A0A087Y680_POEFO Loading...

Docking protein 6

AlphaFold DB , UniProt , Accession A0A087Y680, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 345 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	32.6	Very low	63.6	Low	250 Å²	250	80.1 Å²	80.1	100%	1.232	44%	0.435	S	S	*	.				0	88.2	0	-70.5	-175.3	-161.2	0	0	109.7
2	A	29.5	Very low	65.7	Low	77 Å²	77	74.4 Å²	74.4	64%	0.636	41%	0.409	S	S	*	.			trans	-136.8	75.6	170.2	0	0	0	0	0	108	N4	A2-N4 PolarHBondContact O-N 3.46Å
3	S	38	Very low	67.6	Low	78 Å²	78	72.7 Å²	72.7	55%	0.545	39%	0.393	S	S	.	.			trans	-69	81.9	163.7	30	0	0	0	0	107	F5	S3-F5 WeakPolarHBondContact O-CD2 3.37Å; S3-F5 WeakPolarHBondContact O-CE2 3.43Å; S3-F5 WeakPolarHBondContact O-CG 3.34Å; S3-F5 PolarHBondContact O-N 3.17Å
4	N	50.6	Low	69.1	Low	50 Å²	50	67.5 Å²	67.5	27%	0.267	37%	0.365	S	S	.	.			trans	-58.1	101.5	-178.5	-75	-29	0	0	0	110	A2 K37	A2-N4 PolarHBondContact O-N 3.46Å; N4-K37 PolarHBondContact O-NZ 3.1Å
5	F	54.4	Low	70.4	Confident	107 Å²	107	71.9 Å²	71.9	47%	0.469	37%	0.374	S	S	.	.			trans	-97.9	8.4	175	-66.7	-71.9	0	0	0	113	S3 D7 I8	S3-F5 WeakPolarHBondContact O-CD2 3.37Å; S3-F5 WeakPolarHBondContact O-CE2 3.43Å; S3-F5 WeakPolarHBondContact O-CG 3.34Å; S3-F5 PolarHBondContact O-N 3.17Å; F5-D7 PolarHBondContact O-N 3.29Å; F5-I8 HydrophobicContact CD1-CD1 3.68Å; F5-I8 HydrophobicContact CE1-CD1 4.42Å; F5-I8 PolarHBondContact O-N 3.06Å; F5-I8 VanDerWaalsContact O-N 3.12Å
6	N	63.2	Low	71.5	Confident	110 Å²	110	69.5 Å²	69.5	59%	0.588	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-14.9	-174.5	-84.9	-21.6	0	0	0	115	K33	N6-K33 WeakPolarHBondContact O-CE 3.35Å
7	D	79.6	Confident	72.2	Confident	3 Å²	3	74.2 Å²	74.2	2%	0.016	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-7.3	179.1	62.6	-42.7	0	0	0	114.2	F5 K32 K33 S35 K37 R41	F5-D7 PolarHBondContact O-N 3.29Å; D7-K32 CarbonylContact O-C 3.55Å; D7-K32 WeakPolarHBondContact O-CA 3.48Å; D7-K32 WeakPolarHBondContact O-CB 3.21Å; D7-K32 WeakPolarHBondContact OD2-CD 3.39Å; D7-K33 WeakPolarHBondContact O-CG 3.35Å; D7-K33 PolarHBondContact O-N 2.97Å; D7-S35 WeakPolarHBondContact CB-OG 3.34Å; D7-K37 IonicContact OD1-NZ 2.66Å; D7-K37 PolarHBondContact OD1-NZ 3.24Å; D7-K37 IonicContact OD2-NZ 2.68Å; D7-R41 IonicContact OD2-NH2 2.81Å; D7-R41 PolarHBondContact OD2-NH2 3.17Å
8	I	85.9	Confident	72.5	Confident	42 Å²	42	72.2 Å²	72.2	22%	0.215	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	121.5	179.5	-58.3	-177.7	0	0	0	110.3	F5 Q11 V30 K32	F5-I8 HydrophobicContact CD1-CD1 3.68Å; F5-I8 HydrophobicContact CE1-CD1 4.42Å; F5-I8 PolarHBondContact O-N 3.06Å; F5-I8 VanDerWaalsContact O-N 3.12Å; I8-Q11 HydrophobicContact CG2-CB 4.38Å; I8-Q11 HydrophobicContact CG2-CG 4.41Å; I8-V30 HydrophobicContact CB-CG1 4.49Å; I8-V30 HydrophobicContact CD1-CG1 3.95Å; I8-V30 HydrophobicContact CG1-CG1 3.96Å; I8-V30 HydrophobicContact CG2-CG1 3.86Å; I8-K32 HydrophobicContact CG1-CG 4.16Å
9	V	86	Confident	72.4	Confident	39 Å²	39	79.6 Å²	79.6	24%	0.236	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	-46.3	176.1	178.6	0	0	0	0	110.7	F31 K33 L106 E110	V9-F31 HydrophobicContact CB-CD1 3.68Å; V9-F31 HydrophobicContact CB-CE1 3.98Å; V9-F31 HydrophobicContact CB-CG 4.37Å; V9-F31 HydrophobicContact CG1-CD1 3.8Å; V9-F31 HydrophobicContact CG1-CE1 3.86Å; V9-F31 HydrophobicContact CG2-CD1 4.31Å; V9-F31 HydrophobicContact CG2-CE1 4.22Å; V9-F31 PolarHBondContact N-O 3.18Å; V9-K33 HydrophobicContact CG2-CB 3.62Å; V9-K33 HydrophobicContact CG2-CD 4.33Å; V9-K33 HydrophobicContact CG2-CG 3.93Å; V9-L106 HydrophobicContact CG1-CB 4.14Å; V9-L106 HydrophobicContact CG1-CD1 4.18Å; V9-L106 HydrophobicContact CG1-CD2 3.98Å; V9-L106 HydrophobicContact CG1-CG 4.33Å; V9-E110 HydrophobicContact CG1-CG 4.29Å; V9-E110 HydrophobicContact CG2-CG 4.3Å
10	K	89.1	Confident	72.4	Confident	30 Å²	30	85.8 Å²	85.8	13%	0.13	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	146.8	176.2	-172.5	165.6	168.5	84.3	0	110.5	F31 D99 E102 W103 L106	K10-F31 PolarHBondContact N-O 2.74Å; K10-F31 PolarHBondContact O-N 3.2Å; K10-D99 WeakPolarHBondContact CE-OD1 3.28Å; K10-D99 IonicContact NZ-OD1 2.86Å; K10-D99 PolarHBondContact NZ-OD1 3.19Å; K10-E102 HydrophobicContact CD-CB 4.49Å; K10-E102 IonicContact NZ-OE2 2.73Å; K10-E102 PolarHBondContact NZ-OE2 2.82Å; K10-W103 HydrophobicContact CB-CH2 4.24Å; K10-W103 HydrophobicContact CB-CZ2 4.47Å; K10-W103 HydrophobicContact CB-CZ3 4.33Å; K10-W103 HydrophobicContact CD-CD2 3.81Å; K10-W103 HydrophobicContact CD-CE3 4.3Å; K10-W103 HydrophobicContact CD-CG 4.06Å; K10-W103 HydrophobicContact CD-CZ2 4.25Å; K10-W103 VanDerWaalsContact CE-CE2 3.48Å; K10-W103 HydrophobicContact CG-CD2 4.28Å; K10-W103 HydrophobicContact CG-CH2 4.13Å; K10-W103 HydrophobicContact CG-CZ2 3.85Å; K10-W103 HydrophobicContact CG-CZ3 4.47Å; K10-L106 HydrophobicContact CB-CD1 3.81Å; K10-L106 HydrophobicContact CD-CD1 3.56Å; K10-L106 HydrophobicContact CG-CD1 4.24Å
11	Q	90.2	Very high	72.3	Confident	95 Å²	95	87.9 Å²	87.9	44%	0.444	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	148.8	172.6	58.9	-178.5	-6.7	0	0	110.4	I8 W28 L29 V30	I8-Q11 HydrophobicContact CG2-CB 4.38Å; I8-Q11 HydrophobicContact CG2-CG 4.41Å; Q11-W28 HydrophobicContact CB-CZ2 3.86Å; Q11-W28 HydrophobicContact CG-CZ2 3.71Å; Q11-L29 VanDerWaalsContact CA-O 3.24Å; Q11-L29 WeakPolarHBondContact CA-O 3.43Å; Q11-V30 HydrophobicContact CB-CB 4.42Å; Q11-V30 HydrophobicContact CB-CG1 4.28Å; Q11-V30 HydrophobicContact CB-CG2 4.04Å
12	G	89.6	Confident	74.3	Confident	12 Å²	12	77.5 Å²	77.5	12%	0.124	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.1	173.5	179	0	0	0	0	0	113.9	L29	G12-L29 PolarHBondContact N-O 2.73Å; G12-L29 PolarHBondContact O-N 3.22Å
13	Y	89.6	Confident	76.8	Confident	52 Å²	52	79.3 Å²	79.3	20%	0.204	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	129.5	175	-75.5	-74.4	0	0	0	111.2	R26 C27 W28 E48 E95	Y13-R26 HydrophobicContact CD1-CG 3.94Å; Y13-R26 VanDerWaalsContact CD2-NH2 3.3Å; Y13-R26 VanDerWaalsContact CG-CZ 3.5Å; Y13-R26 VanDerWaalsContact CG-NH2 3.34Å; Y13-C27 WeakPolarHBondContact CA-O 3.32Å; Y13-W28 HydrophobicContact CD1-CE3 4.01Å; Y13-W28 AromaticContact CD2-CE3 3.59Å; Y13-W28 HydrophobicContact CD2-CE3 3.59Å; Y13-W28 AromaticContact CD2-CZ3 3.5Å; Y13-W28 HydrophobicContact CD2-CZ3 3.5Å; Y13-W28 AromaticContact CE1-CE3 3.97Å; Y13-W28 HydrophobicContact CE1-CE3 3.97Å; Y13-W28 AromaticContact CE2-CE3 3.52Å; Y13-W28 HydrophobicContact CE2-CE3 3.52Å; Y13-W28 AromaticContact CE2-CZ3 3.44Å; Y13-W28 HydrophobicContact CE2-CZ3 3.44Å; Y13-W28 VanDerWaalsContact CE2-CZ3 3.44Å; Y13-W28 AromaticContact CG-CE3 3.83Å; Y13-W28 HydrophobicContact CG-CE3 3.83Å; Y13-W28 HydrophobicContact CG-CZ3 4.17Å; Y13-W28 AromaticContact CZ-CE3 3.7Å; Y13-E48 WeakPolarHBondContact OH-CB 3.4Å; Y13-E95 VanDerWaalsContact CB-OE1 3.27Å; Y13-E95 WeakPolarHBondContact CB-OE1 3.16Å
14	V	89.8	Confident	78.9	Confident	0 Å²	0	79.6 Å²	79.6	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	161.2	174.9	-58.6	0	0	0	0	110.1	I16 R26 C27 L29 F92 A93 W103	V14-I16 HydrophobicContact CG2-CD1 4.14Å; V14-I16 HydrophobicContact CG2-CG1 4.08Å; V14-R26 WeakPolarHBondContact O-CA 3.38Å; V14-C27 PolarHBondContact N-O 3.49Å; V14-C27 PolarHBondContact O-N 3.22Å; V14-C27 VanDerWaalsContact O-O 3.12Å; V14-C27 PolarHBondContact O-SG 3.2Å; V14-C27 VanDerWaalsContact O-SG 3.41Å; V14-L29 HydrophobicContact CG1-CB 4.38Å; V14-L29 HydrophobicContact CG1-CD2 4.47Å; V14-L29 HydrophobicContact CG2-CB 3.54Å; V14-L29 HydrophobicContact CG2-CD2 3.96Å; V14-L29 HydrophobicContact CG2-CG 4.3Å; V14-F92 HydrophobicContact CB-CB 4.34Å; V14-F92 HydrophobicContact CB-CD2 4.09Å; V14-F92 HydrophobicContact CG1-CD2 3.84Å; V14-F92 HydrophobicContact CG1-CE2 4.31Å; V14-F92 HydrophobicContact CG2-CB 4.28Å; V14-A93 CarbonylContact C-O 3.52Å; V14-A93 WeakPolarHBondContact CA-O 3.02Å; V14-W103 HydrophobicContact CG1-CZ2 4.37Å
15	R	87.9	Confident	80.6	Confident	133 Å²	133	85.4 Å²	85.4	50%	0.502	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	121.1	175.2	-63.1	179.9	70.2	-174.6	2.8	109.8	F24 R25 F92 A93	R15-F24 HydrophobicContact CB-CD1 4.42Å; R15-R25 WeakPolarHBondContact CA-O 3.31Å; R15-F92 WeakPolarHBondContact O-CA 3.49Å; R15-A93 HydrophobicContact CB-CB 4.33Å; R15-A93 PolarHBondContact N-O 2.9Å; R15-A93 PolarHBondContact O-N 2.77Å
16	I	88.3	Confident	82.3	Confident	34 Å²	34	86.5 Å²	86.5	17%	0.174	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	133.8	178.9	-60.9	178.5	0	0	0	109.2	V14 S18 R25 L29 K44 F92	V14-I16 HydrophobicContact CG2-CD1 4.14Å; V14-I16 HydrophobicContact CG2-CG1 4.08Å; I16-S18 PolarHBondContact O-N 3.43Å; I16-R25 PolarHBondContact N-O 3.09Å; I16-R25 PolarHBondContact O-N 3.05Å; I16-L29 HydrophobicContact CD1-CD1 4.44Å; I16-K44 HydrophobicContact CD1-CD 3.99Å; I16-K44 HydrophobicContact CD1-CG 4.45Å; I16-F92 HydrophobicContact CD1-CB 4.34Å; I16-F92 HydrophobicContact CG1-CB 3.75Å
17	R	83.2	Confident	83.5	Confident	149 Å²	149	81.4 Å²	81.4	56%	0.562	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.4	125.3	175.4	-163.9	179.2	-175.6	-169.1	-0.1	110.3	G22 F24	R17-G22 WeakPolarHBondContact CG-O 3.47Å; R17-G22 PolarHBondContact NE-O 2.99Å; R17-F24 HydrophobicContact CB-CD1 4.16Å; R17-F24 HydrophobicContact CB-CE1 3.94Å; R17-F24 HydrophobicContact CB-CZ 4.14Å; R17-F24 HydrophobicContact CG-CD2 4.5Å; R17-F24 HydrophobicContact CG-CE2 4.26Å; R17-F24 HydrophobicContact CG-CZ 4.29Å
18	S	77.3	Confident	84	Confident	39 Å²	39	82.2 Å²	82.2	27%	0.273	38%	0.375	S	S	.	.			trans	-71	128.8	173.6	-178.6	0	0	0	0	110.3	I16 K20 L21 G22 I23	I16-S18 PolarHBondContact O-N 3.43Å; S18-K20 VanDerWaalsContact C-N 3.29Å; S18-K20 PolarHBondContact O-N 3.43Å; S18-K20 PolarHBondContact OG-N 3.49Å; S18-L21 PolarHBondContact OG-N 3.05Å; S18-G22 VanDerWaalsContact O-CA 3.28Å; S18-G22 WeakPolarHBondContact O-CA 3.41Å; S18-G22 PolarHBondContact O-N 3.47Å; S18-I23 PolarHBondContact N-O 3.38Å
19	K	71.8	Confident	84.2	Confident	213 Å²	213	80.5 Å²	80.5	93%	0.926	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-31.3	173.3	-67.6	-168	176.9	-169.5	0	112.4
20	K	72.1	Confident	84.4	Confident	202 Å²	202	78.8 Å²	78.8	88%	0.878	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-37.1	-177.3	-66.5	-173	176.8	-174.6	0	113.3	S18	S18-K20 VanDerWaalsContact C-N 3.29Å; S18-K20 PolarHBondContact O-N 3.43Å; S18-K20 PolarHBondContact OG-N 3.49Å
21	L	70.2	Confident	84.4	Confident	131 Å²	131	77.3 Å²	77.3	69%	0.686	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113	-9.3	-170.9	-65.7	171.4	0	0	0	113.2	S18 I23	S18-L21 PolarHBondContact OG-N 3.05Å; L21-I23 HydrophobicContact CB-CD1 4.32Å; L21-I23 WeakPolarHBondContact O-CG1 3.47Å; L21-I23 PolarHBondContact O-N 2.83Å
22	G	74.1	Confident	84.4	Confident	32 Å²	32	73.4 Å²	73.4	33%	0.33	33%	0.331	S	S	.	.			trans	68.7	-11.3	-176.9	0	0	0	0	0	115.6	R17 S18	R17-G22 WeakPolarHBondContact CG-O 3.47Å; R17-G22 PolarHBondContact NE-O 2.99Å; S18-G22 VanDerWaalsContact O-CA 3.28Å; S18-G22 WeakPolarHBondContact O-CA 3.41Å; S18-G22 PolarHBondContact O-N 3.47Å
23	I	82.9	Confident	84.1	Confident	114 Å²	114	75.4 Å²	75.4	59%	0.585	34%	0.336	S	S	*	.			trans	-82	143.9	-176.8	-60.2	160.2	0	0	0	111.3	S18 L21	S18-I23 PolarHBondContact N-O 3.38Å; L21-I23 HydrophobicContact CB-CD1 4.32Å; L21-I23 WeakPolarHBondContact O-CG1 3.47Å; L21-I23 PolarHBondContact O-N 2.83Å
24	F	82	Confident	83.7	Confident	85 Å²	85	74.3 Å²	74.3	37%	0.373	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	116.9	171.1	-74.1	-93.4	0	0	0	110.8	R15 R17	R15-F24 HydrophobicContact CB-CD1 4.42Å; R17-F24 HydrophobicContact CB-CD1 4.16Å; R17-F24 HydrophobicContact CB-CE1 3.94Å; R17-F24 HydrophobicContact CB-CZ 4.14Å; R17-F24 HydrophobicContact CG-CD2 4.5Å; R17-F24 HydrophobicContact CG-CE2 4.26Å; R17-F24 HydrophobicContact CG-CZ 4.29Å
25	R	86.1	Confident	83.4	Confident	171 Å²	171	74.6 Å²	74.6	65%	0.645	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-106.9	133.3	177.4	-165.9	176	178.8	178.1	0.2	110.1	R15 I16	R15-R25 WeakPolarHBondContact CA-O 3.31Å; I16-R25 PolarHBondContact N-O 3.09Å; I16-R25 PolarHBondContact O-N 3.05Å
26	R	89.2	Confident	82.8	Confident	131 Å²	131	68.4 Å²	68.4	49%	0.494	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	134.2	169.3	-168.7	176.3	-172.8	-131.3	5.3	108.9	Y13 V14 E95	Y13-R26 HydrophobicContact CD1-CG 3.94Å; Y13-R26 VanDerWaalsContact CD2-NH2 3.3Å; Y13-R26 VanDerWaalsContact CG-CZ 3.5Å; Y13-R26 VanDerWaalsContact CG-NH2 3.34Å; V14-R26 WeakPolarHBondContact O-CA 3.38Å; R26-E95 IonicContact CZ-OE1 3.38Å; R26-E95 IonicContact NE-OE1 3.07Å; R26-E95 PolarHBondContact NE-OE1 3.38Å; R26-E95 IonicContact NH2-OE1 2.81Å; R26-E95 PolarHBondContact NH2-OE1 3.44Å
27	C	89.4	Confident	82.2	Confident	2 Å²	2	68.6 Å²	68.6	1%	0.014	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	157.6	-179.8	54.3	0	0	0	0	110	Y13 V14 K44 Y45	Y13-C27 WeakPolarHBondContact CA-O 3.32Å; V14-C27 PolarHBondContact N-O 3.49Å; V14-C27 PolarHBondContact O-N 3.22Å; V14-C27 VanDerWaalsContact O-O 3.12Å; V14-C27 PolarHBondContact O-SG 3.2Å; V14-C27 VanDerWaalsContact O-SG 3.41Å; C27-K44 HydrophobicContact CB-CG 4.17Å; C27-K44 VanDerWaalsContact SG-CE 3.51Å; C27-Y45 VanDerWaalsContact CB-O 3.26Å; C27-Y45 WeakPolarHBondContact CB-O 3.37Å
28	W	90	Very high	81.8	Confident	21 Å²	21	62 Å²	62	8%	0.08	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	124.5	172.9	-172.5	-96.7	0	0	0	109.6	Q11 Y13 Y45 E48 A51	Q11-W28 HydrophobicContact CB-CZ2 3.86Å; Q11-W28 HydrophobicContact CG-CZ2 3.71Å; Y13-W28 HydrophobicContact CD1-CE3 4.01Å; Y13-W28 AromaticContact CD2-CE3 3.59Å; Y13-W28 HydrophobicContact CD2-CE3 3.59Å; Y13-W28 AromaticContact CD2-CZ3 3.5Å; Y13-W28 HydrophobicContact CD2-CZ3 3.5Å; Y13-W28 AromaticContact CE1-CE3 3.97Å; Y13-W28 HydrophobicContact CE1-CE3 3.97Å; Y13-W28 AromaticContact CE2-CE3 3.52Å; Y13-W28 HydrophobicContact CE2-CE3 3.52Å; Y13-W28 AromaticContact CE2-CZ3 3.44Å; Y13-W28 HydrophobicContact CE2-CZ3 3.44Å; Y13-W28 VanDerWaalsContact CE2-CZ3 3.44Å; Y13-W28 AromaticContact CG-CE3 3.83Å; Y13-W28 HydrophobicContact CG-CE3 3.83Å; Y13-W28 HydrophobicContact CG-CZ3 4.17Å; Y13-W28 AromaticContact CZ-CE3 3.7Å; W28-Y45 PolarHBondContact N-O 3.43Å; W28-Y45 PolarHBondContact O-N 2.9Å; W28-E48 HydrophobicContact CD2-CB 4.08Å; W28-E48 HydrophobicContact CD2-CG 4.36Å; W28-E48 HydrophobicContact CE3-CB 4.01Å; W28-E48 HydrophobicContact CE3-CG 4.38Å; W28-E48 HydrophobicContact CH2-CG 4.11Å; W28-E48 HydrophobicContact CZ2-CG 4.1Å; W28-E48 HydrophobicContact CZ3-CB 4.27Å; W28-E48 HydrophobicContact CZ3-CG 4.26Å; W28-A51 HydrophobicContact CG-CB 4.21Å
29	L	90.3	Very high	81.9	Confident	5 Å²	5	63.1 Å²	63.1	3%	0.026	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	131.6	179.7	-170.2	70.9	0	0	0	109.2	Q11 G12 V14 I16 L42 K44 F92 W103	Q11-L29 VanDerWaalsContact CA-O 3.24Å; Q11-L29 WeakPolarHBondContact CA-O 3.43Å; G12-L29 PolarHBondContact N-O 2.73Å; G12-L29 PolarHBondContact O-N 3.22Å; V14-L29 HydrophobicContact CG1-CB 4.38Å; V14-L29 HydrophobicContact CG1-CD2 4.47Å; V14-L29 HydrophobicContact CG2-CB 3.54Å; V14-L29 HydrophobicContact CG2-CD2 3.96Å; V14-L29 HydrophobicContact CG2-CG 4.3Å; I16-L29 HydrophobicContact CD1-CD1 4.44Å; L29-L42 HydrophobicContact CD1-CB 4.15Å; L29-L42 HydrophobicContact CD1-CD2 4.47Å; L29-L42 HydrophobicContact CD2-CD2 4.17Å; L29-L42 HydrophobicContact CG-CD2 4.25Å; L29-K44 HydrophobicContact CD1-CB 4.23Å; L29-F92 HydrophobicContact CD2-CD1 4.24Å; L29-F92 HydrophobicContact CD2-CD2 4.42Å; L29-F92 HydrophobicContact CD2-CE1 4.33Å; L29-F92 HydrophobicContact CD2-CE2 4.49Å; L29-F92 HydrophobicContact CD2-CG 4.28Å; L29-F92 HydrophobicContact CD2-CZ 4.45Å; L29-W103 HydrophobicContact CB-CH2 4.31Å; L29-W103 HydrophobicContact CD2-CH2 4.11Å; L29-W103 HydrophobicContact CD2-CZ3 4.13Å; L29-W103 HydrophobicContact CG-CH2 4.22Å
30	V	89.9	Confident	82.6	Confident	3 Å²	3	57.3 Å²	57.3	2%	0.018	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	119.1	176.5	-173.1	0	0	0	0	108.3	I8 Q11 K32 L42 E43 Y45	I8-V30 HydrophobicContact CB-CG1 4.49Å; I8-V30 HydrophobicContact CD1-CG1 3.95Å; I8-V30 HydrophobicContact CG1-CG1 3.96Å; I8-V30 HydrophobicContact CG2-CG1 3.86Å; Q11-V30 HydrophobicContact CB-CB 4.42Å; Q11-V30 HydrophobicContact CB-CG1 4.28Å; Q11-V30 HydrophobicContact CB-CG2 4.04Å; V30-K32 HydrophobicContact CG1-CD 4.47Å; V30-K32 HydrophobicContact CG1-CG 4Å; V30-L42 WeakPolarHBondContact O-CA 3.48Å; V30-E43 HydrophobicContact CB-CB 4.38Å; V30-E43 PolarHBondContact N-O 3.39Å; V30-E43 PolarHBondContact O-N 3.39Å; V30-Y45 HydrophobicContact CB-CE2 4.47Å; V30-Y45 HydrophobicContact CG2-CD2 4.01Å; V30-Y45 HydrophobicContact CG2-CE2 3.92Å
31	F	89.6	Confident	83.4	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	123.5	170.3	174.7	-138.4	0	0	0	110.4	V9 K10 L42 L62 W103 L107 E110	V9-F31 HydrophobicContact CB-CD1 3.68Å; V9-F31 HydrophobicContact CB-CE1 3.98Å; V9-F31 HydrophobicContact CB-CG 4.37Å; V9-F31 HydrophobicContact CG1-CD1 3.8Å; V9-F31 HydrophobicContact CG1-CE1 3.86Å; V9-F31 HydrophobicContact CG2-CD1 4.31Å; V9-F31 HydrophobicContact CG2-CE1 4.22Å; V9-F31 PolarHBondContact N-O 3.18Å; K10-F31 PolarHBondContact N-O 2.74Å; K10-F31 PolarHBondContact O-N 3.2Å; F31-L42 HydrophobicContact CB-CD2 3.61Å; F31-L42 HydrophobicContact CD2-CD2 3.84Å; F31-L42 HydrophobicContact CG-CD2 4.05Å; F31-L62 HydrophobicContact CD2-CD1 3.98Å; F31-L62 HydrophobicContact CE2-CD1 3.64Å; F31-W103 HydrophobicContact CB-CH2 4.25Å; F31-W103 HydrophobicContact CB-CZ3 3.64Å; F31-L107 HydrophobicContact CD1-CD2 4.13Å; F31-L107 HydrophobicContact CD2-CD2 4.13Å; F31-L107 HydrophobicContact CE1-CD2 4Å; F31-L107 HydrophobicContact CE2-CD2 4.04Å; F31-L107 HydrophobicContact CG-CD2 4.2Å; F31-L107 HydrophobicContact CZ-CD2 3.95Å; F31-E110 HydrophobicContact CE1-CB 3.84Å; F31-E110 HydrophobicContact CE1-CG 3.93Å; F31-E110 HydrophobicContact CZ-CB 3.54Å; F31-E110 HydrophobicContact CZ-CG 4.05Å
32	K	88.3	Confident	84.3	Confident	13 Å²	13	42.3 Å²	42.3	6%	0.057	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	135.2	179.2	-66.3	178.2	172.7	176.9	0	110.8	D7 I8 V30 R40 R41 E43	D7-K32 CarbonylContact O-C 3.55Å; D7-K32 WeakPolarHBondContact O-CA 3.48Å; D7-K32 WeakPolarHBondContact O-CB 3.21Å; D7-K32 WeakPolarHBondContact OD2-CD 3.39Å; I8-K32 HydrophobicContact CG1-CG 4.16Å; V30-K32 HydrophobicContact CG1-CD 4.47Å; V30-K32 HydrophobicContact CG1-CG 4Å; K32-R40 WeakPolarHBondContact O-CA 3.3Å; K32-R41 HydrophobicContact CB-CG 4.24Å; K32-R41 VanDerWaalsContact CD-NH2 3.34Å; K32-R41 PolarHBondContact N-O 3.35Å; K32-R41 PolarHBondContact O-N 2.97Å; K32-E43 WeakPolarHBondContact CD-OE1 3.43Å; K32-E43 VanDerWaalsContact CE-OE2 3.22Å; K32-E43 WeakPolarHBondContact CE-OE2 3.5Å; K32-E43 IonicContact NZ-OE1 2.93Å; K32-E43 PolarHBondContact NZ-OE1 2.93Å; K32-E43 IonicContact NZ-OE2 2.96Å; K32-E43 PolarHBondContact NZ-OE2 3.41Å
33	K	85.1	Confident	85	Confident	54 Å²	54	41.1 Å²	41.1	24%	0.235	19%	0.188	C	C	.	.			trans	-72.6	169.6	169.8	59.2	175.9	179.2	178.8	0	110.5	N6 D7 V9	N6-K33 WeakPolarHBondContact O-CE 3.35Å; D7-K33 WeakPolarHBondContact O-CG 3.35Å; D7-K33 PolarHBondContact O-N 2.97Å; V9-K33 HydrophobicContact CG2-CB 3.62Å; V9-K33 HydrophobicContact CG2-CD 4.33Å; V9-K33 HydrophobicContact CG2-CG 3.93Å
34	A	81.1	Confident	85.2	Confident	29 Å²	29	38.6 Å²	38.6	24%	0.24	17%	0.173	C	C	.	.	S	Bend	trans	-63.7	137.2	172	0	0	0	0	0	109.4	R40	A34-R40 HydrophobicContact CB-CG 4.06Å; A34-R40 VanDerWaalsContact N-CG 3.33Å
35	S	82.9	Confident	85.5	Confident	6 Å²	6	34.9 Å²	34.9	4%	0.042	16%	0.157	C	C	.	.	B	Isolated β-bridge	trans	-154.6	177.2	179.4	57.6	0	0	0	0	109.9	D7 K37 G38 N140	D7-S35 WeakPolarHBondContact CB-OG 3.34Å; S35-K37 PolarHBondContact O-N 3.18Å; S35-K37 PolarHBondContact OG-N 3.01Å; S35-G38 PolarHBondContact N-O 3.49Å; S35-G38 VanDerWaalsContact N-O 3.08Å; S35-G38 PolarHBondContact O-N 3.43Å; S35-G38 VanDerWaalsContact O-O 3.07Å; S35-N140 WeakPolarHBondContact O-CB 3.5Å
36	S	75.8	Confident	85.4	Confident	2 Å²	2	30 Å²	30	1%	0.014	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.7	-28.5	170.6	65.8	0	0	0	0	114.5	G38 E154 Q212	S36-G38 VanDerWaalsContact C-N 3.27Å; S36-G38 PolarHBondContact O-N 3.42Å; S36-E154 VanDerWaalsContact CB-OE2 3.29Å; S36-E154 WeakPolarHBondContact CB-OE2 3.2Å; S36-E154 PolarHBondContact N-OE2 3.17Å; S36-E154 VanDerWaalsContact OG-CD 3.28Å; S36-E154 PolarHBondContact OG-OE1 2.82Å; S36-E154 PolarHBondContact OG-OE2 3.15Å; S36-Q212 WeakPolarHBondContact CB-O 3.42Å
37	K	75.3	Confident	85.3	Confident	39 Å²	39	26.8 Å²	26.8	17%	0.17	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-6	-179.2	-57.7	-179.2	-162.4	151.4	0	113.7	N4 D7 S35 R214	N4-K37 PolarHBondContact O-NZ 3.1Å; D7-K37 IonicContact OD1-NZ 2.66Å; D7-K37 PolarHBondContact OD1-NZ 3.24Å; D7-K37 IonicContact OD2-NZ 2.68Å; S35-K37 PolarHBondContact O-N 3.18Å; S35-K37 PolarHBondContact OG-N 3.01Å; K37-R214 VanDerWaalsContact O-CD 3.32Å; K37-R214 WeakPolarHBondContact O-CD 3.36Å; K37-R214 PolarHBondContact O-NE 2.94Å
38	G	74.8	Confident	85.1	Confident	9 Å²	9	31.6 Å²	31.6	9%	0.093	16%	0.162	C	C	.	.	B	Isolated β-bridge	trans	131.6	-177.8	177.3	0	0	0	0	0	113.9	S35 S36 R41	S35-G38 PolarHBondContact N-O 3.49Å; S35-G38 VanDerWaalsContact N-O 3.08Å; S35-G38 PolarHBondContact O-N 3.43Å; S35-G38 VanDerWaalsContact O-O 3.07Å; S36-G38 VanDerWaalsContact C-N 3.27Å; S36-G38 PolarHBondContact O-N 3.42Å; G38-R41 PolarHBondContact O-NH1 2.85Å
39	P	79.8	Confident	84.8	Confident	64 Å²	64	38 Å²	38	42%	0.416	19%	0.19	S	C	.	.	S	Bend	trans	-67.8	171.2	-172.7	29.1	-36.2	0	0	0	112.5	R41 E61	P39-R41 PolarHBondContact O-N 3.47Å; P39-R41 PolarHBondContact O-NH1 3.48Å; P39-R41 VanDerWaalsContact O-NH1 3.1Å; P39-E61 HydrophobicContact CG-CG 4.41Å
40	R	85.4	Confident	84.3	Confident	90 Å²	90	38.1 Å²	38.1	34%	0.34	19%	0.192	S	C	.	.	S	Bend	trans	-49.9	127	169.2	-77.3	170.8	-88.4	160.7	2.1	109.2	K32 A34 L62 E110 C111	K32-R40 WeakPolarHBondContact O-CA 3.3Å; A34-R40 HydrophobicContact CB-CG 4.06Å; A34-R40 VanDerWaalsContact N-CG 3.33Å; R40-L62 HydrophobicContact CB-CB 4.17Å; R40-L62 WeakPolarHBondContact O-CB 3.34Å; R40-L62 PolarHBondContact O-N 3.16Å; R40-E110 VanDerWaalsContact CD-O 3.24Å; R40-E110 WeakPolarHBondContact CD-O 3.4Å; R40-E110 PolarHBondContact NH1-O 3.32Å; R40-C111 PolarHBondContact NH1-O 3.45Å; R40-C111 VanDerWaalsContact NH1-O 3.15Å
41	R	88.7	Confident	83.7	Confident	10 Å²	10	38.8 Å²	38.8	4%	0.038	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.2	153.3	-173.9	65.4	-169.2	-178.8	-80.4	-4.1	113	D7 K32 G38 P39 E43 I59 T60	D7-R41 IonicContact OD2-NH2 2.81Å; D7-R41 PolarHBondContact OD2-NH2 3.17Å; K32-R41 HydrophobicContact CB-CG 4.24Å; K32-R41 VanDerWaalsContact CD-NH2 3.34Å; K32-R41 PolarHBondContact N-O 3.35Å; K32-R41 PolarHBondContact O-N 2.97Å; G38-R41 PolarHBondContact O-NH1 2.85Å; P39-R41 PolarHBondContact O-N 3.47Å; P39-R41 PolarHBondContact O-NH1 3.48Å; P39-R41 VanDerWaalsContact O-NH1 3.1Å; R41-E43 HydrophobicContact CG-CG 4.33Å; R41-E43 IonicContact CZ-OE1 3.54Å; R41-E43 IonicContact NE-OE1 2.69Å; R41-E43 PolarHBondContact NE-OE1 3.01Å; R41-E43 IonicContact NH2-OE1 3.53Å; R41-E43 PolarHBondContact NH2-OE1 3.06Å; R41-I59 HydrophobicContact CB-CG2 4.07Å; R41-I59 HydrophobicContact CG-CG2 4.38Å; R41-T60 CarbonylContact C-O 3.57Å; R41-T60 VanDerWaalsContact CA-O 3.29Å; R41-T60 WeakPolarHBondContact CA-O 3.47Å; R41-T60 WeakPolarHBondContact CB-O 3.47Å
42	L	88.8	Confident	83.1	Confident	9 Å²	9	46.9 Å²	46.9	5%	0.047	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	121.8	167.8	-68.2	175.4	0	0	0	109.5	L29 V30 F31 I59 T60 L62 I82	L29-L42 HydrophobicContact CD1-CB 4.15Å; L29-L42 HydrophobicContact CD1-CD2 4.47Å; L29-L42 HydrophobicContact CD2-CD2 4.17Å; L29-L42 HydrophobicContact CG-CD2 4.25Å; V30-L42 WeakPolarHBondContact O-CA 3.48Å; F31-L42 HydrophobicContact CB-CD2 3.61Å; F31-L42 HydrophobicContact CD2-CD2 3.84Å; F31-L42 HydrophobicContact CG-CD2 4.05Å; L42-I59 CarbonylContact O-C 3.58Å; L42-T60 PolarHBondContact N-O 2.98Å; L42-T60 PolarHBondContact O-N 2.96Å; L42-L62 HydrophobicContact CD1-CD1 4.31Å; L42-L62 HydrophobicContact CD1-CD2 3.99Å; L42-L62 HydrophobicContact CD2-CD1 4.42Å; L42-L62 HydrophobicContact CG-CD1 3.87Å; L42-L62 HydrophobicContact CG-CD2 4.11Å; L42-L62 HydrophobicContact CG-CG 4.16Å; L42-I82 HydrophobicContact CD1-CD1 3.54Å
43	E	89.6	Confident	82.5	Confident	7 Å²	7	53.5 Å²	53.5	3%	0.033	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	118.6	174.2	-62.1	176.2	-174.8	0	0	108.7	V30 K32 R41 Y45 I59	V30-E43 HydrophobicContact CB-CB 4.38Å; V30-E43 PolarHBondContact N-O 3.39Å; V30-E43 PolarHBondContact O-N 3.39Å; K32-E43 WeakPolarHBondContact CD-OE1 3.43Å; K32-E43 VanDerWaalsContact CE-OE2 3.22Å; K32-E43 WeakPolarHBondContact CE-OE2 3.5Å; K32-E43 IonicContact NZ-OE1 2.93Å; K32-E43 PolarHBondContact NZ-OE1 2.93Å; K32-E43 IonicContact NZ-OE2 2.96Å; K32-E43 PolarHBondContact NZ-OE2 3.41Å; R41-E43 HydrophobicContact CG-CG 4.33Å; R41-E43 IonicContact CZ-OE1 3.54Å; R41-E43 IonicContact NE-OE1 2.69Å; R41-E43 PolarHBondContact NE-OE1 3.01Å; R41-E43 IonicContact NH2-OE1 3.53Å; R41-E43 PolarHBondContact NH2-OE1 3.06Å; E43-Y45 HydrophobicContact CB-CD2 4.36Å; E43-Y45 HydrophobicContact CB-CE2 3.56Å; E43-Y45 PolarHBondContact OE2-OH 3.06Å; E43-I59 HydrophobicContact CG-CG1 4.38Å
44	K	88	Confident	81.8	Confident	61 Å²	61	57 Å²	57	27%	0.265	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	123.1	178	-179.7	-173.3	176.4	170.1	0	110.3	I16 C27 L29 H57 K58	I16-K44 HydrophobicContact CD1-CD 3.99Å; I16-K44 HydrophobicContact CD1-CG 4.45Å; C27-K44 HydrophobicContact CB-CG 4.17Å; C27-K44 VanDerWaalsContact SG-CE 3.51Å; L29-K44 HydrophobicContact CD1-CB 4.23Å; K44-H57 WeakPolarHBondContact O-CA 3.33Å; K44-K58 HydrophobicContact CB-CB 4.38Å; K44-K58 PolarHBondContact N-O 3.02Å; K44-K58 PolarHBondContact O-N 3.42Å
45	Y	87.4	Confident	80.7	Confident	6 Å²	6	58 Å²	58	2%	0.024	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	151.4	175.8	-63.4	-89	0	0	0	110.9	C27 W28 V30 E43 D47 A50 A51 H57	C27-Y45 VanDerWaalsContact CB-O 3.26Å; C27-Y45 WeakPolarHBondContact CB-O 3.37Å; W28-Y45 PolarHBondContact N-O 3.43Å; W28-Y45 PolarHBondContact O-N 2.9Å; V30-Y45 HydrophobicContact CB-CE2 4.47Å; V30-Y45 HydrophobicContact CG2-CD2 4.01Å; V30-Y45 HydrophobicContact CG2-CE2 3.92Å; E43-Y45 HydrophobicContact CB-CD2 4.36Å; E43-Y45 HydrophobicContact CB-CE2 3.56Å; E43-Y45 PolarHBondContact OE2-OH 3.06Å; Y45-D47 VanDerWaalsContact C-N 3.33Å; Y45-A50 HydrophobicContact CD1-CB 4.3Å; Y45-A50 WeakPolarHBondContact CD1-O 3.39Å; Y45-A51 VanDerWaalsContact CD1-CA 3.44Å; Y45-A51 HydrophobicContact CD1-CB 4.04Å; Y45-A51 HydrophobicContact CD2-CB 3.69Å; Y45-A51 HydrophobicContact CE1-CB 4.4Å; Y45-A51 HydrophobicContact CE2-CB 4.09Å; Y45-A51 HydrophobicContact CG-CB 3.66Å; Y45-H57 HydrophobicContact CD1-CB 3.64Å; Y45-H57 HydrophobicContact CD2-CB 4.49Å; Y45-H57 HydrophobicContact CE1-CB 3.29Å; Y45-H57 AromaticContact CE1-CG 3.76Å; Y45-H57 HydrophobicContact CE2-CB 4.2Å; Y45-H57 HydrophobicContact CG-CB 4.23Å; Y45-H57 AromaticContact CZ-CG 3.77Å
46	P	85.1	Confident	79.4	Confident	69 Å²	69	67.6 Å²	67.6	45%	0.448	32%	0.317	S	S	.	.	S	Bend	trans	-63.1	-41.2	174.6	25.2	-32.4	0	0	0	111.8	A50	P46-A50 HydrophobicContact CG-CB 3.68Å
47	D	85.6	Confident	79.3	Confident	63 Å²	63	70.7 Å²	70.7	34%	0.337	33%	0.331	S	S	.	.	S	Bend	trans	-147.8	172.2	-178.3	64	-7.9	0	0	0	111.5	Y45 K49 A50 A51	Y45-D47 VanDerWaalsContact C-N 3.33Å; D47-K49 VanDerWaalsContact C-N 3.31Å; D47-K49 PolarHBondContact O-N 2.94Å; D47-A50 PolarHBondContact O-N 3.09Å; D47-A50 WeakPolarHBondContact OD1-CA 3.3Å; D47-A50 WeakPolarHBondContact OD1-CB 3.38Å; D47-A50 PolarHBondContact OD1-N 3.37Å; D47-A51 PolarHBondContact O-N 3.23Å
48	E	86	Confident	79.5	Confident	104 Å²	104	75.7 Å²	75.7	49%	0.486	35%	0.353	S	S	.	.	H	α-helix	trans	-64.6	-35	178.3	-176.5	178.8	-178.5	0	0	112.3	Y13 W28 A51 Y52	Y13-E48 WeakPolarHBondContact OH-CB 3.4Å; W28-E48 HydrophobicContact CD2-CB 4.08Å; W28-E48 HydrophobicContact CD2-CG 4.36Å; W28-E48 HydrophobicContact CE3-CB 4.01Å; W28-E48 HydrophobicContact CE3-CG 4.38Å; W28-E48 HydrophobicContact CH2-CG 4.11Å; W28-E48 HydrophobicContact CZ2-CG 4.1Å; W28-E48 HydrophobicContact CZ3-CB 4.27Å; W28-E48 HydrophobicContact CZ3-CG 4.26Å; E48-A51 WeakPolarHBondContact O-CB 3.34Å; E48-A51 PolarHBondContact O-N 3.22Å; E48-A51 VanDerWaalsContact O-N 3.17Å; E48-Y52 PolarHBondContact O-N 3.4Å
49	K	82.6	Confident	80	Confident	155 Å²	155	78.4 Å²	78.4	67%	0.674	37%	0.365	S	S	*	.	H	α-helix	trans	-64.6	-44.2	177.3	-67.9	-176	179.8	-179.6	0	111.4	D47 A51 Y52 F53	D47-K49 VanDerWaalsContact C-N 3.31Å; D47-K49 PolarHBondContact O-N 2.94Å; K49-A51 PolarHBondContact O-N 3.3Å; K49-Y52 WeakPolarHBondContact O-CB 3.39Å; K49-Y52 PolarHBondContact O-N 3.09Å; K49-Y52 VanDerWaalsContact O-N 3.16Å; K49-F53 WeakPolarHBondContact O-CD2 3.4Å; K49-F53 PolarHBondContact O-N 3.11Å
50	A	81.2	Confident	80.2	Confident	8 Å²	8	76.5 Å²	76.5	7%	0.066	35%	0.352	C	S	.	.	H	α-helix	trans	-63.6	-31.6	174	0	0	0	0	0	112.4	Y45 P46 D47 R54 S55	Y45-A50 HydrophobicContact CD1-CB 4.3Å; Y45-A50 WeakPolarHBondContact CD1-O 3.39Å; P46-A50 HydrophobicContact CG-CB 3.68Å; D47-A50 PolarHBondContact O-N 3.09Å; D47-A50 WeakPolarHBondContact OD1-CA 3.3Å; D47-A50 WeakPolarHBondContact OD1-CB 3.38Å; D47-A50 PolarHBondContact OD1-N 3.37Å; A50-R54 WeakPolarHBondContact O-CA 3.33Å; A50-R54 PolarHBondContact O-N 2.98Å; A50-S55 PolarHBondContact O-N 3.42Å; A50-S55 VanDerWaalsContact O-N 3.09Å
51	A	77.8	Confident	80.1	Confident	16 Å²	16	76.9 Å²	76.9	13%	0.132	36%	0.358	C	S	.	.	H	α-helix	trans	-65.3	-41.6	173.1	0	0	0	0	0	112	W28 Y45 D47 E48 K49 R54	W28-A51 HydrophobicContact CG-CB 4.21Å; Y45-A51 VanDerWaalsContact CD1-CA 3.44Å; Y45-A51 HydrophobicContact CD1-CB 4.04Å; Y45-A51 HydrophobicContact CD2-CB 3.69Å; Y45-A51 HydrophobicContact CE1-CB 4.4Å; Y45-A51 HydrophobicContact CE2-CB 4.09Å; Y45-A51 HydrophobicContact CG-CB 3.66Å; D47-A51 PolarHBondContact O-N 3.23Å; E48-A51 WeakPolarHBondContact O-CB 3.34Å; E48-A51 PolarHBondContact O-N 3.22Å; E48-A51 VanDerWaalsContact O-N 3.17Å; K49-A51 PolarHBondContact O-N 3.3Å; A51-R54 PolarHBondContact O-N 3.47Å
52	Y	76.3	Confident	79.7	Confident	171 Å²	171	76.8 Å²	76.8	67%	0.671	36%	0.358	S	S	*	.	H	α-helix	trans	-62.6	-47	175.6	-174.1	-96.8	0	0	0	112.1	E48 K49 R54	E48-Y52 PolarHBondContact O-N 3.4Å; K49-Y52 WeakPolarHBondContact O-CB 3.39Å; K49-Y52 PolarHBondContact O-N 3.09Å; K49-Y52 VanDerWaalsContact O-N 3.16Å; Y52-R54 VanDerWaalsContact C-N 3.25Å; Y52-R54 PolarHBondContact O-N 3.02Å
53	F	75.8	Confident	78.8	Confident	152 Å²	152	81.3 Å²	81.3	67%	0.667	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-0.8	178.8	-67.8	-69.7	0	0	0	114.1	K49 S55	K49-F53 WeakPolarHBondContact O-CD2 3.4Å; K49-F53 PolarHBondContact O-N 3.11Å; F53-S55 PolarHBondContact O-N 3.45Å
54	R	70.9	Confident	77.9	Confident	126 Å²	126	86.6 Å²	86.6	48%	0.475	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.1	26.3	-175.8	-57.3	-177.8	-179	179.2	2	113.9	A50 A51 Y52	A50-R54 WeakPolarHBondContact O-CA 3.33Å; A50-R54 PolarHBondContact O-N 2.98Å; A51-R54 PolarHBondContact O-N 3.47Å; Y52-R54 VanDerWaalsContact C-N 3.25Å; Y52-R54 PolarHBondContact O-N 3.02Å
55	S	57	Low	77.5	Confident	52 Å²	52	84.7 Å²	84.7	36%	0.364	40%	0.399	S	S	.	.			trans	-79.5	133.5	-177.6	60.6	0	0	0	0	110.7	A50 F53	A50-S55 PolarHBondContact O-N 3.42Å; A50-S55 VanDerWaalsContact O-N 3.09Å; F53-S55 PolarHBondContact O-N 3.45Å
56	F	55.6	Low	77	Confident	207 Å²	207	90 Å²	90	91%	0.908	42%	0.423	S	S	*	.	S	Bend	trans	32	89.2	173.9	-67.2	-81	0	0	0	115.8
57	H	73.9	Confident	76.7	Confident	66 Å²	66	90.1 Å²	90.1	31%	0.306	42%	0.42	S	S	.	.			trans	-123.7	144	-178.2	63.1	-75.6	0	0	0	112.2	K44 Y45 I59	K44-H57 WeakPolarHBondContact O-CA 3.33Å; Y45-H57 HydrophobicContact CD1-CB 3.64Å; Y45-H57 HydrophobicContact CD2-CB 4.49Å; Y45-H57 HydrophobicContact CE1-CB 3.29Å; Y45-H57 AromaticContact CE1-CG 3.76Å; Y45-H57 HydrophobicContact CE2-CB 4.2Å; Y45-H57 HydrophobicContact CG-CB 4.23Å; Y45-H57 AromaticContact CZ-CG 3.77Å; H57-I59 WeakPolarHBondContact CD2-CG1 3.47Å; H57-I59 WeakPolarHBondContact NE2-CD1 3.35Å; H57-I59 VanDerWaalsContact NE2-CG1 3.34Å; H57-I59 WeakPolarHBondContact NE2-CG1 3.22Å
58	K	80.1	Confident	76.7	Confident	144 Å²	144	87.4 Å²	87.4	63%	0.626	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.3	110	173	-177.5	169.7	-176.7	164.9	0	108.6	K44	K44-K58 HydrophobicContact CB-CB 4.38Å; K44-K58 PolarHBondContact N-O 3.02Å; K44-K58 PolarHBondContact O-N 3.42Å
59	I	84.3	Confident	76.6	Confident	67 Å²	67	84.4 Å²	84.4	34%	0.344	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	133.5	173	-53.1	175.4	0	0	0	108.7	R41 L42 E43 H57 E61	R41-I59 HydrophobicContact CB-CG2 4.07Å; R41-I59 HydrophobicContact CG-CG2 4.38Å; L42-I59 CarbonylContact O-C 3.58Å; E43-I59 HydrophobicContact CG-CG1 4.38Å; H57-I59 WeakPolarHBondContact CD2-CG1 3.47Å; H57-I59 WeakPolarHBondContact NE2-CD1 3.35Å; H57-I59 VanDerWaalsContact NE2-CG1 3.34Å; H57-I59 WeakPolarHBondContact NE2-CG1 3.22Å; I59-E61 HydrophobicContact CG2-CG 4.38Å
60	T	84	Confident	76.7	Confident	23 Å²	23	80.6 Å²	80.6	14%	0.141	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	111.1	163.7	-67.5	0	0	0	0	107.2	R41 L42 L62 F84 K90	R41-T60 CarbonylContact C-O 3.57Å; R41-T60 VanDerWaalsContact CA-O 3.29Å; R41-T60 WeakPolarHBondContact CA-O 3.47Å; R41-T60 WeakPolarHBondContact CB-O 3.47Å; L42-T60 PolarHBondContact N-O 2.98Å; L42-T60 PolarHBondContact O-N 2.96Å; T60-L62 HydrophobicContact CG2-CD2 4.21Å; T60-F84 HydrophobicContact CG2-CZ 4.13Å; T60-K90 HydrophobicContact CG2-CD 3.56Å; T60-K90 VanDerWaalsContact CG2-NZ 3.28Å; T60-K90 PolarHBondContact OG1-NZ 3.05Å; T60-K90 VanDerWaalsContact OG1-NZ 3.1Å
61	E	83.1	Confident	76.5	Confident	99 Å²	99	82.8 Å²	82.8	46%	0.463	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	136.5	172.1	-63.7	178.3	179	0	0	109.8	P39 I59	P39-E61 HydrophobicContact CG-CG 4.41Å; I59-E61 HydrophobicContact CG2-CG 4.38Å
62	L	80.2	Confident	75.9	Confident	7 Å²	7	85.3 Å²	85.3	4%	0.037	40%	0.4	C	S	.	.			trans	-101.9	64.9	179.2	-66.4	-169.5	0	0	0	108.9	F31 R40 L42 T60 I65 I82 F84 L107	F31-L62 HydrophobicContact CD2-CD1 3.98Å; F31-L62 HydrophobicContact CE2-CD1 3.64Å; R40-L62 HydrophobicContact CB-CB 4.17Å; R40-L62 WeakPolarHBondContact O-CB 3.34Å; R40-L62 PolarHBondContact O-N 3.16Å; L42-L62 HydrophobicContact CD1-CD1 4.31Å; L42-L62 HydrophobicContact CD1-CD2 3.99Å; L42-L62 HydrophobicContact CD2-CD1 4.42Å; L42-L62 HydrophobicContact CG-CD1 3.87Å; L42-L62 HydrophobicContact CG-CD2 4.11Å; L42-L62 HydrophobicContact CG-CG 4.16Å; T60-L62 HydrophobicContact CG2-CD2 4.21Å; L62-I65 HydrophobicContact CB-CD1 3.67Å; L62-I65 HydrophobicContact CB-CG1 4.49Å; L62-I65 HydrophobicContact CD1-CD1 4.02Å; L62-I65 HydrophobicContact CD2-CD1 4.06Å; L62-I65 HydrophobicContact CG-CD1 4.11Å; L62-I82 HydrophobicContact CD2-CD1 4.36Å; L62-F84 HydrophobicContact CD2-CE1 3.95Å; L62-F84 HydrophobicContact CD2-CZ 3.8Å; L62-L107 HydrophobicContact CD1-CD2 3.99Å
63	H	71.2	Confident	75.2	Confident	105 Å²	105	85 Å²	85	49%	0.486	40%	0.398	S	S	.	.			trans	-91.9	146.5	168.8	62	-91	0	0	0	109.4	I65	H63-I65 PolarHBondContact O-N 2.91Å
64	N	70.2	Confident	74.2	Confident	118 Å²	118	86 Å²	86	63%	0.631	41%	0.405	S	S	*	.	S	Bend	trans	50.8	53.7	171.7	-55.7	-14.6	0	0	0	114.2	K66 C85	N64-K66 PolarHBondContact O-N 3.04Å; N64-C85 HydrophobicContact CB-CB 4.05Å; N64-C85 PolarHBondContact O-N 3.17Å; N64-C85 PolarHBondContact O-SG 2.83Å
65	I	78.8	Confident	73.8	Confident	20 Å²	20	84.6 Å²	84.6	10%	0.103	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	124.1	172.9	-67	168.6	0	0	0	108.6	L62 H63 V68 I82 F84 C111 L112	L62-I65 HydrophobicContact CB-CD1 3.67Å; L62-I65 HydrophobicContact CB-CG1 4.49Å; L62-I65 HydrophobicContact CD1-CD1 4.02Å; L62-I65 HydrophobicContact CD2-CD1 4.06Å; L62-I65 HydrophobicContact CG-CD1 4.11Å; H63-I65 PolarHBondContact O-N 2.91Å; I65-V68 HydrophobicContact CG2-CG2 3.82Å; I65-I82 HydrophobicContact CD1-CG2 3.92Å; I65-I82 HydrophobicContact CG1-CG2 3.95Å; I65-I82 HydrophobicContact CG2-CG2 4.04Å; I65-F84 HydrophobicContact CG1-CD1 4.29Å; I65-F84 HydrophobicContact CG1-CE1 4.26Å; I65-C111 HydrophobicContact CB-CB 4.24Å; I65-C111 HydrophobicContact CD1-CB 3.43Å; I65-C111 VanDerWaalsContact CD1-CB 3.43Å; I65-C111 WeakPolarHBondContact CD1-SG 3.39Å; I65-C111 HydrophobicContact CG1-CB 4.41Å; I65-C111 HydrophobicContact CG2-CB 4.42Å; I65-L112 HydrophobicContact CG2-CD2 4.09Å; I65-L112 WeakPolarHBondContact O-CD2 3.28Å
66	K	77.4	Confident	74.1	Confident	119 Å²	119	86 Å²	86	52%	0.517	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	-45.7	177.2	-175.9	175.5	-179.7	173.1	0	111.1	N64 I83 D87	N64-K66 PolarHBondContact O-N 3.04Å; K66-I83 HydrophobicContact CB-CG2 4.37Å; K66-I83 WeakPolarHBondContact CB-O 3.13Å; K66-I83 HydrophobicContact CD-CG2 4.32Å; K66-I83 PolarHBondContact N-O 3.02Å; K66-D87 IonicContact NZ-OD1 3Å; K66-D87 PolarHBondContact NZ-OD1 3.26Å
67	N	79.3	Confident	74.7	Confident	71 Å²	71	83.8 Å²	83.8	38%	0.38	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	156.1	-179.8	-161.3	3.1	0	0	0	111.6	T69 I83	N67-T69 HydrophobicContact CB-CG2 4.49Å; N67-T69 VanDerWaalsContact ND2-CG2 3.3Å; N67-T69 WeakPolarHBondContact ND2-CG2 3.4Å; N67-I83 HydrophobicContact CB-CD1 4.48Å; N67-I83 PolarHBondContact N-O 3.31Å; N67-I83 PolarHBondContact O-N 3.43Å
68	V	84.9	Confident	75	Confident	6 Å²	6	83.5 Å²	83.5	4%	0.036	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	119.7	169.9	-176.9	0	0	0	0	107.8	I65 V80 A81 I82 L107	I65-V68 HydrophobicContact CG2-CG2 3.82Å; V68-V80 HydrophobicContact CG1-CG1 3.92Å; V68-A81 WeakPolarHBondContact CA-O 3.36Å; V68-I82 HydrophobicContact CG1-CG1 4.46Å; V68-I82 HydrophobicContact CG2-CG1 4.48Å; V68-I82 HydrophobicContact CG2-CG2 4.48Å; V68-L107 HydrophobicContact CG1-CB 3.9Å; V68-L107 HydrophobicContact CG1-CD1 4.22Å; V68-L107 HydrophobicContact CG2-CB 4.14Å
69	T	84.6	Confident	75.2	Confident	41 Å²	41	76.7 Å²	76.7	25%	0.252	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	144.9	-172.1	57.2	0	0	0	0	111.9	N67 A81 I83	N67-T69 HydrophobicContact CB-CG2 4.49Å; N67-T69 VanDerWaalsContact ND2-CG2 3.3Å; N67-T69 WeakPolarHBondContact ND2-CG2 3.4Å; T69-A81 PolarHBondContact N-O 3.45Å; T69-A81 PolarHBondContact O-N 3.05Å; T69-I83 HydrophobicContact CG2-CD1 4.5Å
70	R	83.8	Confident	75.3	Confident	74 Å²	74	73.5 Å²	73.5	28%	0.279	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	134.9	166.9	-65.3	-83.1	-108.2	153.9	-8.4	108.9	E97 E101 C104	R70-E97 PolarHBondContact NH2-O 3.21Å; R70-E101 IonicContact CZ-OE1 3.85Å; R70-E101 VanDerWaalsContact NH2-CD 3.3Å; R70-E101 IonicContact NH2-OE1 2.8Å; R70-E101 PolarHBondContact NH2-OE1 2.78Å; R70-C104 HydrophobicContact CG-CB 4.24Å
71	M	76.6	Confident	75.4	Confident	55 Å²	55	72.6 Å²	72.6	27%	0.271	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-80	144.8	172.8	-63.8	-62.8	-59.5	0	0	110.2	K76 A79 A81 T91	M71-K76 HydrophobicContact CB-CB 4.37Å; M71-A79 HydrophobicContact CB-CB 3.89Å; M71-A79 HydrophobicContact CG-CB 3.88Å; M71-A79 PolarHBondContact N-O 3.49Å; M71-A81 HydrophobicContact CG-CB 4.24Å; M71-A81 HydrophobicContact SD-CB 3.84Å; M71-T91 HydrophobicContact CG-CG2 4.15Å
72	P	65.8	Low	75.7	Confident	69 Å²	69	67.9 Å²	67.9	45%	0.448	33%	0.325	S	S	.	.	P	Polyproline II helix	trans	-58.8	141.7	179	-23.6	32.9	0	0	0	113	E74 T75 K76	P72-E74 PolarHBondContact O-N 3.39Å; P72-T75 PolarHBondContact O-N 3.05Å; P72-T75 VanDerWaalsContact O-N 3.15Å; P72-T75 PolarHBondContact O-OG1 3.39Å; P72-K76 PolarHBondContact O-N 3.43Å
73	R	61.6	Low	75.9	Confident	165 Å²	165	69.9 Å²	69.9	62%	0.623	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-27.1	-177.3	-69	-175.5	-179.2	172	6.8	112.5	T75 E97	R73-T75 VanDerWaalsContact C-N 3.35Å; R73-T75 PolarHBondContact O-N 3.49Å; R73-E97 IonicContact CZ-OE1 3.48Å; R73-E97 IonicContact CZ-OE2 3.96Å; R73-E97 IonicContact NE-OE1 3.27Å; R73-E97 PolarHBondContact NE-OE1 2.91Å; R73-E97 IonicContact NE-OE2 3.49Å; R73-E97 IonicContact NH2-OE1 3.19Å; R73-E97 PolarHBondContact NH2-OE1 2.95Å; R73-E97 IonicContact NH2-OE2 3.99Å; R73-E97 PolarHBondContact NH2-OE2 3.16Å
74	E	56	Low	76.5	Confident	173 Å²	173	65.3 Å²	65.3	81%	0.808	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-27	179	-62.8	86.1	-166.5	0	0	113.7	P72	P72-E74 PolarHBondContact O-N 3.39Å
75	T	60.9	Low	76.9	Confident	96 Å²	96	63.3 Å²	63.3	59%	0.589	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.1	-37.8	-170.9	61.4	0	0	0	0	113.3	P72 R73	P72-T75 PolarHBondContact O-N 3.05Å; P72-T75 VanDerWaalsContact O-N 3.15Å; P72-T75 PolarHBondContact O-OG1 3.39Å; R73-T75 VanDerWaalsContact C-N 3.35Å; R73-T75 PolarHBondContact O-N 3.49Å
76	K	64.1	Low	77	Confident	80 Å²	80	67.3 Å²	67.3	35%	0.348	33%	0.33	S	S	.	.	S	Bend	trans	-150.5	99.7	-179.1	-64.3	-177.3	-174.4	164.7	0	110.7	M71 P72 H78 A79	M71-K76 HydrophobicContact CB-CB 4.37Å; P72-K76 PolarHBondContact O-N 3.43Å; K76-H78 PolarHBondContact O-N 3.33Å; K76-A79 HydrophobicContact CB-CB 3.69Å; K76-A79 HydrophobicContact CD-CB 4.43Å; K76-A79 PolarHBondContact O-N 3.28Å
77	K	67.6	Low	76.9	Confident	162 Å²	162	67.2 Å²	67.2	70%	0.704	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	120.5	178.4	-62.1	-173.8	179.4	-175.8	0	110.8	A79	K77-A79 PolarHBondContact O-N 3.22Å
78	H	79.8	Confident	77.2	Confident	59 Å²	59	66.9 Å²	66.9	27%	0.273	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.3	31.2	173.7	-35.5	-56.2	0	0	0	115.7	K76 C94 A100	K76-H78 PolarHBondContact O-N 3.33Å; H78-C94 PolarHBondContact O-N 3.05Å; H78-A100 HydrophobicContact CB-CB 4.21Å; H78-A100 WeakPolarHBondContact O-CB 3.31Å
79	A	84.5	Confident	77.1	Confident	2 Å²	2	70 Å²	70	2%	0.017	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	139.3	178.6	0	0	0	0	0	114	M71 K76 K77 T91 F92 A93	M71-A79 HydrophobicContact CB-CB 3.89Å; M71-A79 HydrophobicContact CG-CB 3.88Å; M71-A79 PolarHBondContact N-O 3.49Å; K76-A79 HydrophobicContact CB-CB 3.69Å; K76-A79 HydrophobicContact CD-CB 4.43Å; K76-A79 PolarHBondContact O-N 3.28Å; K77-A79 PolarHBondContact O-N 3.22Å; A79-T91 HydrophobicContact CB-CG2 3.97Å; A79-F92 CarbonylContact C-O 3.59Å; A79-F92 VanDerWaalsContact CA-O 3.3Å; A79-F92 WeakPolarHBondContact CA-O 3.43Å; A79-A93 HydrophobicContact CB-CB 4.29Å
80	V	86.7	Confident	77.2	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	129.9	173.5	-177.7	0	0	0	0	108.2	V68 T91 F92 A100 W103 C104 L107	V68-V80 HydrophobicContact CG1-CG1 3.92Å; V80-T91 VanDerWaalsContact O-CA 3.29Å; V80-T91 WeakPolarHBondContact O-CA 3.45Å; V80-T91 WeakPolarHBondContact O-CG2 3.36Å; V80-F92 HydrophobicContact CB-CD2 4.45Å; V80-F92 HydrophobicContact CB-CE1 4.17Å; V80-F92 HydrophobicContact CB-CE2 3.91Å; V80-F92 HydrophobicContact CB-CZ 3.76Å; V80-F92 HydrophobicContact CG1-CE1 4.22Å; V80-F92 HydrophobicContact CG1-CZ 3.91Å; V80-F92 HydrophobicContact CG2-CE2 4.2Å; V80-F92 HydrophobicContact CG2-CZ 4.38Å; V80-F92 PolarHBondContact N-O 3.14Å; V80-F92 PolarHBondContact O-N 3.44Å; V80-A100 HydrophobicContact CG2-CB 3.86Å; V80-A100 WeakPolarHBondContact CG2-O 3.46Å; V80-W103 HydrophobicContact CG2-CB 4.35Å; V80-C104 HydrophobicContact CG1-CB 4.29Å; V80-C104 HydrophobicContact CG2-CB 4.38Å; V80-L107 HydrophobicContact CG1-CD1 4.16Å
81	A	87.1	Confident	77.4	Confident	4 Å²	4	70.2 Å²	70.2	3%	0.033	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	129.6	177.2	0	0	0	0	0	110.5	V68 T69 M71 K90 T91	V68-A81 WeakPolarHBondContact CA-O 3.36Å; T69-A81 PolarHBondContact N-O 3.45Å; T69-A81 PolarHBondContact O-N 3.05Å; M71-A81 HydrophobicContact CG-CB 4.24Å; M71-A81 HydrophobicContact SD-CB 3.84Å; A81-K90 WeakPolarHBondContact CA-O 3.47Å; A81-T91 HydrophobicContact CB-CG2 4.23Å
82	I	87.9	Confident	78	Confident	0 Å²	0	68 Å²	68	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	122.6	171.3	-56.8	170.1	0	0	0	106.6	L42 L62 I65 V68 F84 S89 K90 F92 L107	L42-I82 HydrophobicContact CD1-CD1 3.54Å; L62-I82 HydrophobicContact CD2-CD1 4.36Å; I65-I82 HydrophobicContact CD1-CG2 3.92Å; I65-I82 HydrophobicContact CG1-CG2 3.95Å; I65-I82 HydrophobicContact CG2-CG2 4.04Å; V68-I82 HydrophobicContact CG1-CG1 4.46Å; V68-I82 HydrophobicContact CG2-CG1 4.48Å; V68-I82 HydrophobicContact CG2-CG2 4.48Å; I82-F84 HydrophobicContact CB-CE2 4.49Å; I82-F84 HydrophobicContact CG2-CE2 4.03Å; I82-F84 HydrophobicContact CG2-CZ 4.02Å; I82-S89 CarbonylContact O-C 3.52Å; I82-S89 WeakPolarHBondContact O-CA 3.4Å; I82-K90 PolarHBondContact N-O 3.4Å; I82-K90 PolarHBondContact O-N 2.71Å; I82-F92 HydrophobicContact CD1-CE1 4.07Å; I82-F92 HydrophobicContact CG1-CE1 4.45Å; I82-L107 HydrophobicContact CD1-CD1 3.86Å; I82-L107 HydrophobicContact CD1-CD2 4.09Å; I82-L107 HydrophobicContact CG1-CD1 4.05Å
83	I	84.3	Confident	79.1	Confident	48 Å²	48	65.4 Å²	65.4	25%	0.246	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	121.4	179.6	-54.7	172.5	0	0	0	107.3	K66 N67 T69	K66-I83 HydrophobicContact CB-CG2 4.37Å; K66-I83 WeakPolarHBondContact CB-O 3.13Å; K66-I83 HydrophobicContact CD-CG2 4.32Å; K66-I83 PolarHBondContact N-O 3.02Å; N67-I83 HydrophobicContact CB-CD1 4.48Å; N67-I83 PolarHBondContact N-O 3.31Å; N67-I83 PolarHBondContact O-N 3.43Å; T69-I83 HydrophobicContact CG2-CD1 4.5Å
84	F	84	Confident	80.4	Confident	9 Å²	9	57.9 Å²	57.9	4%	0.039	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	161.9	178.1	-64.8	-90.2	0	0	0	110.1	T60 L62 I65 I82 D86 D87 T88 K90	T60-F84 HydrophobicContact CG2-CZ 4.13Å; L62-F84 HydrophobicContact CD2-CE1 3.95Å; L62-F84 HydrophobicContact CD2-CZ 3.8Å; I65-F84 HydrophobicContact CG1-CD1 4.29Å; I65-F84 HydrophobicContact CG1-CE1 4.26Å; I82-F84 HydrophobicContact CB-CE2 4.49Å; I82-F84 HydrophobicContact CG2-CE2 4.03Å; I82-F84 HydrophobicContact CG2-CZ 4.02Å; F84-D86 WeakPolarHBondContact CB-OD1 3.35Å; F84-D86 PolarHBondContact O-N 2.79Å; F84-D87 PolarHBondContact O-N 3.31Å; F84-T88 WeakPolarHBondContact CD2-O 3.48Å; F84-T88 WeakPolarHBondContact CD2-OG1 3.31Å; F84-T88 PolarHBondContact N-O 2.87Å; F84-K90 HydrophobicContact CE2-CB 4.14Å; F84-K90 HydrophobicContact CE2-CD 3.65Å; F84-K90 HydrophobicContact CE2-CG 3.79Å; F84-K90 HydrophobicContact CZ-CD 3.88Å
85	C	78.7	Confident	81.7	Confident	77 Å²	77	55.3 Å²	55.3	52%	0.52	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-16.4	177.1	-69.6	0	0	0	0	113.6	N64 D87	N64-C85 HydrophobicContact CB-CB 4.05Å; N64-C85 PolarHBondContact O-N 3.17Å; N64-C85 PolarHBondContact O-SG 2.83Å; C85-D87 PolarHBondContact O-N 3.43Å
86	D	81.3	Confident	82.9	Confident	103 Å²	103	53.2 Å²	53.2	55%	0.551	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	14.5	172.8	69	-9.6	0	0	0	112.9	F84 T88	F84-D86 WeakPolarHBondContact CB-OD1 3.35Å; F84-D86 PolarHBondContact O-N 2.79Å; D86-T88 VanDerWaalsContact CG-CG2 3.45Å; D86-T88 VanDerWaalsContact CG-OG1 3.26Å; D86-T88 PolarHBondContact O-N 3.33Å; D86-T88 VanDerWaalsContact OD1-CB 3.23Å; D86-T88 WeakPolarHBondContact OD1-CB 3.15Å; D86-T88 WeakPolarHBondContact OD1-CG2 3.27Å; D86-T88 PolarHBondContact OD1-N 3.27Å; D86-T88 PolarHBondContact OD1-OG1 3Å; D86-T88 VanDerWaalsContact OD2-CG2 3.23Å; D86-T88 WeakPolarHBondContact OD2-CG2 3.37Å; D86-T88 PolarHBondContact OD2-OG1 2.75Å
87	D	76.4	Confident	83.8	Confident	118 Å²	118	52.2 Å²	52.2	63%	0.631	28%	0.281	S	S	*	.	S	Bend	trans	55.4	10.8	-172.1	-69.8	-31.8	0	0	0	114.5	K66 F84 C85	K66-D87 IonicContact NZ-OD1 3Å; K66-D87 PolarHBondContact NZ-OD1 3.26Å; F84-D87 PolarHBondContact O-N 3.31Å; C85-D87 PolarHBondContact O-N 3.43Å
88	T	84.2	Confident	84.7	Confident	63 Å²	63	50.3 Å²	50.3	39%	0.387	28%	0.278	S	S	.	.			trans	-74.9	148.7	168.2	73.6	0	0	0	0	109.8	F84 D86	F84-T88 WeakPolarHBondContact CD2-O 3.48Å; F84-T88 WeakPolarHBondContact CD2-OG1 3.31Å; F84-T88 PolarHBondContact N-O 2.87Å; D86-T88 VanDerWaalsContact CG-CG2 3.45Å; D86-T88 VanDerWaalsContact CG-OG1 3.26Å; D86-T88 PolarHBondContact O-N 3.33Å; D86-T88 VanDerWaalsContact OD1-CB 3.23Å; D86-T88 WeakPolarHBondContact OD1-CB 3.15Å; D86-T88 WeakPolarHBondContact OD1-CG2 3.27Å; D86-T88 PolarHBondContact OD1-N 3.27Å; D86-T88 PolarHBondContact OD1-OG1 3Å; D86-T88 VanDerWaalsContact OD2-CG2 3.23Å; D86-T88 WeakPolarHBondContact OD2-CG2 3.37Å; D86-T88 PolarHBondContact OD2-OG1 2.75Å
89	S	83.7	Confident	85.1	Confident	72 Å²	72	49 Å²	49	50%	0.503	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	144.7	173.6	61.6	0	0	0	0	111.8	I82	I82-S89 CarbonylContact O-C 3.52Å; I82-S89 WeakPolarHBondContact O-CA 3.4Å
90	K	86	Confident	85.2	Confident	79 Å²	79	48.9 Å²	48.9	34%	0.343	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	122.4	171.7	-71	176.2	-160.9	-112	0	108.8	T60 A81 I82 F84	T60-K90 HydrophobicContact CG2-CD 3.56Å; T60-K90 VanDerWaalsContact CG2-NZ 3.28Å; T60-K90 PolarHBondContact OG1-NZ 3.05Å; T60-K90 VanDerWaalsContact OG1-NZ 3.1Å; A81-K90 WeakPolarHBondContact CA-O 3.47Å; I82-K90 PolarHBondContact N-O 3.4Å; I82-K90 PolarHBondContact O-N 2.71Å; F84-K90 HydrophobicContact CE2-CB 4.14Å; F84-K90 HydrophobicContact CE2-CD 3.65Å; F84-K90 HydrophobicContact CE2-CG 3.79Å; F84-K90 HydrophobicContact CZ-CD 3.88Å
91	T	87.9	Confident	85.1	Confident	41 Å²	41	53.2 Å²	53.2	25%	0.252	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	136.8	179.3	-42.8	0	0	0	0	110.2	M71 A79 V80 A81	M71-T91 HydrophobicContact CG-CG2 4.15Å; A79-T91 HydrophobicContact CB-CG2 3.97Å; V80-T91 VanDerWaalsContact O-CA 3.29Å; V80-T91 WeakPolarHBondContact O-CA 3.45Å; V80-T91 WeakPolarHBondContact O-CG2 3.36Å; A81-T91 HydrophobicContact CB-CG2 4.23Å
92	F	89.4	Confident	85.2	Confident	7 Å²	7	57.9 Å²	57.9	3%	0.031	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	152	169.3	60.2	-90.3	0	0	0	109.4	V14 R15 I16 L29 A79 V80 I82 W103 L107	V14-F92 HydrophobicContact CB-CB 4.34Å; V14-F92 HydrophobicContact CB-CD2 4.09Å; V14-F92 HydrophobicContact CG1-CD2 3.84Å; V14-F92 HydrophobicContact CG1-CE2 4.31Å; V14-F92 HydrophobicContact CG2-CB 4.28Å; R15-F92 WeakPolarHBondContact O-CA 3.49Å; I16-F92 HydrophobicContact CD1-CB 4.34Å; I16-F92 HydrophobicContact CG1-CB 3.75Å; L29-F92 HydrophobicContact CD2-CD1 4.24Å; L29-F92 HydrophobicContact CD2-CD2 4.42Å; L29-F92 HydrophobicContact CD2-CE1 4.33Å; L29-F92 HydrophobicContact CD2-CE2 4.49Å; L29-F92 HydrophobicContact CD2-CG 4.28Å; L29-F92 HydrophobicContact CD2-CZ 4.45Å; A79-F92 CarbonylContact C-O 3.59Å; A79-F92 VanDerWaalsContact CA-O 3.3Å; A79-F92 WeakPolarHBondContact CA-O 3.43Å; V80-F92 HydrophobicContact CB-CD2 4.45Å; V80-F92 HydrophobicContact CB-CE1 4.17Å; V80-F92 HydrophobicContact CB-CE2 3.91Å; V80-F92 HydrophobicContact CB-CZ 3.76Å; V80-F92 HydrophobicContact CG1-CE1 4.22Å; V80-F92 HydrophobicContact CG1-CZ 3.91Å; V80-F92 HydrophobicContact CG2-CE2 4.2Å; V80-F92 HydrophobicContact CG2-CZ 4.38Å; V80-F92 PolarHBondContact N-O 3.14Å; V80-F92 PolarHBondContact O-N 3.44Å; I82-F92 HydrophobicContact CD1-CE1 4.07Å; I82-F92 HydrophobicContact CG1-CE1 4.45Å; F92-W103 HydrophobicContact CE2-CB 4.06Å; F92-W103 AromaticContact CE2-CD2 3.97Å; F92-W103 HydrophobicContact CE2-CD2 3.97Å; F92-W103 HydrophobicContact CE2-CE3 4.21Å; F92-W103 AromaticContact CE2-CG 3.9Å; F92-W103 HydrophobicContact CE2-CG 3.9Å; F92-W103 HydrophobicContact CZ-CB 4.19Å; F92-W103 HydrophobicContact CZ-CD2 4.21Å; F92-W103 HydrophobicContact CZ-CE3 4.01Å; F92-W103 HydrophobicContact CZ-CG 4.3Å; F92-L107 HydrophobicContact CE1-CD1 4.02Å; F92-L107 HydrophobicContact CZ-CD1 3.78Å
93	A	89.2	Confident	85.2	Confident	15 Å²	15	57.9 Å²	57.9	12%	0.124	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	132.2	176.7	0	0	0	0	0	110.3	V14 R15 A79	V14-A93 CarbonylContact C-O 3.52Å; V14-A93 WeakPolarHBondContact CA-O 3.02Å; R15-A93 HydrophobicContact CB-CB 4.33Å; R15-A93 PolarHBondContact N-O 2.9Å; R15-A93 PolarHBondContact O-N 2.77Å; A79-A93 HydrophobicContact CB-CB 4.29Å
94	C	88	Confident	85.4	Confident	8 Å²	8	56.3 Å²	56.3	5%	0.054	31%	0.306	C	S	.	.			trans	-92	170	179.2	-53.4	0	0	0	0	111.5	H78 D99 A100	H78-C94 PolarHBondContact O-N 3.05Å; C94-D99 HydrophobicContact CB-CB 4.27Å; C94-D99 WeakPolarHBondContact CB-OD2 3.29Å; C94-A100 HydrophobicContact CB-CB 3.65Å; C94-A100 VanDerWaalsContact SG-CA 3.59Å; C94-A100 VanDerWaalsContact SG-CB 3.6Å
95	E	84.7	Confident	85.4	Confident	118 Å²	118	61.9 Å²	61.9	55%	0.551	33%	0.331	S	S	*	.	S	Bend	trans	-78.5	-27.9	-177.2	-65.2	-174.8	167.4	0	0	112.6	Y13 R26	Y13-E95 VanDerWaalsContact CB-OE1 3.27Å; Y13-E95 WeakPolarHBondContact CB-OE1 3.16Å; R26-E95 IonicContact CZ-OE1 3.38Å; R26-E95 IonicContact NE-OE1 3.07Å; R26-E95 PolarHBondContact NE-OE1 3.38Å; R26-E95 IonicContact NH2-OE1 2.81Å; R26-E95 PolarHBondContact NH2-OE1 3.44Å
96	S	85.1	Confident	85.8	Confident	52 Å²	52	60.8 Å²	60.8	36%	0.364	32%	0.319	S	S	.	.	S	Bend	trans	-135.5	163.2	178.2	76	0	0	0	0	112.4	D99 A100	S96-D99 VanDerWaalsContact OG-CB 3.24Å; S96-D99 WeakPolarHBondContact OG-CB 3.23Å; S96-D99 PolarHBondContact OG-N 2.78Å; S96-A100 PolarHBondContact O-N 2.71Å; S96-A100 VanDerWaalsContact O-N 3.15Å
97	E	83.9	Confident	86	Confident	60 Å²	60	55.9 Å²	55.9	28%	0.28	29%	0.293	S	S	.	.	H	α-helix	trans	-62.3	-47	174.5	175.4	144	-123.9	0	0	112.2	R70 R73 D99 A100 E101	R70-E97 PolarHBondContact NH2-O 3.21Å; R73-E97 IonicContact CZ-OE1 3.48Å; R73-E97 IonicContact CZ-OE2 3.96Å; R73-E97 IonicContact NE-OE1 3.27Å; R73-E97 PolarHBondContact NE-OE1 2.91Å; R73-E97 IonicContact NE-OE2 3.49Å; R73-E97 IonicContact NH2-OE1 3.19Å; R73-E97 PolarHBondContact NH2-OE1 2.95Å; R73-E97 IonicContact NH2-OE2 3.99Å; R73-E97 PolarHBondContact NH2-OE2 3.16Å; E97-D99 VanDerWaalsContact C-N 3.34Å; E97-D99 PolarHBondContact O-N 3.38Å; E97-A100 PolarHBondContact O-N 3.03Å; E97-E101 PolarHBondContact O-N 3Å
98	L	85.3	Confident	86.2	Confident	121 Å²	121	51.3 Å²	51.3	63%	0.634	27%	0.27	S	S	*	.	H	α-helix	trans	-59.4	-44.2	177.6	-66.6	173.2	0	0	0	111.3	A100 E101 E102	L98-A100 PolarHBondContact O-N 3Å; L98-E101 WeakPolarHBondContact O-CA 3.47Å; L98-E101 VanDerWaalsContact O-CB 3.23Å; L98-E101 WeakPolarHBondContact O-CB 3.3Å; L98-E101 PolarHBondContact O-N 2.91Å; L98-E101 VanDerWaalsContact O-N 3.11Å; L98-E102 PolarHBondContact O-N 3.5Å
99	D	88.1	Confident	86.1	Confident	31 Å²	31	51.2 Å²	51.2	17%	0.166	27%	0.269	C	S	.	.	H	α-helix	trans	-63.6	-43.7	179.8	-174.2	51.1	0	0	0	111.3	K10 C94 S96 E97 E101 E102 W103	K10-D99 WeakPolarHBondContact CE-OD1 3.28Å; K10-D99 IonicContact NZ-OD1 2.86Å; K10-D99 PolarHBondContact NZ-OD1 3.19Å; C94-D99 HydrophobicContact CB-CB 4.27Å; C94-D99 WeakPolarHBondContact CB-OD2 3.29Å; S96-D99 VanDerWaalsContact OG-CB 3.24Å; S96-D99 WeakPolarHBondContact OG-CB 3.23Å; S96-D99 PolarHBondContact OG-N 2.78Å; E97-D99 VanDerWaalsContact C-N 3.34Å; E97-D99 PolarHBondContact O-N 3.38Å; D99-E101 VanDerWaalsContact C-N 3.25Å; D99-E101 PolarHBondContact O-N 3.05Å; D99-E102 PolarHBondContact O-N 3.16Å; D99-W103 PolarHBondContact O-N 3Å; D99-W103 PolarHBondContact OD2-NE1 2.89Å
100	A	86.4	Confident	85.9	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-67.8	-25.8	176	0	0	0	0	0	113.2	H78 V80 C94 S96 E97 L98 C104	H78-A100 HydrophobicContact CB-CB 4.21Å; H78-A100 WeakPolarHBondContact O-CB 3.31Å; V80-A100 HydrophobicContact CG2-CB 3.86Å; V80-A100 WeakPolarHBondContact CG2-O 3.46Å; C94-A100 HydrophobicContact CB-CB 3.65Å; C94-A100 VanDerWaalsContact SG-CA 3.59Å; C94-A100 VanDerWaalsContact SG-CB 3.6Å; S96-A100 PolarHBondContact O-N 2.71Å; S96-A100 VanDerWaalsContact O-N 3.15Å; E97-A100 PolarHBondContact O-N 3.03Å; L98-A100 PolarHBondContact O-N 3Å; A100-C104 VanDerWaalsContact O-CB 3.28Å; A100-C104 WeakPolarHBondContact O-CB 3.47Å; A100-C104 PolarHBondContact O-N 2.81Å
101	E	85.8	Confident	85.5	Confident	91 Å²	91	47.9 Å²	47.9	43%	0.425	25%	0.249	S	C	.	.	H	α-helix	trans	-67.8	-46.7	171.1	-124.6	147.4	-114.2	0	0	111.1	R70 E97 L98 D99 C104 K105	R70-E101 IonicContact CZ-OE1 3.85Å; R70-E101 VanDerWaalsContact NH2-CD 3.3Å; R70-E101 IonicContact NH2-OE1 2.8Å; R70-E101 PolarHBondContact NH2-OE1 2.78Å; E97-E101 PolarHBondContact O-N 3Å; L98-E101 WeakPolarHBondContact O-CA 3.47Å; L98-E101 VanDerWaalsContact O-CB 3.23Å; L98-E101 WeakPolarHBondContact O-CB 3.3Å; L98-E101 PolarHBondContact O-N 2.91Å; L98-E101 VanDerWaalsContact O-N 3.11Å; D99-E101 VanDerWaalsContact C-N 3.25Å; D99-E101 PolarHBondContact O-N 3.05Å; E101-C104 PolarHBondContact O-N 2.84Å; E101-K105 VanDerWaalsContact O-CB 3.27Å; E101-K105 WeakPolarHBondContact O-CB 3.24Å; E101-K105 PolarHBondContact O-N 2.95Å
102	E	88.1	Confident	84.7	Confident	102 Å²	102	48.6 Å²	48.6	48%	0.477	25%	0.251	S	S	.	.	H	α-helix	trans	-61.7	-46.6	175	-70.9	-177.7	169.1	0	0	111.9	K10 L98 D99 C104 K105 L106	K10-E102 HydrophobicContact CD-CB 4.49Å; K10-E102 IonicContact NZ-OE2 2.73Å; K10-E102 PolarHBondContact NZ-OE2 2.82Å; L98-E102 PolarHBondContact O-N 3.5Å; D99-E102 PolarHBondContact O-N 3.16Å; E102-C104 VanDerWaalsContact C-N 3.34Å; E102-C104 PolarHBondContact O-N 3.41Å; E102-K105 PolarHBondContact O-N 2.85Å; E102-L106 WeakPolarHBondContact O-CB 3.36Å; E102-L106 VanDerWaalsContact O-CG 3.28Å; E102-L106 WeakPolarHBondContact O-CG 3.34Å; E102-L106 PolarHBondContact O-N 2.84Å
103	W	89.6	Confident	83.3	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-57	-47.9	175.5	-85.4	107.3	0	0	0	111.5	K10 V14 L29 F31 V80 F92 D99 L107	K10-W103 HydrophobicContact CB-CH2 4.24Å; K10-W103 HydrophobicContact CB-CZ2 4.47Å; K10-W103 HydrophobicContact CB-CZ3 4.33Å; K10-W103 HydrophobicContact CD-CD2 3.81Å; K10-W103 HydrophobicContact CD-CE3 4.3Å; K10-W103 HydrophobicContact CD-CG 4.06Å; K10-W103 HydrophobicContact CD-CZ2 4.25Å; K10-W103 VanDerWaalsContact CE-CE2 3.48Å; K10-W103 HydrophobicContact CG-CD2 4.28Å; K10-W103 HydrophobicContact CG-CH2 4.13Å; K10-W103 HydrophobicContact CG-CZ2 3.85Å; K10-W103 HydrophobicContact CG-CZ3 4.47Å; V14-W103 HydrophobicContact CG1-CZ2 4.37Å; L29-W103 HydrophobicContact CB-CH2 4.31Å; L29-W103 HydrophobicContact CD2-CH2 4.11Å; L29-W103 HydrophobicContact CD2-CZ3 4.13Å; L29-W103 HydrophobicContact CG-CH2 4.22Å; F31-W103 HydrophobicContact CB-CH2 4.25Å; F31-W103 HydrophobicContact CB-CZ3 3.64Å; V80-W103 HydrophobicContact CG2-CB 4.35Å; F92-W103 HydrophobicContact CE2-CB 4.06Å; F92-W103 AromaticContact CE2-CD2 3.97Å; F92-W103 HydrophobicContact CE2-CD2 3.97Å; F92-W103 HydrophobicContact CE2-CE3 4.21Å; F92-W103 AromaticContact CE2-CG 3.9Å; F92-W103 HydrophobicContact CE2-CG 3.9Å; F92-W103 HydrophobicContact CZ-CB 4.19Å; F92-W103 HydrophobicContact CZ-CD2 4.21Å; F92-W103 HydrophobicContact CZ-CE3 4.01Å; F92-W103 HydrophobicContact CZ-CG 4.3Å; D99-W103 PolarHBondContact O-N 3Å; D99-W103 PolarHBondContact OD2-NE1 2.89Å; W103-L107 VanDerWaalsContact O-CB 3.29Å; W103-L107 WeakPolarHBondContact O-CB 3.37Å; W103-L107 WeakPolarHBondContact O-CD1 3.44Å; W103-L107 VanDerWaalsContact O-CG 3.22Å; W103-L107 WeakPolarHBondContact O-CG 3.3Å; W103-L107 PolarHBondContact O-N 2.73Å
104	C	86.8	Confident	81.5	Confident	15 Å²	15	53.7 Å²	53.7	10%	0.101	29%	0.293	C	S	.	.	H	α-helix	trans	-63.5	-46.3	179.1	-166.8	0	0	0	0	111.3	R70 V80 A100 E101 E102 L106 L107 C108	R70-C104 HydrophobicContact CG-CB 4.24Å; V80-C104 HydrophobicContact CG1-CB 4.29Å; V80-C104 HydrophobicContact CG2-CB 4.38Å; A100-C104 VanDerWaalsContact O-CB 3.28Å; A100-C104 WeakPolarHBondContact O-CB 3.47Å; A100-C104 PolarHBondContact O-N 2.81Å; E101-C104 PolarHBondContact O-N 2.84Å; E102-C104 VanDerWaalsContact C-N 3.34Å; E102-C104 PolarHBondContact O-N 3.41Å; C104-L106 PolarHBondContact O-N 3.22Å; C104-L107 PolarHBondContact O-N 3.3Å; C104-C108 WeakPolarHBondContact O-CB 3.41Å; C104-C108 PolarHBondContact O-N 2.86Å; C104-C108 PolarHBondContact O-SG 3.5Å
105	K	85.6	Confident	79.5	Confident	126 Å²	126	64.5 Å²	64.5	55%	0.548	33%	0.333	S	S	.	.	H	α-helix	trans	-58.1	-50.2	178.8	-176.7	-179.4	179.1	-179.2	0	111.6	E101 E102 C108 V109 L116	E101-K105 VanDerWaalsContact O-CB 3.27Å; E101-K105 WeakPolarHBondContact O-CB 3.24Å; E101-K105 PolarHBondContact O-N 2.95Å; E102-K105 PolarHBondContact O-N 2.85Å; K105-C108 PolarHBondContact O-N 2.82Å; K105-V109 VanDerWaalsContact O-CG2 3.31Å; K105-V109 WeakPolarHBondContact O-CG2 3.3Å; K105-V109 PolarHBondContact O-N 2.84Å; K105-L116 HydrophobicContact CD-CD1 4.43Å; K105-L116 HydrophobicContact CG-CD1 4.05Å
106	L	85.8	Confident	77.4	Confident	54 Å²	54	63.5 Å²	63.5	28%	0.283	33%	0.331	S	S	.	.	H	α-helix	trans	-66	-41.4	-178.8	-69.6	170.3	0	0	0	111.8	V9 K10 E102 C104 V109 E110	V9-L106 HydrophobicContact CG1-CB 4.14Å; V9-L106 HydrophobicContact CG1-CD1 4.18Å; V9-L106 HydrophobicContact CG1-CD2 3.98Å; V9-L106 HydrophobicContact CG1-CG 4.33Å; K10-L106 HydrophobicContact CB-CD1 3.81Å; K10-L106 HydrophobicContact CD-CD1 3.56Å; K10-L106 HydrophobicContact CG-CD1 4.24Å; E102-L106 WeakPolarHBondContact O-CB 3.36Å; E102-L106 VanDerWaalsContact O-CG 3.28Å; E102-L106 WeakPolarHBondContact O-CG 3.34Å; E102-L106 PolarHBondContact O-N 2.84Å; C104-L106 PolarHBondContact O-N 3.22Å; L106-V109 PolarHBondContact O-N 3.23Å; L106-E110 VanDerWaalsContact O-CB 3.3Å; L106-E110 WeakPolarHBondContact O-CB 3.5Å; L106-E110 WeakPolarHBondContact O-CG 3.25Å; L106-E110 PolarHBondContact O-N 2.92Å
107	L	85.6	Confident	75.3	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-63.5	-41.7	175.2	-75.6	167.8	0	0	0	111.6	F31 L62 V68 V80 I82 F92 W103 C104 C111	F31-L107 HydrophobicContact CD1-CD2 4.13Å; F31-L107 HydrophobicContact CD2-CD2 4.13Å; F31-L107 HydrophobicContact CE1-CD2 4Å; F31-L107 HydrophobicContact CE2-CD2 4.04Å; F31-L107 HydrophobicContact CG-CD2 4.2Å; F31-L107 HydrophobicContact CZ-CD2 3.95Å; L62-L107 HydrophobicContact CD1-CD2 3.99Å; V68-L107 HydrophobicContact CG1-CB 3.9Å; V68-L107 HydrophobicContact CG1-CD1 4.22Å; V68-L107 HydrophobicContact CG2-CB 4.14Å; V80-L107 HydrophobicContact CG1-CD1 4.16Å; I82-L107 HydrophobicContact CD1-CD1 3.86Å; I82-L107 HydrophobicContact CD1-CD2 4.09Å; I82-L107 HydrophobicContact CG1-CD1 4.05Å; F92-L107 HydrophobicContact CE1-CD1 4.02Å; F92-L107 HydrophobicContact CZ-CD1 3.78Å; W103-L107 VanDerWaalsContact O-CB 3.29Å; W103-L107 WeakPolarHBondContact O-CB 3.37Å; W103-L107 WeakPolarHBondContact O-CD1 3.44Å; W103-L107 VanDerWaalsContact O-CG 3.22Å; W103-L107 WeakPolarHBondContact O-CG 3.3Å; W103-L107 PolarHBondContact O-N 2.73Å; C104-L107 PolarHBondContact O-N 3.3Å; L107-C111 WeakPolarHBondContact O-CA 3.15Å; L107-C111 WeakPolarHBondContact O-CB 3.36Å; L107-C111 PolarHBondContact O-N 3.24Å; L107-C111 PolarHBondContact O-SG 2.8Å
108	C	81.9	Confident	73	Confident	22 Å²	22	72.7 Å²	72.7	15%	0.149	38%	0.378	C	S	.	.	H	α-helix	trans	-62.2	-51.4	175.5	-69.4	0	0	0	0	111.8	C104 K105 E110 L112	C104-C108 WeakPolarHBondContact O-CB 3.41Å; C104-C108 PolarHBondContact O-N 2.86Å; C104-C108 PolarHBondContact O-SG 3.5Å; K105-C108 PolarHBondContact O-N 2.82Å; C108-E110 PolarHBondContact O-N 2.9Å; C108-L112 HydrophobicContact CB-CD1 4.48Å; C108-L112 WeakPolarHBondContact O-CA 3.41Å; C108-L112 VanDerWaalsContact O-CB 3.3Å; C108-L112 WeakPolarHBondContact O-CB 3.24Å; C108-L112 PolarHBondContact O-N 2.98Å
109	V	81.1	Confident	71	Confident	61 Å²	61	73.8 Å²	73.8	37%	0.37	38%	0.383	S	S	.	.	H	α-helix	trans	-59.5	-49	-178.1	170.4	0	0	0	0	111.1	K105 L106 G113 L116	K105-V109 VanDerWaalsContact O-CG2 3.31Å; K105-V109 WeakPolarHBondContact O-CG2 3.3Å; K105-V109 PolarHBondContact O-N 2.84Å; L106-V109 PolarHBondContact O-N 3.23Å; V109-G113 WeakPolarHBondContact O-CA 3.24Å; V109-G113 PolarHBondContact O-N 3Å; V109-L116 HydrophobicContact CG2-CD1 4.36Å; V109-L116 HydrophobicContact CG2-CG 4.42Å
110	E	78.8	Confident	68.6	Low	65 Å²	65	77.1 Å²	77.1	30%	0.304	41%	0.408	S	S	.	.	H	α-helix	trans	-78.7	-31.6	-175.3	-72.5	-68.7	149.9	0	0	113.6	V9 F31 R40 L106 C108	V9-E110 HydrophobicContact CG1-CG 4.29Å; V9-E110 HydrophobicContact CG2-CG 4.3Å; F31-E110 HydrophobicContact CE1-CB 3.84Å; F31-E110 HydrophobicContact CE1-CG 3.93Å; F31-E110 HydrophobicContact CZ-CB 3.54Å; F31-E110 HydrophobicContact CZ-CG 4.05Å; R40-E110 VanDerWaalsContact CD-O 3.24Å; R40-E110 WeakPolarHBondContact CD-O 3.4Å; R40-E110 PolarHBondContact NH1-O 3.32Å; L106-E110 VanDerWaalsContact O-CB 3.3Å; L106-E110 WeakPolarHBondContact O-CB 3.5Å; L106-E110 WeakPolarHBondContact O-CG 3.25Å; L106-E110 PolarHBondContact O-N 2.92Å; C108-E110 PolarHBondContact O-N 2.9Å
111	C	78.4	Confident	66.9	Low	16 Å²	16	85.9 Å²	85.9	11%	0.108	45%	0.454	C	S	.	.	H	α-helix	trans	-93.1	-40.4	-175.1	-56.6	0	0	0	0	112.9	R40 I65 L107	R40-C111 PolarHBondContact NH1-O 3.45Å; R40-C111 VanDerWaalsContact NH1-O 3.15Å; I65-C111 HydrophobicContact CB-CB 4.24Å; I65-C111 HydrophobicContact CD1-CB 3.43Å; I65-C111 VanDerWaalsContact CD1-CB 3.43Å; I65-C111 WeakPolarHBondContact CD1-SG 3.39Å; I65-C111 HydrophobicContact CG1-CB 4.41Å; I65-C111 HydrophobicContact CG2-CB 4.42Å; L107-C111 WeakPolarHBondContact O-CA 3.15Å; L107-C111 WeakPolarHBondContact O-CB 3.36Å; L107-C111 PolarHBondContact O-N 3.24Å; L107-C111 PolarHBondContact O-SG 2.8Å
112	L	72.2	Confident	64.8	Low	57 Å²	57	84.9 Å²	84.9	30%	0.298	47%	0.468	S	S	.	.	H	α-helix	trans	-101.4	-6.1	-173.5	-57.2	171.6	0	0	0	112.5	I65 C108 T114	I65-L112 HydrophobicContact CG2-CD2 4.09Å; I65-L112 WeakPolarHBondContact O-CD2 3.28Å; C108-L112 HydrophobicContact CB-CD1 4.48Å; C108-L112 WeakPolarHBondContact O-CA 3.41Å; C108-L112 VanDerWaalsContact O-CB 3.3Å; C108-L112 WeakPolarHBondContact O-CB 3.24Å; C108-L112 PolarHBondContact O-N 2.98Å; L112-T114 WeakPolarHBondContact CB-OG1 3.12Å; L112-T114 PolarHBondContact O-N 3.3Å
113	G	59.9	Low	62.6	Low	61 Å²	61	88.9 Å²	88.9	63%	0.629	49%	0.487	S	S	*	.			trans	62.2	12.3	179.6	0	0	0	0	0	113.7	V109 R115	V109-G113 WeakPolarHBondContact O-CA 3.24Å; V109-G113 PolarHBondContact O-N 3Å; G113-R115 PolarHBondContact O-N 3.03Å
114	T	50.7	Low	60.5	Low	68 Å²	68	94.4 Å²	94.4	42%	0.417	52%	0.523	S	S	.	.			trans	-72	103.4	-176.4	15.5	0	0	0	0	108.3	L112 L116	L112-T114 WeakPolarHBondContact CB-OG1 3.12Å; L112-T114 PolarHBondContact O-N 3.3Å; T114-L116 PolarHBondContact O-N 3.4Å
115	R	45.2	Very low	58.8	Low	235 Å²	235	98.7 Å²	98.7	89%	0.887	55%	0.545	S	S	*	.			trans	-52.4	110.4	150.4	-69.5	-176.7	172.5	-178.6	-2.4	105.2	G113 N117	G113-R115 PolarHBondContact O-N 3.03Å; R115-N117 PolarHBondContact O-N 3.43Å
116	L	40.3	Very low	57.2	Low	97 Å²	97	99.9 Å²	99.9	51%	0.508	56%	0.556	S	S	.	*	S	Bend	trans	-60.5	95.7	174.4	-64.7	171.5	0	0	0	106.5	K105 V109 T114	K105-L116 HydrophobicContact CD-CD1 4.43Å; K105-L116 HydrophobicContact CG-CD1 4.05Å; V109-L116 HydrophobicContact CG2-CD1 4.36Å; V109-L116 HydrophobicContact CG2-CG 4.42Å; T114-L116 PolarHBondContact O-N 3.4Å
117	N	41.8	Very low	55.4	Low	152 Å²	152	104.5 Å²	104.5	81%	0.813	58%	0.581	S	S	*	*			trans	155	82.9	161.1	-75.8	-18.2	0	0	0	107.5	R115	R115-N117 PolarHBondContact O-N 3.43Å
118	D	35.1	Very low	53.4	Low	153 Å²	153	106.3 Å²	106.3	82%	0.818	60%	0.596	S	S	*	*				-163.9	155.1	122.1	-114.9	-32.6	0	0	0	112.2
119	I	44.3	Very low	51.5	Low	144 Å²	144	108.3 Å²	108.3	74%	0.738	61%	0.613	S	S	*	*			trans	-71.3	142	-165.8	-57.7	155.8	0	0	0	110.5
120	S	38	Very low	49.6	Very low	100 Å²	100	108.1 Å²	108.1	70%	0.699	62%	0.624	S	S	*	*			trans	62.1	116.1	155.8	-67.4	0	0	0	0	120.3	G122	S120-G122 PolarHBondContact O-N 2.94Å
121	L	51	Low	47.8	Very low	184 Å²	184	109.9 Å²	109.9	96%	0.963	64%	0.639	S	S	*	*				11.1	96.3	124.8	-78.1	150.2	0	0	0	115.7
122	G	41.5	Very low	46	Very low	70 Å²	70	115 Å²	115	72%	0.722	66%	0.661	S	S	*	*			trans	172.1	103.9	168.6	0	0	0	0	0	112.9	S120	S120-G122 PolarHBondContact O-N 2.94Å
123	E	40.5	Very low	44.7	Very low	187 Å²	187	121.7 Å²	121.7	87%	0.874	68%	0.683	S	S	*	*			trans	55.6	133.5	168	-70.1	-165	140.1	0	0	120.3	D125	E123-D125 PolarHBondContact O-N 2.8Å; E123-D125 VanDerWaalsContact O-N 3.17Å
124	P	47	Very low	44	Very low	115 Å²	115	125.1 Å²	125.1	75%	0.747	68%	0.682	S	S	*	*			trans	-68.4	112.5	162.4	28.5	-27.7	0	0	0	108.3	L126	P124-L126 PolarHBondContact O-N 3.27Å
125	D	50	Low	43.7	Very low	105 Å²	105	128.1 Å²	128.1	56%	0.561	69%	0.692	S	S	*	*			trans	-54.1	105.7	175.8	-171.5	-0.1	0	0	0	110.2	E123 L127 A128	E123-D125 PolarHBondContact O-N 2.8Å; E123-D125 VanDerWaalsContact O-N 3.17Å; D125-L127 PolarHBondContact O-N 2.75Å; D125-L127 VanDerWaalsContact O-N 3.11Å; D125-L127 WeakPolarHBondContact OD1-CB 3.2Å; D125-L127 PolarHBondContact OD1-N 2.89Å; D125-A128 HydrophobicContact CB-CB 4.21Å; D125-A128 WeakPolarHBondContact O-CB 2.98Å; D125-A128 PolarHBondContact O-N 2.84Å
126	L	51.8	Low	43.9	Very low	152 Å²	152	123.7 Å²	123.7	80%	0.796	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	-16.8	-177.8	-68.4	170.3	0	0	0	111.9	P124	P124-L126 PolarHBondContact O-N 3.27Å
127	L	48.4	Very low	45.4	Very low	151 Å²	151	121.5 Å²	121.5	79%	0.791	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	-21.2	175.5	-57	178.7	0	0	0	112.6	D125 A129	D125-L127 PolarHBondContact O-N 2.75Å; D125-L127 VanDerWaalsContact O-N 3.11Å; D125-L127 WeakPolarHBondContact OD1-CB 3.2Å; D125-L127 PolarHBondContact OD1-N 2.89Å; L127-A129 VanDerWaalsContact C-N 3.33Å
128	A	43.4	Very low	47.5	Very low	38 Å²	38	117.2 Å²	117.2	31%	0.314	65%	0.645	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.2	-17	173.7	0	0	0	0	0	112.9	D125 G130 V131 Q132	D125-A128 HydrophobicContact CB-CB 4.21Å; D125-A128 WeakPolarHBondContact O-CB 2.98Å; D125-A128 PolarHBondContact O-N 2.84Å; A128-G130 PolarHBondContact O-N 2.73Å; A128-V131 PolarHBondContact O-N 2.9Å; A128-Q132 WeakPolarHBondContact O-CG 3.23Å; A128-Q132 PolarHBondContact O-N 2.9Å
129	A	43.2	Very low	50	Low	63 Å²	63	110.5 Å²	110.5	52%	0.521	61%	0.609	S	S	.	*	H	α-helix	trans	-60.6	-31	179.2	0	0	0	0	0	112.9	L127	L127-A129 VanDerWaalsContact C-N 3.33Å
130	G	39.3	Very low	52.1	Low	58 Å²	58	105.4 Å²	105.4	60%	0.598	58%	0.583	S	S	*	*	H	α-helix	trans	-70.9	-34.1	173.8	0	0	0	0	0	113.4	A128	A128-G130 PolarHBondContact O-N 2.73Å
131	V	42.6	Very low	54.6	Low	101 Å²	101	100.7 Å²	100.7	61%	0.612	55%	0.55	S	S	*	.	H	α-helix	trans	-84.3	-26.1	-178.6	-177.1	0	0	0	0	112	A128 R133	A128-V131 PolarHBondContact O-N 2.9Å; V131-R133 VanDerWaalsContact C-N 3.31Å; V131-R133 PolarHBondContact O-N 3.2Å
132	Q	40.5	Very low	56.5	Low	125 Å²	125	93.7 Å²	93.7	58%	0.584	51%	0.511	S	S	*	.	H	α-helix	trans	-71	-23.6	175	-76.1	-78.4	13.4	0	0	113.2	A128 N136	A128-Q132 WeakPolarHBondContact O-CG 3.23Å; A128-Q132 PolarHBondContact O-N 2.9Å; Q132-N136 PolarHBondContact O-N 3.48Å
133	R	44.9	Very low	58.9	Low	197 Å²	197	90.4 Å²	90.4	74%	0.743	48%	0.477	S	S	*	.	H	α-helix	trans	-71.7	-32.7	-175.8	-134.3	177.2	-170.4	-109.1	4	113	V131	V131-R133 VanDerWaalsContact C-N 3.31Å; V131-R133 PolarHBondContact O-N 3.2Å
134	E	44.2	Very low	61.2	Low	133 Å²	133	85.1 Å²	85.1	62%	0.621	45%	0.453	S	S	*	.	H	α-helix	trans	-84.1	-29	179.7	-75.9	-162.1	149.1	0	0	114.1	N136 E137	E134-N136 PolarHBondContact O-N 3.27Å; E134-E137 PolarHBondContact O-N 3.45Å
135	Q	44.3	Very low	63.1	Low	131 Å²	131	83.8 Å²	83.8	61%	0.612	44%	0.444	S	S	*	.	H	α-helix	trans	-71.2	-22.8	172.9	-84.3	173.7	16.3	0	0	112.5	E137	Q135-E137 PolarHBondContact O-N 2.89Å
136	N	50.8	Low	64.8	Low	141 Å²	141	79.8 Å²	79.8	75%	0.754	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	6.1	176.3	-160.9	70.1	0	0	0	114	Q132 E134	Q132-N136 PolarHBondContact O-N 3.48Å; E134-N136 PolarHBondContact O-N 3.27Å
137	E	69.8	Low	66.2	Low	51 Å²	51	78.7 Å²	78.7	24%	0.238	43%	0.426	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.1	20.7	179.2	-56.4	-161.8	144.2	0	0	113.5	E134 Q135 R222	E134-E137 PolarHBondContact O-N 3.45Å; Q135-E137 PolarHBondContact O-N 2.89Å; E137-R222 IonicContact OE1-CZ 3.22Å; E137-R222 IonicContact OE1-NH1 2.77Å; E137-R222 PolarHBondContact OE1-NH1 3.2Å; E137-R222 IonicContact OE1-NH2 2.75Å; E137-R222 PolarHBondContact OE1-NH2 3.39Å; E137-R222 IonicContact OE2-NH1 3.05Å; E137-R222 PolarHBondContact OE2-NH1 3.03Å
138	R	86.5	Confident	67.7	Low	63 Å²	63	75.1 Å²	75.1	24%	0.238	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	123.8	174.9	-62.5	-171.5	176.8	-178.2	-2.4	110.5	M157 Q158 A172	R138-M157 CarbonylContact C-O 3.58Å; R138-M157 WeakPolarHBondContact CA-O 3.47Å; R138-Q158 HydrophobicContact CG-CB 4.09Å; R138-Q158 HydrophobicContact CG-CG 4.19Å; R138-Q158 VanDerWaalsContact NE-OE1 3.13Å; R138-A172 PolarHBondContact NH1-O 3.31Å
139	F	87.9	Confident	69.6	Low	12 Å²	12	74.3 Å²	74.3	5%	0.053	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	134.7	177.5	-59.5	-84.5	0	0	0	110	V141 T156 M157 I159 E215 M218 I219 R222	F139-V141 HydrophobicContact CB-CG1 4.29Å; F139-T156 CarbonylContact O-C 3.49Å; F139-T156 WeakPolarHBondContact O-CA 3.28Å; F139-M157 PolarHBondContact N-O 2.69Å; F139-M157 PolarHBondContact O-N 2.88Å; F139-I159 HydrophobicContact CD2-CD1 3.51Å; F139-I159 HydrophobicContact CE2-CD1 3.6Å; F139-E215 HydrophobicContact CD1-CB 3.89Å; F139-E215 HydrophobicContact CE1-CB 4.41Å; F139-M218 HydrophobicContact CE1-CB 3.89Å; F139-M218 HydrophobicContact CE1-CE 4.11Å; F139-M218 HydrophobicContact CZ-CB 4.31Å; F139-I219 HydrophobicContact CB-CD1 3.75Å; F139-I219 HydrophobicContact CB-CG1 3.89Å; F139-I219 HydrophobicContact CD1-CD1 4.29Å; F139-I219 HydrophobicContact CD1-CG1 3.76Å; F139-I219 HydrophobicContact CD2-CD1 4.48Å; F139-I219 HydrophobicContact CD2-CG1 3.69Å; F139-I219 HydrophobicContact CE1-CG1 4.18Å; F139-I219 HydrophobicContact CE2-CG1 4.13Å; F139-I219 HydrophobicContact CG-CD1 3.92Å; F139-I219 HydrophobicContact CG-CG1 3.48Å; F139-I219 VanDerWaalsContact CG-CG1 3.48Å; F139-I219 HydrophobicContact CZ-CG1 4.35Å; F139-R222 HydrophobicContact CE2-CG 4.42Å; F139-R222 HydrophobicContact CZ-CG 4.28Å
140	N	88.7	Confident	71.4	Confident	37 Å²	37	78.8 Å²	78.8	20%	0.198	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	125.8	173.5	-62	-77.3	0	0	0	108.9	S35 T156 T213	S35-N140 WeakPolarHBondContact O-CB 3.5Å; N140-T156 WeakPolarHBondContact OD1-CG2 3.02Å; N140-T213 PolarHBondContact O-OG1 2.76Å
141	V	90.8	Very high	73.6	Confident	0 Å²	0	79.1 Å²	79.1	0%	0	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	151.4	-175.6	-57.4	0	0	0	0	110.5	F139 C155 M157 L166 F211 T213 I219	F139-V141 HydrophobicContact CB-CG1 4.29Å; V141-C155 VanDerWaalsContact CG2-SG 3.6Å; V141-C155 PolarHBondContact N-O 2.85Å; V141-C155 PolarHBondContact O-N 2.77Å; V141-M157 HydrophobicContact CG1-CB 3.99Å; V141-M157 HydrophobicContact CG2-CB 3.84Å; V141-M157 HydrophobicContact CG2-CE 4.47Å; V141-L166 HydrophobicContact CG2-CD2 4.29Å; V141-F211 HydrophobicContact CB-CB 4.17Å; V141-F211 HydrophobicContact CB-CD1 4.17Å; V141-F211 HydrophobicContact CG2-CD1 3.7Å; V141-F211 HydrophobicContact CG2-CE1 4.38Å; V141-T213 HydrophobicContact CG1-CG2 4.14Å; V141-I219 HydrophobicContact CG1-CD1 3.9Å
142	Y	90.1	Very high	75.7	Confident	37 Å²	37	81.7 Å²	81.7	15%	0.145	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	112.3	171.2	-173.8	-78.2	0	0	0	108.9	M144 G153 E154 F211 Q212	Y142-M144 HydrophobicContact CD1-SD 3.95Å; Y142-M144 HydrophobicContact CE1-SD 4.09Å; Y142-M144 PolarHBondContact O-N 2.94Å; Y142-G153 CarbonylContact C-O 3.42Å; Y142-G153 WeakPolarHBondContact CA-O 3.27Å; Y142-E154 HydrophobicContact CD2-CG 3.95Å; Y142-E154 HydrophobicContact CE2-CG 4.47Å; Y142-F211 CarbonylContact O-C 3.54Å; Y142-F211 WeakPolarHBondContact O-CA 3.4Å; Y142-Q212 PolarHBondContact N-O 2.83Å; Y142-Q212 PolarHBondContact O-N 2.79Å
143	L	91.3	Very high	77.9	Confident	2 Å²	2	76.3 Å²	76.3	1%	0.01	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	119.7	176.3	173.3	61	0	0	0	109.3	L149 I151 G153 L166 F209 F211	L143-L149 HydrophobicContact CD2-CD2 3.7Å; L143-I151 WeakPolarHBondContact CD2-O 3.3Å; L143-G153 PolarHBondContact N-O 2.81Å; L143-G153 PolarHBondContact O-N 3.49Å; L143-L166 HydrophobicContact CD2-CD1 4.11Å; L143-F209 HydrophobicContact CD1-CD1 4.37Å; L143-F211 HydrophobicContact CB-CD1 4.18Å; L143-F211 HydrophobicContact CB-CE1 4.05Å; L143-F211 HydrophobicContact CD1-CD1 4.13Å; L143-F211 HydrophobicContact CD1-CE1 3.61Å; L143-F211 HydrophobicContact CD1-CZ 3.86Å; L143-F211 HydrophobicContact CG-CE1 4.29Å
144	M	89.9	Confident	79.9	Confident	75 Å²	75	68.2 Å²	68.2	37%	0.369	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-69.5	148.4	174	-61.9	-60.9	-69.3	0	0	110.3	Y142 T146 T210	Y142-M144 HydrophobicContact CD1-SD 3.95Å; Y142-M144 HydrophobicContact CE1-SD 4.09Å; Y142-M144 PolarHBondContact O-N 2.94Å; M144-T146 PolarHBondContact O-N 3.37Å; M144-T210 WeakPolarHBondContact CB-O 3.02Å; M144-T210 HydrophobicContact CG-CG2 4.04Å; M144-T210 WeakPolarHBondContact CG-O 3.39Å; M144-T210 PolarHBondContact N-O 3.13Å
145	P	87.2	Confident	82.1	Confident	87 Å²	87	62.1 Å²	62.1	57%	0.565	32%	0.321	S	S	*	.	P	Polyproline II helix	trans	-55.7	130.3	175.4	-24.2	33.8	0	0	0	111.5	Y152	P145-Y152 HydrophobicContact CG-CD2 4.26Å; P145-Y152 HydrophobicContact CG-CG 4.16Å
146	T	85	Confident	84.3	Confident	21 Å²	21	56.7 Å²	56.7	13%	0.129	30%	0.297	C	S	.	.	B	Isolated β-bridge	trans	-130.2	147.1	177.9	58.4	0	0	0	0	110	M144 N148 L149 L208 F209	M144-T146 PolarHBondContact O-N 3.37Å; T146-N148 PolarHBondContact O-N 2.72Å; T146-L149 PolarHBondContact O-N 2.7Å; T146-L149 VanDerWaalsContact O-O 3.05Å; T146-L208 WeakPolarHBondContact CG2-O 3.34Å; T146-F209 HydrophobicContact CG2-CD1 4.11Å
147	P	81.3	Confident	86.3	Confident	130 Å²	130	50 Å²	50	84%	0.844	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-24.3	-177.3	25.5	-34	0	0	0	113.4
148	N	79.3	Confident	87.3	Confident	75 Å²	75	48.2 Å²	48.2	40%	0.401	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-4.8	-174.5	-60.4	-19.7	0	0	0	113.5	T146 E206 G207	T146-N148 PolarHBondContact O-N 2.72Å; N148-E206 PolarHBondContact ND2-O 2.91Å; N148-G207 WeakPolarHBondContact ND2-CA 3.4Å
149	L	83.6	Confident	87.6	Confident	21 Å²	21	45.6 Å²	45.6	11%	0.11	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-145.1	113.9	-175.3	-176.6	61.1	0	0	0	109.7	L143 T146 I151 V177 W179 F209	L143-L149 HydrophobicContact CD2-CD2 3.7Å; T146-L149 PolarHBondContact O-N 2.7Å; T146-L149 VanDerWaalsContact O-O 3.05Å; L149-I151 HydrophobicContact CD1-CB 4.21Å; L149-I151 HydrophobicContact CD1-CD1 3.98Å; L149-I151 HydrophobicContact CD1-CG1 3.98Å; L149-I151 HydrophobicContact CD2-CB 4.43Å; L149-I151 HydrophobicContact CG-CB 3.97Å; L149-I151 HydrophobicContact CG-CG1 4.28Å; L149-I151 PolarHBondContact O-N 3.29Å; L149-V177 HydrophobicContact CD1-CG2 3.83Å; L149-V177 HydrophobicContact CD2-CG2 3.88Å; L149-W179 HydrophobicContact CD2-CH2 4.39Å; L149-W179 HydrophobicContact CD2-CZ2 4.27Å; L149-F209 HydrophobicContact CB-CE1 3.98Å; L149-F209 HydrophobicContact CD2-CD1 4.43Å; L149-F209 HydrophobicContact CD2-CE1 3.98Å
150	D	82.1	Confident	87.7	Confident	158 Å²	158	46.9 Å²	46.9	85%	0.845	25%	0.252	S	S	*	.	S	Bend	trans	-78.7	33.1	177.5	-163.5	30.2	0	0	0	112.4
151	I	84.3	Confident	87.6	Confident	64 Å²	64	52.7 Å²	52.7	33%	0.328	28%	0.278	S	S	.	.			trans	-130.2	126.5	178.1	-51.3	177.8	0	0	0	106.7	L143 L149 L176 V177	L143-I151 WeakPolarHBondContact CD2-O 3.3Å; L149-I151 HydrophobicContact CD1-CB 4.21Å; L149-I151 HydrophobicContact CD1-CD1 3.98Å; L149-I151 HydrophobicContact CD1-CG1 3.98Å; L149-I151 HydrophobicContact CD2-CB 4.43Å; L149-I151 HydrophobicContact CG-CB 3.97Å; L149-I151 HydrophobicContact CG-CG1 4.28Å; L149-I151 PolarHBondContact O-N 3.29Å; I151-L176 HydrophobicContact CD1-CB 4.48Å; I151-L176 HydrophobicContact CD1-CD2 4.45Å; I151-L176 HydrophobicContact CG2-CD1 4.41Å; I151-V177 HydrophobicContact CD1-CG2 4.36Å
152	Y	87.1	Confident	87.5	Confident	155 Å²	155	58.8 Å²	58.8	61%	0.608	31%	0.306	S	S	*	.			trans	-148.4	155.6	177.1	63.6	-87.1	0	0	0	110.2	P145	P145-Y152 HydrophobicContact CG-CD2 4.26Å; P145-Y152 HydrophobicContact CG-CG 4.16Å
153	G	86.9	Confident	87.6	Confident	13 Å²	13	58.2 Å²	58.2	13%	0.134	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	119.4	-164.3	179.5	0	0	0	0	0	114.6	Y142 L143 C155	Y142-G153 CarbonylContact C-O 3.42Å; Y142-G153 WeakPolarHBondContact CA-O 3.27Å; L143-G153 PolarHBondContact N-O 2.81Å; L143-G153 PolarHBondContact O-N 3.49Å; G153-C155 PolarHBondContact O-N 2.8Å
154	E	87.2	Confident	87.7	Confident	27 Å²	27	58.1 Å²	58.1	13%	0.126	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	123.9	179.5	-65.8	-74.9	162.1	0	0	110.4	S36 Y142 I169	S36-E154 VanDerWaalsContact CB-OE2 3.29Å; S36-E154 WeakPolarHBondContact CB-OE2 3.2Å; S36-E154 PolarHBondContact N-OE2 3.17Å; S36-E154 VanDerWaalsContact OG-CD 3.28Å; S36-E154 PolarHBondContact OG-OE1 2.82Å; S36-E154 PolarHBondContact OG-OE2 3.15Å; Y142-E154 HydrophobicContact CD2-CG 3.95Å; Y142-E154 HydrophobicContact CE2-CG 4.47Å; E154-I169 HydrophobicContact CB-CD1 3.75Å; E154-I169 HydrophobicContact CB-CG1 4.39Å; E154-I169 HydrophobicContact CB-CG2 4.05Å; E154-I169 WeakPolarHBondContact O-CG2 3.42Å
155	C	89.4	Confident	87.8	Confident	4 Å²	4	56.4 Å²	56.4	3%	0.027	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	168.3	176	51.7	0	0	0	0	109.9	V141 G153 W167 L176	V141-C155 VanDerWaalsContact CG2-SG 3.6Å; V141-C155 PolarHBondContact N-O 2.85Å; V141-C155 PolarHBondContact O-N 2.77Å; G153-C155 PolarHBondContact O-N 2.8Å; C155-W167 WeakPolarHBondContact CB-O 3.36Å; C155-L176 HydrophobicContact CB-CD1 3.99Å
156	T	90.4	Very high	88.1	Confident	18 Å²	18	52.3 Å²	52.3	11%	0.11	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	128.6	171.7	54.6	0	0	0	0	110.4	F139 N140 L166 W167 I169	F139-T156 CarbonylContact O-C 3.49Å; F139-T156 WeakPolarHBondContact O-CA 3.28Å; N140-T156 WeakPolarHBondContact OD1-CG2 3.02Å; T156-L166 CarbonylContact O-C 3Å; T156-L166 WeakPolarHBondContact O-CA 3.41Å; T156-W167 PolarHBondContact N-O 2.94Å; T156-W167 PolarHBondContact O-N 2.62Å; T156-W167 WeakPolarHBondContact OG1-CB 3.36Å; T156-I169 HydrophobicContact CG2-CG2 4.32Å
157	M	92.7	Very high	88.3	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	129	179.7	-178.6	179	-75.5	0	0	110.2	R138 F139 V141 I159 I164 Y165 L166 F194 F196 F211 I219	R138-M157 CarbonylContact C-O 3.58Å; R138-M157 WeakPolarHBondContact CA-O 3.47Å; F139-M157 PolarHBondContact N-O 2.69Å; F139-M157 PolarHBondContact O-N 2.88Å; V141-M157 HydrophobicContact CG1-CB 3.99Å; V141-M157 HydrophobicContact CG2-CB 3.84Å; V141-M157 HydrophobicContact CG2-CE 4.47Å; M157-I159 HydrophobicContact CG-CD1 3.97Å; M157-I159 HydrophobicContact CG-CG1 4.41Å; M157-I159 HydrophobicContact SD-CD1 4.17Å; M157-I164 HydrophobicContact CE-CG2 4.37Å; M157-I164 HydrophobicContact CG-CG2 3.97Å; M157-I164 HydrophobicContact SD-CG2 4.19Å; M157-Y165 CarbonylContact C-O 3.44Å; M157-Y165 WeakPolarHBondContact CA-O 3.43Å; M157-L166 HydrophobicContact CB-CD2 3.88Å; M157-L166 HydrophobicContact CE-CD2 3.98Å; M157-L166 HydrophobicContact CG-CD2 4.19Å; M157-F194 HydrophobicContact CE-CD1 4.24Å; M157-F194 HydrophobicContact CE-CE1 4.3Å; M157-F194 HydrophobicContact SD-CD1 4.22Å; M157-F194 HydrophobicContact SD-CE1 4.15Å; M157-F196 HydrophobicContact CE-CE1 4.37Å; M157-F211 HydrophobicContact CE-CB 4.49Å; M157-F211 HydrophobicContact CE-CD1 3.57Å; M157-F211 HydrophobicContact CE-CD2 3.61Å; M157-F211 HydrophobicContact CE-CE1 3.51Å; M157-F211 HydrophobicContact CE-CE2 3.59Å; M157-F211 HydrophobicContact CE-CG 3.6Å; M157-F211 HydrophobicContact CE-CZ 3.52Å; M157-I219 HydrophobicContact SD-CG2 3.81Å
158	Q	92.3	Very high	88.5	Confident	14 Å²	14	48.9 Å²	48.9	7%	0.065	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	130.7	173.9	-170.9	175.9	-4.6	0	0	109.2	R138 Y165	R138-Q158 HydrophobicContact CG-CB 4.09Å; R138-Q158 HydrophobicContact CG-CG 4.19Å; R138-Q158 VanDerWaalsContact NE-OE1 3.13Å; Q158-Y165 PolarHBondContact N-O 2.86Å; Q158-Y165 PolarHBondContact O-N 2.88Å
159	I	91.8	Very high	88.6	Confident	7 Å²	7	48 Å²	48	4%	0.036	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	114.5	178.1	-56.4	94.1	0	0	0	107.8	F139 M157 I164 I219 R222 V223	F139-I159 HydrophobicContact CD2-CD1 3.51Å; F139-I159 HydrophobicContact CE2-CD1 3.6Å; M157-I159 HydrophobicContact CG-CD1 3.97Å; M157-I159 HydrophobicContact CG-CG1 4.41Å; M157-I159 HydrophobicContact SD-CD1 4.17Å; I159-I164 HydrophobicContact CG1-CG1 4.48Å; I159-I219 HydrophobicContact CD1-CG1 4.47Å; I159-I219 HydrophobicContact CD1-CG2 4.07Å; I159-R222 HydrophobicContact CB-CB 4.38Å; I159-R222 HydrophobicContact CG2-CB 4.29Å; I159-V223 HydrophobicContact CG1-CG2 3.86Å; I159-V223 HydrophobicContact CG2-CG2 3.92Å
160	T	90.5	Very high	88.3	Confident	39 Å²	39	54.2 Å²	54.2	24%	0.239	26%	0.262	C	S	.	.			trans	-98.4	-179.4	173.7	64.7	0	0	0	0	110.5	E162 N163 Y165 L181	T160-E162 PolarHBondContact O-N 3.47Å; T160-N163 PolarHBondContact N-O 2.93Å; T160-N163 PolarHBondContact OG1-N 2.88Å; T160-N163 PolarHBondContact OG1-O 2.81Å; T160-Y165 HydrophobicContact CG2-CD2 3.83Å; T160-Y165 HydrophobicContact CG2-CE2 3.53Å; T160-L181 WeakPolarHBondContact O-CD1 3.29Å
161	H	86.8	Confident	88	Confident	159 Å²	159	50.3 Å²	50.3	74%	0.736	24%	0.241	S	C	*	.	S	Bend	trans	-65.9	-23.2	178.7	-60.7	-66.3	0	0	0	113.8	I230	H161-I230 WeakPolarHBondContact O-CD1 3.44Å
162	E	88.3	Confident	87.5	Confident	129 Å²	129	50.1 Å²	50.1	60%	0.603	25%	0.249	S	C	*	.	S	Bend	trans	-121.4	-26.3	-175.7	-66.2	-178.9	179	0	0	113.5	T160 L181	T160-E162 PolarHBondContact O-N 3.47Å; E162-L181 WeakPolarHBondContact O-CB 3.3Å; E162-L181 PolarHBondContact O-N 3.34Å
163	N	92.3	Very high	87	Confident	24 Å²	24	53.7 Å²	53.7	13%	0.128	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	149.9	-168.5	-61.5	-67.9	0	0	0	112.7	T160 Y165 M178 W179 P180	T160-N163 PolarHBondContact N-O 2.93Å; T160-N163 PolarHBondContact OG1-N 2.88Å; T160-N163 PolarHBondContact OG1-O 2.81Å; N163-Y165 HydrophobicContact CB-CE1 3.81Å; N163-Y165 HydrophobicContact CB-CE2 3.88Å; N163-Y165 VanDerWaalsContact CB-CZ 3.44Å; N163-Y165 WeakPolarHBondContact CB-OH 3.32Å; N163-Y165 PolarHBondContact ND2-OH 2.86Å; N163-Y165 VanDerWaalsContact ND2-OH 3.16Å; N163-M178 HydrophobicContact CB-CG 4.41Å; N163-W179 CarbonylContact C-O 3.57Å; N163-W179 WeakPolarHBondContact CA-O 3.41Å; N163-P180 VanDerWaalsContact OD1-CA 3.3Å; N163-P180 WeakPolarHBondContact OD1-CA 3.48Å
164	I	93.4	Very high	86.9	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	132.5	164.5	-57.6	178.9	0	0	0	108.3	M157 I159 M178 W179 L181 L184 F196 V223	M157-I164 HydrophobicContact CE-CG2 4.37Å; M157-I164 HydrophobicContact CG-CG2 3.97Å; M157-I164 HydrophobicContact SD-CG2 4.19Å; I159-I164 HydrophobicContact CG1-CG1 4.48Å; I164-M178 CarbonylContact O-C 3.46Å; I164-M178 WeakPolarHBondContact O-CA 3.38Å; I164-W179 HydrophobicContact CB-CB 4.44Å; I164-W179 HydrophobicContact CG2-CE3 4.24Å; I164-W179 PolarHBondContact N-O 3.27Å; I164-W179 PolarHBondContact O-N 2.57Å; I164-L181 HydrophobicContact CD1-CD2 3.75Å; I164-L181 HydrophobicContact CG1-CD2 3.57Å; I164-L181 HydrophobicContact CG1-CG 4.25Å; I164-L184 HydrophobicContact CD1-CD1 3.81Å; I164-F196 HydrophobicContact CD1-CD1 4.48Å; I164-F196 HydrophobicContact CD1-CE1 4.4Å; I164-V223 HydrophobicContact CD1-CG1 4.33Å; I164-V223 HydrophobicContact CD1-CG2 3.83Å; I164-V223 HydrophobicContact CG1-CG2 4.43Å
165	Y	92.3	Very high	86.9	Confident	39 Å²	39	59.5 Å²	59.5	15%	0.153	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	141.4	177.5	-58.8	-61.3	0	0	0	111.3	M157 Q158 T160 N163 K175 V177 M178	M157-Y165 CarbonylContact C-O 3.44Å; M157-Y165 WeakPolarHBondContact CA-O 3.43Å; Q158-Y165 PolarHBondContact N-O 2.86Å; Q158-Y165 PolarHBondContact O-N 2.88Å; T160-Y165 HydrophobicContact CG2-CD2 3.83Å; T160-Y165 HydrophobicContact CG2-CE2 3.53Å; N163-Y165 HydrophobicContact CB-CE1 3.81Å; N163-Y165 HydrophobicContact CB-CE2 3.88Å; N163-Y165 VanDerWaalsContact CB-CZ 3.44Å; N163-Y165 WeakPolarHBondContact CB-OH 3.32Å; N163-Y165 PolarHBondContact ND2-OH 2.86Å; N163-Y165 VanDerWaalsContact ND2-OH 3.16Å; Y165-K175 HydrophobicContact CD1-CD 4.13Å; Y165-K175 HydrophobicContact CE1-CD 4.47Å; Y165-V177 WeakPolarHBondContact CA-O 3.29Å; Y165-M178 HydrophobicContact CD1-CB 3.85Å; Y165-M178 HydrophobicContact CD1-CG 3.95Å; Y165-M178 HydrophobicContact CD1-SD 4.46Å; Y165-M178 HydrophobicContact CE1-CB 3.88Å; Y165-M178 HydrophobicContact CE1-CG 3.52Å; Y165-M178 HydrophobicContact CE1-SD 3.54Å; Y165-M178 VanDerWaalsContact CE1-SD 3.54Å
166	L	92.4	Very high	86.9	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.005	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	136.9	161.7	-65.5	178.9	0	0	0	110.3	V141 L143 T156 M157 L176 V177 W179 F211	V141-L166 HydrophobicContact CG2-CD2 4.29Å; L143-L166 HydrophobicContact CD2-CD1 4.11Å; T156-L166 CarbonylContact O-C 3Å; T156-L166 WeakPolarHBondContact O-CA 3.41Å; M157-L166 HydrophobicContact CB-CD2 3.88Å; M157-L166 HydrophobicContact CE-CD2 3.98Å; M157-L166 HydrophobicContact CG-CD2 4.19Å; L166-L176 HydrophobicContact CB-CB 4.07Å; L166-L176 HydrophobicContact CB-CD1 4.39Å; L166-L176 PolarHBondContact O-N 2.83Å; L166-V177 PolarHBondContact N-O 3.2Å; L166-V177 PolarHBondContact O-N 3.31Å; L166-W179 HydrophobicContact CD1-CH2 3.38Å; L166-W179 HydrophobicContact CD1-CZ3 3.44Å; L166-W179 VanDerWaalsContact CD1-CZ3 3.44Å; L166-W179 HydrophobicContact CD2-CZ3 4.41Å; L166-W179 HydrophobicContact CG-CH2 4.03Å; L166-W179 HydrophobicContact CG-CZ3 3.53Å; L166-F211 HydrophobicContact CD1-CE1 3.78Å; L166-F211 HydrophobicContact CD1-CZ 4.14Å; L166-F211 HydrophobicContact CD2-CE1 3.78Å; L166-F211 HydrophobicContact CD2-CZ 4.4Å; L166-F211 HydrophobicContact CG-CE1 4.36Å
167	W	90.4	Very high	86.9	Confident	40 Å²	40	61.3 Å²	61.3	15%	0.152	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	151.6	176.3	-54.1	88.2	0	0	0	110.2	C155 T156 R173 L174 K175	C155-W167 WeakPolarHBondContact CB-O 3.36Å; T156-W167 PolarHBondContact N-O 2.94Å; T156-W167 PolarHBondContact O-N 2.62Å; T156-W167 WeakPolarHBondContact OG1-CB 3.36Å; W167-R173 WeakPolarHBondContact CZ3-O 3.33Å; W167-L174 WeakPolarHBondContact CA-O 3.48Å; W167-K175 HydrophobicContact CE3-CB 3.97Å; W167-K175 HydrophobicContact CH2-CB 4.2Å; W167-K175 HydrophobicContact CZ3-CB 3.76Å
168	D	85.9	Confident	86.9	Confident	40 Å²	40	64 Å²	64	21%	0.214	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	142.5	176.1	-172.2	-88.3	0	0	0	111.8	H170 N171 L174 L176	D168-H170 VanDerWaalsContact OD1-CA 3.29Å; D168-H170 WeakPolarHBondContact OD1-CA 3.46Å; D168-H170 VanDerWaalsContact OD1-CB 3.28Å; D168-H170 WeakPolarHBondContact OD1-CB 3.49Å; D168-H170 IonicContact OD1-CD2 2.83Å; D168-H170 IonicContact OD1-CG 2.93Å; D168-H170 PolarHBondContact OD1-N 3.01Å; D168-N171 HydrophobicContact CB-CB 4.44Å; D168-N171 CarbonylContact O-C 3.51Å; D168-N171 PolarHBondContact OD1-N 3.08Å; D168-L174 HydrophobicContact CB-CB 4.14Å; D168-L174 HydrophobicContact CB-CD2 3.96Å; D168-L174 PolarHBondContact N-O 3.02Å; D168-L176 HydrophobicContact CB-CD1 4.48Å; D168-L176 HydrophobicContact CB-CD2 4.26Å; D168-L176 HydrophobicContact CB-CG 4.35Å
169	I	81.1	Confident	87	Confident	55 Å²	55	63.4 Å²	63.4	28%	0.282	31%	0.305	S	S	.	.	S	Bend	trans	-73.7	-27.5	179	51.9	156.6	0	0	0	113.7	E154 T156	E154-I169 HydrophobicContact CB-CD1 3.75Å; E154-I169 HydrophobicContact CB-CG1 4.39Å; E154-I169 HydrophobicContact CB-CG2 4.05Å; E154-I169 WeakPolarHBondContact O-CG2 3.42Å; T156-I169 HydrophobicContact CG2-CG2 4.32Å
170	H	76.4	Confident	87	Confident	152 Å²	152	64.7 Å²	64.7	70%	0.704	31%	0.314	S	S	*	.	S	Bend	trans	-89.5	-33.2	179.9	-59.1	-72.2	0	0	0	110.8	D168	D168-H170 VanDerWaalsContact OD1-CA 3.29Å; D168-H170 WeakPolarHBondContact OD1-CA 3.46Å; D168-H170 VanDerWaalsContact OD1-CB 3.28Å; D168-H170 WeakPolarHBondContact OD1-CB 3.49Å; D168-H170 IonicContact OD1-CD2 2.83Å; D168-H170 IonicContact OD1-CG 2.93Å; D168-H170 PolarHBondContact OD1-N 3.01Å
171	N	76.3	Confident	87.1	Confident	77 Å²	77	62.9 Å²	62.9	41%	0.412	30%	0.303	S	S	.	.			trans	-122	93	177.3	-170.3	-11.6	0	0	0	111.5	D168 R173 L174	D168-N171 HydrophobicContact CB-CB 4.44Å; D168-N171 CarbonylContact O-C 3.51Å; D168-N171 PolarHBondContact OD1-N 3.08Å; N171-R173 PolarHBondContact O-N 2.94Å; N171-R173 PolarHBondContact OD1-N 3.24Å; N171-L174 HydrophobicContact CB-CB 3.86Å; N171-L174 PolarHBondContact O-N 3.48Å
172	A	73.1	Confident	87.3	Confident	59 Å²	59	58.7 Å²	58.7	49%	0.488	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-7.5	-179.3	0	0	0	0	0	115.2	R138	R138-A172 PolarHBondContact NH1-O 3.31Å
173	R	76.9	Confident	87.3	Confident	230 Å²	230	53.8 Å²	53.8	87%	0.868	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	-10	174.8	-65	-176.8	130.1	175.6	-2.6	113.1	W167 N171	W167-R173 WeakPolarHBondContact CZ3-O 3.33Å; N171-R173 PolarHBondContact O-N 2.94Å; N171-R173 PolarHBondContact OD1-N 3.24Å
174	L	84	Confident	87.4	Confident	77 Å²	77	53.1 Å²	53.1	40%	0.403	27%	0.268	S	S	.	.			trans	-88	113.1	179.6	-169.5	147	0	0	0	109.4	W167 D168 N171 L176	W167-L174 WeakPolarHBondContact CA-O 3.48Å; D168-L174 HydrophobicContact CB-CB 4.14Å; D168-L174 HydrophobicContact CB-CD2 3.96Å; D168-L174 PolarHBondContact N-O 3.02Å; N171-L174 HydrophobicContact CB-CB 3.86Å; N171-L174 PolarHBondContact O-N 3.48Å; L174-L176 HydrophobicContact CD2-CD2 3.49Å; L174-L176 VanDerWaalsContact CD2-CD2 3.49Å; L174-L176 HydrophobicContact CD2-CG 4.16Å
175	K	88.9	Confident	87.3	Confident	86 Å²	86	57.2 Å²	57.2	37%	0.374	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	118.1	175.1	179.3	176.5	165.9	176.8	0	108.7	Y165 W167 M178	Y165-K175 HydrophobicContact CD1-CD 4.13Å; Y165-K175 HydrophobicContact CE1-CD 4.47Å; W167-K175 HydrophobicContact CE3-CB 3.97Å; W167-K175 HydrophobicContact CH2-CB 4.2Å; W167-K175 HydrophobicContact CZ3-CB 3.76Å; K175-M178 VanDerWaalsContact CE-CB 3.49Å; K175-M178 PolarHBondContact NZ-SD 3.33Å
176	L	88.9	Confident	87.3	Confident	45 Å²	45	58.3 Å²	58.3	24%	0.236	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	-55.3	179.2	-63.1	171.4	0	0	0	110.3	I151 C155 L166 D168 L174	I151-L176 HydrophobicContact CD1-CB 4.48Å; I151-L176 HydrophobicContact CD1-CD2 4.45Å; I151-L176 HydrophobicContact CG2-CD1 4.41Å; C155-L176 HydrophobicContact CB-CD1 3.99Å; L166-L176 HydrophobicContact CB-CB 4.07Å; L166-L176 HydrophobicContact CB-CD1 4.39Å; L166-L176 PolarHBondContact O-N 2.83Å; D168-L176 HydrophobicContact CB-CD1 4.48Å; D168-L176 HydrophobicContact CB-CD2 4.26Å; D168-L176 HydrophobicContact CB-CG 4.35Å; L174-L176 HydrophobicContact CD2-CD2 3.49Å; L174-L176 VanDerWaalsContact CD2-CD2 3.49Å; L174-L176 HydrophobicContact CD2-CG 4.16Å
177	V	90.9	Very high	87.4	Confident	14 Å²	14	58.6 Å²	58.6	9%	0.085	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	155	-172.3	-172.2	0	0	0	0	110.8	L149 I151 Y165 L166 W179 T204	L149-V177 HydrophobicContact CD1-CG2 3.83Å; L149-V177 HydrophobicContact CD2-CG2 3.88Å; I151-V177 HydrophobicContact CD1-CG2 4.36Å; Y165-V177 WeakPolarHBondContact CA-O 3.29Å; L166-V177 PolarHBondContact N-O 3.2Å; L166-V177 PolarHBondContact O-N 3.31Å; V177-W179 HydrophobicContact CB-CH2 3.86Å; V177-W179 HydrophobicContact CB-CZ2 4.06Å; V177-W179 HydrophobicContact CB-CZ3 4.16Å; V177-W179 HydrophobicContact CG1-CD2 3.91Å; V177-W179 VanDerWaalsContact CG1-CE2 3.47Å; V177-W179 HydrophobicContact CG1-CE3 4.13Å; V177-W179 HydrophobicContact CG1-CH2 3.63Å; V177-W179 HydrophobicContact CG1-CZ2 3.32Å; V177-W179 HydrophobicContact CG1-CZ3 4.04Å; V177-W179 HydrophobicContact CG2-CH2 4.44Å; V177-T204 HydrophobicContact CG1-CG2 3.33Å
178	M	92.4	Very high	87.5	Confident	58 Å²	58	56.9 Å²	56.9	29%	0.286	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	136.4	174	168.2	172.9	42.7	0	0	110.6	N163 I164 Y165 K175	N163-M178 HydrophobicContact CB-CG 4.41Å; I164-M178 CarbonylContact O-C 3.46Å; I164-M178 WeakPolarHBondContact O-CA 3.38Å; Y165-M178 HydrophobicContact CD1-CB 3.85Å; Y165-M178 HydrophobicContact CD1-CG 3.95Å; Y165-M178 HydrophobicContact CD1-SD 4.46Å; Y165-M178 HydrophobicContact CE1-CB 3.88Å; Y165-M178 HydrophobicContact CE1-CG 3.52Å; Y165-M178 HydrophobicContact CE1-SD 3.54Å; Y165-M178 VanDerWaalsContact CE1-SD 3.54Å; K175-M178 VanDerWaalsContact CE-CB 3.49Å; K175-M178 PolarHBondContact NZ-SD 3.33Å
179	W	93.6	Very high	87.7	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	121.1	170	-63.9	-78.3	0	0	0	110.5	L149 N163 I164 L166 V177 L181 L184 F196 T204 F209 F211	L149-W179 HydrophobicContact CD2-CH2 4.39Å; L149-W179 HydrophobicContact CD2-CZ2 4.27Å; N163-W179 CarbonylContact C-O 3.57Å; N163-W179 WeakPolarHBondContact CA-O 3.41Å; I164-W179 HydrophobicContact CB-CB 4.44Å; I164-W179 HydrophobicContact CG2-CE3 4.24Å; I164-W179 PolarHBondContact N-O 3.27Å; I164-W179 PolarHBondContact O-N 2.57Å; L166-W179 HydrophobicContact CD1-CH2 3.38Å; L166-W179 HydrophobicContact CD1-CZ3 3.44Å; L166-W179 VanDerWaalsContact CD1-CZ3 3.44Å; L166-W179 HydrophobicContact CD2-CZ3 4.41Å; L166-W179 HydrophobicContact CG-CH2 4.03Å; L166-W179 HydrophobicContact CG-CZ3 3.53Å; V177-W179 HydrophobicContact CB-CH2 3.86Å; V177-W179 HydrophobicContact CB-CZ2 4.06Å; V177-W179 HydrophobicContact CB-CZ3 4.16Å; V177-W179 HydrophobicContact CG1-CD2 3.91Å; V177-W179 VanDerWaalsContact CG1-CE2 3.47Å; V177-W179 HydrophobicContact CG1-CE3 4.13Å; V177-W179 HydrophobicContact CG1-CH2 3.63Å; V177-W179 HydrophobicContact CG1-CZ2 3.32Å; V177-W179 HydrophobicContact CG1-CZ3 4.04Å; V177-W179 HydrophobicContact CG2-CH2 4.44Å; W179-L181 PolarHBondContact O-N 2.85Å; W179-L184 HydrophobicContact CB-CD2 4.48Å; W179-F196 HydrophobicContact CB-CE2 4.37Å; W179-F196 AromaticContact CD2-CE2 3.87Å; W179-F196 HydrophobicContact CD2-CE2 3.87Å; W179-F196 AromaticContact CD2-CZ 3.53Å; W179-F196 HydrophobicContact CD2-CZ 3.53Å; W179-F196 AromaticContact CE2-CZ 3.89Å; W179-F196 HydrophobicContact CE3-CE1 4.34Å; W179-F196 HydrophobicContact CE3-CE2 4.29Å; W179-F196 AromaticContact CE3-CZ 3.49Å; W179-F196 HydrophobicContact CE3-CZ 3.49Å; W179-F196 VanDerWaalsContact CE3-CZ 3.49Å; W179-F196 AromaticContact CG-CE2 3.88Å; W179-F196 HydrophobicContact CG-CE2 3.88Å; W179-F196 AromaticContact CG-CZ 3.98Å; W179-F196 HydrophobicContact CG-CZ 3.98Å; W179-F196 HydrophobicContact CH2-CZ 4.12Å; W179-F196 HydrophobicContact CZ2-CZ 4.2Å; W179-F196 HydrophobicContact CZ3-CE1 4.41Å; W179-F196 AromaticContact CZ3-CZ 3.74Å; W179-F196 HydrophobicContact CZ3-CZ 3.74Å; W179-T204 HydrophobicContact CZ2-CG2 3.94Å; W179-T204 PolarHBondContact NE1-OG1 3.42Å; W179-F209 AromaticContact CE2-CE2 3.85Å; W179-F209 HydrophobicContact CH2-CD1 4.42Å; W179-F209 AromaticContact CZ2-CD1 3.94Å; W179-F209 HydrophobicContact CZ2-CD1 3.94Å; W179-F209 HydrophobicContact CZ2-CD2 4.03Å; W179-F209 AromaticContact CZ2-CE1 3.8Å; W179-F209 HydrophobicContact CZ2-CE1 3.8Å; W179-F209 AromaticContact CZ2-CE2 3.86Å; W179-F209 HydrophobicContact CZ2-CE2 3.86Å; W179-F209 HydrophobicContact CZ2-CG 4.06Å; W179-F209 AromaticContact CZ2-CZ 3.76Å; W179-F209 HydrophobicContact CZ2-CZ 3.76Å; W179-F209 AromaticContact NE1-CE2 3.51Å; W179-F209 AromaticContact NE1-CZ 3.87Å; W179-F211 HydrophobicContact CH2-CZ 4.17Å; W179-F211 HydrophobicContact CZ3-CZ 4.18Å
180	P	92.7	Very high	88.2	Confident	34 Å²	34	61.3 Å²	61.3	22%	0.221	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	131	169.6	-19.6	32.1	0	0	0	110.6	N163 S182 S183	N163-P180 VanDerWaalsContact OD1-CA 3.3Å; N163-P180 WeakPolarHBondContact OD1-CA 3.48Å; P180-S182 PolarHBondContact O-N 2.91Å; P180-S183 PolarHBondContact O-N 3.34Å
181	L	91.4	Very high	88.5	Confident	1 Å²	1	58.1 Å²	58.1	1%	0.005	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-60.4	-32.4	177.2	-74.6	171.5	0	0	0	111.6	T160 E162 I164 W179 S183 L184 V223 A226 I230	T160-L181 WeakPolarHBondContact O-CD1 3.29Å; E162-L181 WeakPolarHBondContact O-CB 3.3Å; E162-L181 PolarHBondContact O-N 3.34Å; I164-L181 HydrophobicContact CD1-CD2 3.75Å; I164-L181 HydrophobicContact CG1-CD2 3.57Å; I164-L181 HydrophobicContact CG1-CG 4.25Å; W179-L181 PolarHBondContact O-N 2.85Å; L181-S183 PolarHBondContact O-N 3.49Å; L181-L184 HydrophobicContact CD2-CD1 3.78Å; L181-L184 WeakPolarHBondContact O-CB 3.47Å; L181-L184 PolarHBondContact O-N 3.33Å; L181-V223 HydrophobicContact CD2-CG1 3.88Å; L181-A226 HydrophobicContact CD1-CB 3.47Å; L181-A226 VanDerWaalsContact CD1-CB 3.47Å; L181-I230 HydrophobicContact CB-CD1 3.54Å; L181-I230 HydrophobicContact CD1-CD1 4.02Å; L181-I230 HydrophobicContact CG-CD1 4.44Å
182	S	90.8	Very high	88.9	Confident	72 Å²	72	58 Å²	58	50%	0.503	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-65.8	-22.7	175.4	58.3	0	0	0	0	113.9	P180	P180-S182 PolarHBondContact O-N 2.91Å
183	S	90.1	Very high	89.7	Confident	26 Å²	26	59.9 Å²	59.9	18%	0.182	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-96	1.4	-179.2	-63.2	0	0	0	0	113	P180 L181 G199 C202	P180-S183 PolarHBondContact O-N 3.34Å; L181-S183 PolarHBondContact O-N 3.49Å; S183-G199 PolarHBondContact O-N 2.92Å; S183-C202 WeakPolarHBondContact CB-SG 3.23Å
184	L	92.5	Very high	90.5	Very high	9 Å²	9	48.9 Å²	48.9	5%	0.047	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	132.5	173	-60.5	-175.2	0	0	0	110.1	I164 W179 L181 Y187 F196 V223 A304	I164-L184 HydrophobicContact CD1-CD1 3.81Å; W179-L184 HydrophobicContact CB-CD2 4.48Å; L181-L184 HydrophobicContact CD2-CD1 3.78Å; L181-L184 WeakPolarHBondContact O-CB 3.47Å; L181-L184 PolarHBondContact O-N 3.33Å; L184-Y187 HydrophobicContact CD1-CD1 4.31Å; L184-F196 HydrophobicContact CD2-CB 4.42Å; L184-F196 HydrophobicContact CD2-CD2 3.41Å; L184-F196 VanDerWaalsContact CD2-CD2 3.41Å; L184-F196 HydrophobicContact CD2-CE2 3.86Å; L184-F196 HydrophobicContact CD2-CG 4.07Å; L184-V223 HydrophobicContact CD1-CG1 4.08Å; L184-A304 WeakPolarHBondContact O-CB 3.48Å
185	R	91.4	Very high	91	Very high	87 Å²	87	45.4 Å²	45.4	33%	0.328	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	-40.7	175.2	-69	177	172.8	175.3	6.2	111.8	E197 E206 A304 Q305	R185-E197 HydrophobicContact CB-CB 4.46Å; R185-E197 HydrophobicContact CB-CG 4.48Å; R185-E197 WeakPolarHBondContact CD-OE1 3.34Å; R185-E197 IonicContact CZ-OE1 3.86Å; R185-E197 PolarHBondContact N-O 3.4Å; R185-E197 IonicContact NE-OE1 3.99Å; R185-E197 IonicContact NH1-OE1 2.81Å; R185-E197 PolarHBondContact NH1-OE1 2.87Å; R185-E206 VanDerWaalsContact CZ-CD 3.46Å; R185-E206 IonicContact CZ-OE1 3.51Å; R185-E206 IonicContact CZ-OE2 2.57Å; R185-E206 IonicContact NH1-OE1 2.62Å; R185-E206 PolarHBondContact NH1-OE1 2.82Å; R185-E206 IonicContact NH1-OE2 3.99Å; R185-E206 PolarHBondContact NH1-OE2 2.78Å; R185-E206 IonicContact NH2-OE1 3.5Å; R185-E206 PolarHBondContact NH2-OE1 2.95Å; R185-E206 IonicContact NH2-OE2 3.75Å; R185-E206 PolarHBondContact NH2-OE2 2.8Å; R185-A304 CarbonylContact O-C 3.57Å; R185-A304 WeakPolarHBondContact O-CA 3.2Å; R185-A304 VanDerWaalsContact O-CB 3.31Å; R185-A304 WeakPolarHBondContact O-CB 3.46Å; R185-Q305 PolarHBondContact O-N 2.97Å
186	R	92.3	Very high	91.3	Very high	62 Å²	62	41.3 Å²	41.3	23%	0.234	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	148.7	-175.4	-56.3	-171.1	73	176.8	3.7	109.5	F196 E197 Q305 T306 F307	R186-F196 CarbonylContact O-C 3.55Å; R186-F196 VanDerWaalsContact O-CA 3.24Å; R186-F196 WeakPolarHBondContact O-CA 3.41Å; R186-F196 WeakPolarHBondContact O-CB 3.34Å; R186-E197 HydrophobicContact CB-CB 4.28Å; R186-E197 PolarHBondContact O-N 2.98Å; R186-Q305 WeakPolarHBondContact CA-O 3.18Å; R186-Q305 WeakPolarHBondContact CB-O 3.47Å; R186-Q305 HydrophobicContact CG-CB 4.33Å; R186-Q305 VanDerWaalsContact CG-O 3.24Å; R186-Q305 WeakPolarHBondContact CG-O 3.4Å; R186-Q305 PolarHBondContact NE-O 3.36Å; R186-T306 PolarHBondContact NH2-O 3.17Å; R186-F307 HydrophobicContact CB-CD2 4.4Å; R186-F307 HydrophobicContact CB-CE2 3.92Å; R186-F307 HydrophobicContact CB-CZ 4.48Å
187	Y	94.5	Very high	91.6	Very high	6 Å²	6	41.2 Å²	41.2	2%	0.024	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	152.1	169.4	49.1	-94.5	0	0	0	109.6	L184 T195 Y220 V223 H224 T227 A304 T306	L184-Y187 HydrophobicContact CD1-CD1 4.31Å; Y187-T195 CarbonylContact C-O 3.55Å; Y187-T195 VanDerWaalsContact CA-O 3.28Å; Y187-T195 WeakPolarHBondContact CA-O 3.43Å; Y187-Y220 AromaticContact CD2-CD2 3.81Å; Y187-Y220 HydrophobicContact CD2-CD2 3.81Å; Y187-Y220 AromaticContact CD2-CE2 3.5Å; Y187-Y220 HydrophobicContact CD2-CE2 3.5Å; Y187-Y220 HydrophobicContact CE2-CD2 4.31Å; Y187-Y220 AromaticContact CE2-CE2 3.75Å; Y187-Y220 HydrophobicContact CE2-CE2 3.75Å; Y187-V223 HydrophobicContact CD1-CG1 4.06Å; Y187-V223 HydrophobicContact CD2-CG1 4.26Å; Y187-V223 HydrophobicContact CE1-CG1 4.29Å; Y187-V223 HydrophobicContact CG-CG1 4.06Å; Y187-H224 HydrophobicContact CE2-CB 3.95Å; Y187-H224 AromaticContact CE2-ND1 3.74Å; Y187-H224 AromaticContact CZ-ND1 3.75Å; Y187-H224 PolarHBondContact OH-ND1 2.93Å; Y187-T227 HydrophobicContact CE1-CG2 4.27Å; Y187-A304 HydrophobicContact CE1-CB 4.01Å; Y187-T306 HydrophobicContact CE2-CG2 4.39Å
188	G	92.3	Very high	91.8	Very high	5 Å²	5	40.5 Å²	40.5	5%	0.052	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	162.4	-174.5	0	0	0	0	0	110.7	F194 T195	G188-F194 VanDerWaalsContact O-CD2 3.25Å; G188-F194 WeakPolarHBondContact O-CD2 3.34Å; G188-T195 PolarHBondContact N-O 3.39Å; G188-T195 PolarHBondContact O-N 3.42Å; G188-T195 VanDerWaalsContact O-O 3.12Å
189	R	92	Very high	91.6	Very high	124 Å²	124	38.1 Å²	38.1	47%	0.468	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	160.4	-179.9	65.6	82.1	174.3	166.7	-15.8	111.1	F194 E217 Y220	R189-F194 HydrophobicContact CB-CD2 4.27Å; R189-E217 WeakPolarHBondContact CD-OE2 3.14Å; R189-E217 IonicContact CZ-OE2 2.95Å; R189-E217 IonicContact NE-OE2 3.88Å; R189-E217 PolarHBondContact NE-OE2 2.81Å; R189-E217 IonicContact NH1-OE2 3.75Å; R189-E217 IonicContact NH2-OE1 2.76Å; R189-E217 IonicContact NH2-OE2 3.35Å; R189-E217 PolarHBondContact NH2-OE2 2.95Å; R189-Y220 HydrophobicContact CB-CD2 4.08Å; R189-Y220 HydrophobicContact CB-CG 4.11Å; R189-Y220 HydrophobicContact CG-CD1 4.15Å; R189-Y220 HydrophobicContact CG-CD2 3.74Å; R189-Y220 HydrophobicContact CG-CE2 4.48Å; R189-Y220 HydrophobicContact CG-CG 3.55Å
190	D	90.5	Very high	91.3	Very high	64 Å²	64	47 Å²	47	34%	0.342	23%	0.23	S	C	.	.			trans	-139.8	178.9	167.4	-173.1	19.5	0	0	0	108.7	T192 W193	D190-T192 PolarHBondContact O-N 3.28Å; D190-W193 VanDerWaalsContact CB-CD1 3.44Å; D190-W193 HydrophobicContact CB-CD2 4.15Å; D190-W193 HydrophobicContact CB-CG 4.04Å; D190-W193 HydrophobicContact CB-CZ2 4.18Å; D190-W193 PolarHBondContact N-O 2.89Å; D190-W193 PolarHBondContact OD2-NE1 3.15Å
191	S	82.2	Confident	90.8	Very high	85 Å²	85	53 Å²	53	59%	0.594	26%	0.257	S	S	*	.	S	Bend	trans	-59.7	-24	174.6	59.2	0	0	0	0	114.3
192	T	84.9	Confident	90.5	Very high	73 Å²	73	53.3 Å²	53.3	45%	0.448	26%	0.259	S	S	.	.	S	Bend	trans	-127	-3.5	-173.4	61.2	0	0	0	0	114.8	D190 T213	D190-T192 PolarHBondContact O-N 3.28Å; T192-T213 CarbonylContact C-O 3.51Å; T192-T213 WeakPolarHBondContact CA-O 3.48Å; T192-T213 PolarHBondContact O-N 2.99Å; T192-T213 VanDerWaalsContact O-O 3.04Å
193	W	90.2	Very high	90.1	Very high	99 Å²	99	56.8 Å²	56.8	38%	0.375	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	157.9	179.5	59.7	-76.7	0	0	0	112.3	D190 T195 T210 F211 T213	D190-W193 VanDerWaalsContact CB-CD1 3.44Å; D190-W193 HydrophobicContact CB-CD2 4.15Å; D190-W193 HydrophobicContact CB-CG 4.04Å; D190-W193 HydrophobicContact CB-CZ2 4.18Å; D190-W193 PolarHBondContact N-O 2.89Å; D190-W193 PolarHBondContact OD2-NE1 3.15Å; W193-T195 HydrophobicContact CE3-CG2 4Å; W193-T195 HydrophobicContact CH2-CG2 4.11Å; W193-T195 HydrophobicContact CZ3-CG2 3.29Å; W193-T210 HydrophobicContact CE3-CG2 3.92Å; W193-F211 CarbonylContact C-O 3.56Å; W193-F211 WeakPolarHBondContact CA-O 3.29Å; W193-F211 WeakPolarHBondContact CB-O 3.37Å; W193-T213 PolarHBondContact N-O 3.16Å
194	F	94.3	Very high	89.9	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	142.4	171.6	171.1	-105.8	0	0	0	108	M157 G188 R189 F196 F211 T213 I219 Y220 V223	M157-F194 HydrophobicContact CE-CD1 4.24Å; M157-F194 HydrophobicContact CE-CE1 4.3Å; M157-F194 HydrophobicContact SD-CD1 4.22Å; M157-F194 HydrophobicContact SD-CE1 4.15Å; G188-F194 VanDerWaalsContact O-CD2 3.25Å; G188-F194 WeakPolarHBondContact O-CD2 3.34Å; R189-F194 HydrophobicContact CB-CD2 4.27Å; F194-F196 AromaticContact CE1-CD1 3.71Å; F194-F196 HydrophobicContact CE1-CD1 3.71Å; F194-F196 HydrophobicContact CE1-CE1 4.39Å; F194-F196 HydrophobicContact CZ-CD1 4.26Å; F194-F211 HydrophobicContact CD1-CD2 4.05Å; F194-F211 PolarHBondContact N-O 2.99Å; F194-F211 WeakPolarHBondContact O-CB 3.46Å; F194-F211 PolarHBondContact O-N 3.47Å; F194-T213 HydrophobicContact CB-CG2 4.19Å; F194-I219 HydrophobicContact CB-CG2 4.5Å; F194-I219 HydrophobicContact CD1-CG2 3.57Å; F194-I219 HydrophobicContact CD2-CB 4.46Å; F194-I219 HydrophobicContact CD2-CG2 3.89Å; F194-I219 HydrophobicContact CE1-CG2 3.61Å; F194-I219 HydrophobicContact CE2-CG2 3.96Å; F194-I219 HydrophobicContact CG-CB 4.38Å; F194-I219 HydrophobicContact CG-CG2 3.71Å; F194-I219 HydrophobicContact CZ-CG2 3.83Å; F194-Y220 HydrophobicContact CE2-CD2 4.49Å; F194-V223 HydrophobicContact CZ-CB 4.42Å; F194-V223 HydrophobicContact CZ-CG2 3.93Å
195	T	94.9	Very high	89.5	Confident	3 Å²	3	57.4 Å²	57.4	2%	0.018	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	151.6	178.6	-168.6	0	0	0	0	111.8	Y187 G188 W193 L208 F209 F307	Y187-T195 CarbonylContact C-O 3.55Å; Y187-T195 VanDerWaalsContact CA-O 3.28Å; Y187-T195 WeakPolarHBondContact CA-O 3.43Å; G188-T195 PolarHBondContact N-O 3.39Å; G188-T195 PolarHBondContact O-N 3.42Å; G188-T195 VanDerWaalsContact O-O 3.12Å; W193-T195 HydrophobicContact CE3-CG2 4Å; W193-T195 HydrophobicContact CH2-CG2 4.11Å; W193-T195 HydrophobicContact CZ3-CG2 3.29Å; T195-L208 WeakPolarHBondContact OG1-CD1 3.22Å; T195-F209 WeakPolarHBondContact CA-O 3.42Å; T195-F209 WeakPolarHBondContact CB-O 3.43Å; T195-F209 PolarHBondContact OG1-O 2.82Å; T195-F307 HydrophobicContact CG2-CD2 4.25Å; T195-F307 HydrophobicContact CG2-CE2 4.16Å
196	F	95.6	Very high	89.4	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	155.5	165.3	67.3	-96.6	0	0	0	111.6	M157 I164 W179 L184 R186 F194 F209 F211	M157-F196 HydrophobicContact CE-CE1 4.37Å; I164-F196 HydrophobicContact CD1-CD1 4.48Å; I164-F196 HydrophobicContact CD1-CE1 4.4Å; W179-F196 HydrophobicContact CB-CE2 4.37Å; W179-F196 AromaticContact CD2-CE2 3.87Å; W179-F196 HydrophobicContact CD2-CE2 3.87Å; W179-F196 AromaticContact CD2-CZ 3.53Å; W179-F196 HydrophobicContact CD2-CZ 3.53Å; W179-F196 AromaticContact CE2-CZ 3.89Å; W179-F196 HydrophobicContact CE3-CE1 4.34Å; W179-F196 HydrophobicContact CE3-CE2 4.29Å; W179-F196 AromaticContact CE3-CZ 3.49Å; W179-F196 HydrophobicContact CE3-CZ 3.49Å; W179-F196 VanDerWaalsContact CE3-CZ 3.49Å; W179-F196 AromaticContact CG-CE2 3.88Å; W179-F196 HydrophobicContact CG-CE2 3.88Å; W179-F196 AromaticContact CG-CZ 3.98Å; W179-F196 HydrophobicContact CG-CZ 3.98Å; W179-F196 HydrophobicContact CH2-CZ 4.12Å; W179-F196 HydrophobicContact CZ2-CZ 4.2Å; W179-F196 HydrophobicContact CZ3-CE1 4.41Å; W179-F196 AromaticContact CZ3-CZ 3.74Å; W179-F196 HydrophobicContact CZ3-CZ 3.74Å; L184-F196 HydrophobicContact CD2-CB 4.42Å; L184-F196 HydrophobicContact CD2-CD2 3.41Å; L184-F196 VanDerWaalsContact CD2-CD2 3.41Å; L184-F196 HydrophobicContact CD2-CE2 3.86Å; L184-F196 HydrophobicContact CD2-CG 4.07Å; R186-F196 CarbonylContact O-C 3.55Å; R186-F196 VanDerWaalsContact O-CA 3.24Å; R186-F196 WeakPolarHBondContact O-CA 3.41Å; R186-F196 WeakPolarHBondContact O-CB 3.34Å; F194-F196 AromaticContact CE1-CD1 3.71Å; F194-F196 HydrophobicContact CE1-CD1 3.71Å; F194-F196 HydrophobicContact CE1-CE1 4.39Å; F194-F196 HydrophobicContact CZ-CD1 4.26Å; F196-F209 HydrophobicContact CD2-CD2 4.12Å; F196-F209 HydrophobicContact CE1-CB 4.27Å; F196-F209 HydrophobicContact CE2-CB 4.21Å; F196-F209 AromaticContact CE2-CD2 3.47Å; F196-F209 HydrophobicContact CE2-CD2 3.47Å; F196-F209 VanDerWaalsContact CE2-CD2 3.47Å; F196-F209 HydrophobicContact CE2-CE2 4.24Å; F196-F209 HydrophobicContact CE2-CG 4.18Å; F196-F209 HydrophobicContact CZ-CB 4Å; F196-F209 AromaticContact CZ-CD2 3.9Å; F196-F209 HydrophobicContact CZ-CD2 3.9Å; F196-F209 HydrophobicContact CZ-CG 4.18Å; F196-F209 PolarHBondContact N-O 3.17Å; F196-F209 PolarHBondContact O-N 2.99Å; F196-F211 HydrophobicContact CD1-CD2 4.42Å; F196-F211 AromaticContact CD1-CE2 3.78Å; F196-F211 HydrophobicContact CD1-CE2 3.78Å; F196-F211 HydrophobicContact CE1-CD2 4.19Å; F196-F211 AromaticContact CE1-CE2 3.22Å; F196-F211 HydrophobicContact CE1-CE2 3.22Å; F196-F211 AromaticContact CE1-CZ 3.77Å; F196-F211 HydrophobicContact CE1-CZ 3.77Å; F196-F211 AromaticContact CZ-CE2 3.96Å; F196-F211 HydrophobicContact CZ-CE2 3.96Å; F196-F211 HydrophobicContact CZ-CZ 4.19Å
197	E	95.1	Very high	89.3	Confident	43 Å²	43	54.2 Å²	54.2	20%	0.201	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	120.7	172.6	-171.4	-166.9	148.1	0	0	109.2	R185 R186 G207 L208	R185-E197 HydrophobicContact CB-CB 4.46Å; R185-E197 HydrophobicContact CB-CG 4.48Å; R185-E197 WeakPolarHBondContact CD-OE1 3.34Å; R185-E197 IonicContact CZ-OE1 3.86Å; R185-E197 PolarHBondContact N-O 3.4Å; R185-E197 IonicContact NE-OE1 3.99Å; R185-E197 IonicContact NH1-OE1 2.81Å; R185-E197 PolarHBondContact NH1-OE1 2.87Å; R186-E197 HydrophobicContact CB-CB 4.28Å; R186-E197 PolarHBondContact O-N 2.98Å; E197-G207 CarbonylContact C-O 3.49Å; E197-G207 VanDerWaalsContact CA-O 3.3Å; E197-G207 WeakPolarHBondContact CA-O 3.38Å; E197-L208 HydrophobicContact CB-CD1 4.29Å
198	S	93.4	Very high	89.1	Confident	0 Å²	0	58 Å²	58	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	148	172.4	63.1	0	0	0	0	111.5	G205 E206 G207 F209	S198-G205 PolarHBondContact OG-O 3.2Å; S198-E206 WeakPolarHBondContact O-CA 3.28Å; S198-G207 PolarHBondContact N-O 2.82Å; S198-G207 PolarHBondContact O-N 3.07Å; S198-G207 PolarHBondContact OG-N 2.85Å; S198-G207 VanDerWaalsContact OG-N 3.13Å; S198-G207 PolarHBondContact OG-O 3.2Å; S198-F209 WeakPolarHBondContact OG-CE2 3.11Å
199	G	89.2	Confident	89.2	Confident	7 Å²	7	57.9 Å²	57.9	7%	0.072	29%	0.292	C	S	.	.			trans	-80.6	171.9	167.8	0	0	0	0	0	113.4	S183 M201 C202 G205	S183-G199 PolarHBondContact O-N 2.92Å; G199-M201 PolarHBondContact O-N 2.87Å; G199-M201 VanDerWaalsContact O-N 3.14Å; G199-C202 PolarHBondContact O-N 2.88Å; G199-G205 CarbonylContact O-C 3.6Å
200	R	86.9	Confident	89.2	Confident	188 Å²	188	53.7 Å²	53.7	71%	0.709	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-17.7	178.8	-61.8	-179	-170.5	178.1	3.2	114.6	C202 E206	R200-C202 VanDerWaalsContact C-N 3.26Å; R200-E206 HydrophobicContact CG-CB 3.72Å; R200-E206 WeakPolarHBondContact CG-OE2 3.23Å; R200-E206 IonicContact CZ-OE2 3.58Å; R200-E206 IonicContact NE-OE2 2.73Å; R200-E206 PolarHBondContact NE-OE2 2.86Å; R200-E206 IonicContact NH2-OE2 3.01Å
201	M	81.6	Confident	89.4	Confident	160 Å²	160	50.7 Å²	50.7	79%	0.788	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-8.8	-179	-59.4	-56.3	-63.6	0	0	112.9	G199	G199-M201 PolarHBondContact O-N 2.87Å; G199-M201 VanDerWaalsContact O-N 3.14Å
202	C	86.1	Confident	89.8	Confident	7 Å²	7	51 Å²	51	5%	0.047	26%	0.256	C	S	.	.	S	Bend	trans	-78.3	148	174	-64.2	0	0	0	0	110.7	S183 G199 R200 T204 G205	S183-C202 WeakPolarHBondContact CB-SG 3.23Å; G199-C202 PolarHBondContact O-N 2.88Å; R200-C202 VanDerWaalsContact C-N 3.26Å; C202-T204 PolarHBondContact O-N 3.08Å; C202-T204 VanDerWaalsContact O-N 3.16Å; C202-G205 WeakPolarHBondContact O-CA 3.49Å; C202-G205 PolarHBondContact O-N 2.93Å
203	D	82.1	Confident	90	Very high	145 Å²	145	47.6 Å²	47.6	78%	0.775	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-28.8	177.3	-63.5	-27.7	0	0	0	112.9	G205	D203-G205 PolarHBondContact O-N 3.02Å
204	T	85.3	Confident	89.7	Confident	23 Å²	23	50.3 Å²	50.3	14%	0.141	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-4.3	173.9	61.8	0	0	0	0	114.2	V177 W179 C202 F209	V177-T204 HydrophobicContact CG1-CG2 3.33Å; W179-T204 HydrophobicContact CZ2-CG2 3.94Å; W179-T204 PolarHBondContact NE1-OG1 3.42Å; C202-T204 PolarHBondContact O-N 3.08Å; C202-T204 VanDerWaalsContact O-N 3.16Å; T204-F209 HydrophobicContact CG2-CZ 4.31Å
205	G	85.6	Confident	89.2	Confident	25 Å²	25	53.8 Å²	53.8	26%	0.258	26%	0.261	S	S	.	.			trans	71.2	-172.4	-168.5	0	0	0	0	0	114.1	S198 G199 C202 D203	S198-G205 PolarHBondContact OG-O 3.2Å; G199-G205 CarbonylContact O-C 3.6Å; C202-G205 WeakPolarHBondContact O-CA 3.49Å; C202-G205 PolarHBondContact O-N 2.93Å; D203-G205 PolarHBondContact O-N 3.02Å
206	E	88.9	Confident	88.9	Confident	73 Å²	73	53.6 Å²	53.6	34%	0.341	26%	0.261	S	S	.	.	S	Bend	trans	-75.3	120.9	176.6	170.3	177.9	172.7	0	0	110.5	N148 R185 S198 R200	N148-E206 PolarHBondContact ND2-O 2.91Å; R185-E206 VanDerWaalsContact CZ-CD 3.46Å; R185-E206 IonicContact CZ-OE1 3.51Å; R185-E206 IonicContact CZ-OE2 2.57Å; R185-E206 IonicContact NH1-OE1 2.62Å; R185-E206 PolarHBondContact NH1-OE1 2.82Å; R185-E206 IonicContact NH1-OE2 3.99Å; R185-E206 PolarHBondContact NH1-OE2 2.78Å; R185-E206 IonicContact NH2-OE1 3.5Å; R185-E206 PolarHBondContact NH2-OE1 2.95Å; R185-E206 IonicContact NH2-OE2 3.75Å; R185-E206 PolarHBondContact NH2-OE2 2.8Å; S198-E206 WeakPolarHBondContact O-CA 3.28Å; R200-E206 HydrophobicContact CG-CB 3.72Å; R200-E206 WeakPolarHBondContact CG-OE2 3.23Å; R200-E206 IonicContact CZ-OE2 3.58Å; R200-E206 IonicContact NE-OE2 2.73Å; R200-E206 PolarHBondContact NE-OE2 2.86Å; R200-E206 IonicContact NH2-OE2 3.01Å
207	G	89.4	Confident	88.6	Confident	8 Å²	8	57 Å²	57	8%	0.082	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168	158	-177.1	0	0	0	0	0	114.5	N148 E197 S198	N148-G207 WeakPolarHBondContact ND2-CA 3.4Å; E197-G207 CarbonylContact C-O 3.49Å; E197-G207 VanDerWaalsContact CA-O 3.3Å; E197-G207 WeakPolarHBondContact CA-O 3.38Å; S198-G207 PolarHBondContact N-O 2.82Å; S198-G207 PolarHBondContact O-N 3.07Å; S198-G207 PolarHBondContact OG-N 2.85Å; S198-G207 VanDerWaalsContact OG-N 3.13Å; S198-G207 PolarHBondContact OG-O 3.2Å
208	L	91.9	Very high	88.3	Confident	87 Å²	87	59.7 Å²	59.7	46%	0.455	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	122.9	172.1	-175.3	71.3	0	0	0	109.7	T146 T195 E197 F307	T146-L208 WeakPolarHBondContact CG2-O 3.34Å; T195-L208 WeakPolarHBondContact OG1-CD1 3.22Å; E197-L208 HydrophobicContact CB-CD1 4.29Å; L208-F307 HydrophobicContact CD1-CE2 4.49Å; L208-F307 HydrophobicContact CD1-CZ 4.28Å
209	F	92.9	Very high	88.3	Confident	1 Å²	1	59.7 Å²	59.7	0%	0.004	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	126.7	176.7	-60.3	-78.9	0	0	0	110.2	L143 T146 L149 W179 T195 F196 S198 T204 F211	L143-F209 HydrophobicContact CD1-CD1 4.37Å; T146-F209 HydrophobicContact CG2-CD1 4.11Å; L149-F209 HydrophobicContact CB-CE1 3.98Å; L149-F209 HydrophobicContact CD2-CD1 4.43Å; L149-F209 HydrophobicContact CD2-CE1 3.98Å; W179-F209 AromaticContact CE2-CE2 3.85Å; W179-F209 HydrophobicContact CH2-CD1 4.42Å; W179-F209 AromaticContact CZ2-CD1 3.94Å; W179-F209 HydrophobicContact CZ2-CD1 3.94Å; W179-F209 HydrophobicContact CZ2-CD2 4.03Å; W179-F209 AromaticContact CZ2-CE1 3.8Å; W179-F209 HydrophobicContact CZ2-CE1 3.8Å; W179-F209 AromaticContact CZ2-CE2 3.86Å; W179-F209 HydrophobicContact CZ2-CE2 3.86Å; W179-F209 HydrophobicContact CZ2-CG 4.06Å; W179-F209 AromaticContact CZ2-CZ 3.76Å; W179-F209 HydrophobicContact CZ2-CZ 3.76Å; W179-F209 AromaticContact NE1-CE2 3.51Å; W179-F209 AromaticContact NE1-CZ 3.87Å; T195-F209 WeakPolarHBondContact CA-O 3.42Å; T195-F209 WeakPolarHBondContact CB-O 3.43Å; T195-F209 PolarHBondContact OG1-O 2.82Å; F196-F209 HydrophobicContact CD2-CD2 4.12Å; F196-F209 HydrophobicContact CE1-CB 4.27Å; F196-F209 HydrophobicContact CE2-CB 4.21Å; F196-F209 AromaticContact CE2-CD2 3.47Å; F196-F209 HydrophobicContact CE2-CD2 3.47Å; F196-F209 VanDerWaalsContact CE2-CD2 3.47Å; F196-F209 HydrophobicContact CE2-CE2 4.24Å; F196-F209 HydrophobicContact CE2-CG 4.18Å; F196-F209 HydrophobicContact CZ-CB 4Å; F196-F209 AromaticContact CZ-CD2 3.9Å; F196-F209 HydrophobicContact CZ-CD2 3.9Å; F196-F209 HydrophobicContact CZ-CG 4.18Å; F196-F209 PolarHBondContact N-O 3.17Å; F196-F209 PolarHBondContact O-N 2.99Å; S198-F209 WeakPolarHBondContact OG-CE2 3.11Å; T204-F209 HydrophobicContact CG2-CZ 4.31Å; F209-F211 HydrophobicContact CB-CD2 4.5Å; F209-F211 HydrophobicContact CB-CE2 3.53Å; F209-F211 HydrophobicContact CB-CZ 3.91Å
210	T	93	Very high	88.5	Confident	37 Å²	37	61.4 Å²	61.4	23%	0.227	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	125.5	-178.8	-56.9	0	0	0	0	109.8	M144 W193	M144-T210 WeakPolarHBondContact CB-O 3.02Å; M144-T210 HydrophobicContact CG-CG2 4.04Å; M144-T210 WeakPolarHBondContact CG-O 3.39Å; M144-T210 PolarHBondContact N-O 3.13Å; W193-T210 HydrophobicContact CE3-CG2 3.92Å
211	F	93.3	Very high	88.7	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	117.9	-177.4	-61.1	-85.9	0	0	0	109.3	V141 Y142 L143 M157 L166 W179 W193 F194 F196 F209	V141-F211 HydrophobicContact CB-CB 4.17Å; V141-F211 HydrophobicContact CB-CD1 4.17Å; V141-F211 HydrophobicContact CG2-CD1 3.7Å; V141-F211 HydrophobicContact CG2-CE1 4.38Å; Y142-F211 CarbonylContact O-C 3.54Å; Y142-F211 WeakPolarHBondContact O-CA 3.4Å; L143-F211 HydrophobicContact CB-CD1 4.18Å; L143-F211 HydrophobicContact CB-CE1 4.05Å; L143-F211 HydrophobicContact CD1-CD1 4.13Å; L143-F211 HydrophobicContact CD1-CE1 3.61Å; L143-F211 HydrophobicContact CD1-CZ 3.86Å; L143-F211 HydrophobicContact CG-CE1 4.29Å; M157-F211 HydrophobicContact CE-CB 4.49Å; M157-F211 HydrophobicContact CE-CD1 3.57Å; M157-F211 HydrophobicContact CE-CD2 3.61Å; M157-F211 HydrophobicContact CE-CE1 3.51Å; M157-F211 HydrophobicContact CE-CE2 3.59Å; M157-F211 HydrophobicContact CE-CG 3.6Å; M157-F211 HydrophobicContact CE-CZ 3.52Å; L166-F211 HydrophobicContact CD1-CE1 3.78Å; L166-F211 HydrophobicContact CD1-CZ 4.14Å; L166-F211 HydrophobicContact CD2-CE1 3.78Å; L166-F211 HydrophobicContact CD2-CZ 4.4Å; L166-F211 HydrophobicContact CG-CE1 4.36Å; W179-F211 HydrophobicContact CH2-CZ 4.17Å; W179-F211 HydrophobicContact CZ3-CZ 4.18Å; W193-F211 CarbonylContact C-O 3.56Å; W193-F211 WeakPolarHBondContact CA-O 3.29Å; W193-F211 WeakPolarHBondContact CB-O 3.37Å; F194-F211 HydrophobicContact CD1-CD2 4.05Å; F194-F211 PolarHBondContact N-O 2.99Å; F194-F211 WeakPolarHBondContact O-CB 3.46Å; F194-F211 PolarHBondContact O-N 3.47Å; F196-F211 HydrophobicContact CD1-CD2 4.42Å; F196-F211 AromaticContact CD1-CE2 3.78Å; F196-F211 HydrophobicContact CD1-CE2 3.78Å; F196-F211 HydrophobicContact CE1-CD2 4.19Å; F196-F211 AromaticContact CE1-CE2 3.22Å; F196-F211 HydrophobicContact CE1-CE2 3.22Å; F196-F211 AromaticContact CE1-CZ 3.77Å; F196-F211 HydrophobicContact CE1-CZ 3.77Å; F196-F211 AromaticContact CZ-CE2 3.96Å; F196-F211 HydrophobicContact CZ-CE2 3.96Å; F196-F211 HydrophobicContact CZ-CZ 4.19Å; F209-F211 HydrophobicContact CB-CD2 4.5Å; F209-F211 HydrophobicContact CB-CE2 3.53Å; F209-F211 HydrophobicContact CB-CZ 3.91Å
212	Q	91.3	Very high	89.1	Confident	91 Å²	91	54.5 Å²	54.5	43%	0.425	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	123.4	171.3	173.2	172.4	81.7	0	0	109.3	S36 Y142	S36-Q212 WeakPolarHBondContact CB-O 3.42Å; Y142-Q212 PolarHBondContact N-O 2.83Å; Y142-Q212 PolarHBondContact O-N 2.79Å
213	T	88.7	Confident	89.5	Confident	3 Å²	3	54.2 Å²	54.2	2%	0.018	26%	0.262	C	S	.	.			trans	-165	147.4	-178.1	-178.7	0	0	0	0	110.9	N140 V141 T192 W193 F194 E215 I219	N140-T213 PolarHBondContact O-OG1 2.76Å; V141-T213 HydrophobicContact CG1-CG2 4.14Å; T192-T213 CarbonylContact C-O 3.51Å; T192-T213 WeakPolarHBondContact CA-O 3.48Å; T192-T213 PolarHBondContact O-N 2.99Å; T192-T213 VanDerWaalsContact O-O 3.04Å; W193-T213 PolarHBondContact N-O 3.16Å; F194-T213 HydrophobicContact CB-CG2 4.19Å; T213-E215 VanDerWaalsContact C-N 3.32Å; T213-E215 PolarHBondContact OG1-N 3.26Å; T213-I219 HydrophobicContact CG2-CD1 3.66Å
214	R	83.8	Confident	90	Very high	155 Å²	155	50.1 Å²	50.1	59%	0.585	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-16.4	172.5	-66.3	-172.6	174.3	-173.7	0.7	113.1	K37 G216	K37-R214 VanDerWaalsContact O-CD 3.32Å; K37-R214 WeakPolarHBondContact O-CD 3.36Å; K37-R214 PolarHBondContact O-NE 2.94Å; R214-G216 VanDerWaalsContact C-N 3.27Å; R214-G216 PolarHBondContact O-N 3.46Å
215	E	84.9	Confident	90.3	Very high	73 Å²	73	52.8 Å²	52.8	34%	0.341	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	22.3	-177.7	-60.4	179.7	113.2	0	0	111.5	F139 T213 E217 M218 I219	F139-E215 HydrophobicContact CD1-CB 3.89Å; F139-E215 HydrophobicContact CE1-CB 4.41Å; T213-E215 VanDerWaalsContact C-N 3.32Å; T213-E215 PolarHBondContact OG1-N 3.26Å; E215-E217 VanDerWaalsContact C-N 3.28Å; E215-E217 PolarHBondContact O-N 3.35Å; E215-M218 PolarHBondContact O-N 2.9Å; E215-M218 VanDerWaalsContact O-N 3.08Å; E215-I219 WeakPolarHBondContact O-CG1 3.12Å; E215-I219 PolarHBondContact O-N 2.62Å
216	G	88.3	Confident	90.6	Very high	0 Å²	0	52 Å²	52	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-57.5	-36.7	-174.9	0	0	0	0	0	113.7	R214 Y220	R214-G216 VanDerWaalsContact C-N 3.27Å; R214-G216 PolarHBondContact O-N 3.46Å; G216-Y220 VanDerWaalsContact O-CB 3.3Å; G216-Y220 WeakPolarHBondContact O-CB 3.29Å; G216-Y220 PolarHBondContact O-N 2.94Å
217	E	89.6	Confident	90.7	Very high	70 Å²	70	49.6 Å²	49.6	33%	0.327	24%	0.24	S	C	.	.	H	α-helix	trans	-64.2	-46.3	174.6	177	59.9	-170.9	0	0	112.2	R189 E215 I219 Y220 Q221	R189-E217 WeakPolarHBondContact CD-OE2 3.14Å; R189-E217 IonicContact CZ-OE2 2.95Å; R189-E217 IonicContact NE-OE2 3.88Å; R189-E217 PolarHBondContact NE-OE2 2.81Å; R189-E217 IonicContact NH1-OE2 3.75Å; R189-E217 IonicContact NH2-OE1 2.76Å; R189-E217 IonicContact NH2-OE2 3.35Å; R189-E217 PolarHBondContact NH2-OE2 2.95Å; E215-E217 VanDerWaalsContact C-N 3.28Å; E215-E217 PolarHBondContact O-N 3.35Å; E217-I219 VanDerWaalsContact C-N 3.35Å; E217-I219 PolarHBondContact O-N 2.76Å; E217-Y220 PolarHBondContact O-N 3.35Å; E217-Q221 WeakPolarHBondContact O-CG 3.32Å; E217-Q221 PolarHBondContact O-N 3.36Å; E217-Q221 PolarHBondContact OE1-NE2 3Å
218	M	88.8	Confident	90.8	Very high	100 Å²	100	52 Å²	52	49%	0.493	25%	0.25	S	S	.	.	H	α-helix	trans	-65	-42.1	-179.6	-67.3	175.1	66.2	0	0	111.1	F139 E215 Q221 R222	F139-M218 HydrophobicContact CE1-CB 3.89Å; F139-M218 HydrophobicContact CE1-CE 4.11Å; F139-M218 HydrophobicContact CZ-CB 4.31Å; E215-M218 PolarHBondContact O-N 2.9Å; E215-M218 VanDerWaalsContact O-N 3.08Å; M218-Q221 PolarHBondContact O-N 3.11Å; M218-R222 VanDerWaalsContact O-CG 3.27Å; M218-R222 WeakPolarHBondContact O-CG 3.24Å; M218-R222 PolarHBondContact O-N 2.88Å
219	I	92.3	Very high	90.7	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61.5	-47.3	175.9	-66.4	163.3	0	0	0	110.1	F139 V141 M157 I159 F194 T213 E215 E217 Q221 R222 V223	F139-I219 HydrophobicContact CB-CD1 3.75Å; F139-I219 HydrophobicContact CB-CG1 3.89Å; F139-I219 HydrophobicContact CD1-CD1 4.29Å; F139-I219 HydrophobicContact CD1-CG1 3.76Å; F139-I219 HydrophobicContact CD2-CD1 4.48Å; F139-I219 HydrophobicContact CD2-CG1 3.69Å; F139-I219 HydrophobicContact CE1-CG1 4.18Å; F139-I219 HydrophobicContact CE2-CG1 4.13Å; F139-I219 HydrophobicContact CG-CD1 3.92Å; F139-I219 HydrophobicContact CG-CG1 3.48Å; F139-I219 VanDerWaalsContact CG-CG1 3.48Å; F139-I219 HydrophobicContact CZ-CG1 4.35Å; V141-I219 HydrophobicContact CG1-CD1 3.9Å; M157-I219 HydrophobicContact SD-CG2 3.81Å; I159-I219 HydrophobicContact CD1-CG1 4.47Å; I159-I219 HydrophobicContact CD1-CG2 4.07Å; F194-I219 HydrophobicContact CB-CG2 4.5Å; F194-I219 HydrophobicContact CD1-CG2 3.57Å; F194-I219 HydrophobicContact CD2-CB 4.46Å; F194-I219 HydrophobicContact CD2-CG2 3.89Å; F194-I219 HydrophobicContact CE1-CG2 3.61Å; F194-I219 HydrophobicContact CE2-CG2 3.96Å; F194-I219 HydrophobicContact CG-CB 4.38Å; F194-I219 HydrophobicContact CG-CG2 3.71Å; F194-I219 HydrophobicContact CZ-CG2 3.83Å; T213-I219 HydrophobicContact CG2-CD1 3.66Å; E215-I219 WeakPolarHBondContact O-CG1 3.12Å; E215-I219 PolarHBondContact O-N 2.62Å; E217-I219 VanDerWaalsContact C-N 3.35Å; E217-I219 PolarHBondContact O-N 2.76Å; I219-Q221 PolarHBondContact O-N 2.84Å; I219-R222 WeakPolarHBondContact O-CB 3.38Å; I219-R222 PolarHBondContact O-N 3.25Å; I219-V223 HydrophobicContact CG2-CG2 4.34Å; I219-V223 WeakPolarHBondContact O-CG2 3.24Å; I219-V223 PolarHBondContact O-N 2.86Å
220	Y	93.3	Very high	90.5	Very high	44 Å²	44	51.5 Å²	51.5	17%	0.173	25%	0.254	C	S	.	.	H	α-helix	trans	-58.7	-47.5	178.2	175.9	-90.9	0	0	0	112.1	Y187 R189 F194 G216 E217 R222 V223 H224 T306	Y187-Y220 AromaticContact CD2-CD2 3.81Å; Y187-Y220 HydrophobicContact CD2-CD2 3.81Å; Y187-Y220 AromaticContact CD2-CE2 3.5Å; Y187-Y220 HydrophobicContact CD2-CE2 3.5Å; Y187-Y220 HydrophobicContact CE2-CD2 4.31Å; Y187-Y220 AromaticContact CE2-CE2 3.75Å; Y187-Y220 HydrophobicContact CE2-CE2 3.75Å; R189-Y220 HydrophobicContact CB-CD2 4.08Å; R189-Y220 HydrophobicContact CB-CG 4.11Å; R189-Y220 HydrophobicContact CG-CD1 4.15Å; R189-Y220 HydrophobicContact CG-CD2 3.74Å; R189-Y220 HydrophobicContact CG-CE2 4.48Å; R189-Y220 HydrophobicContact CG-CG 3.55Å; F194-Y220 HydrophobicContact CE2-CD2 4.49Å; G216-Y220 VanDerWaalsContact O-CB 3.3Å; G216-Y220 WeakPolarHBondContact O-CB 3.29Å; G216-Y220 PolarHBondContact O-N 2.94Å; E217-Y220 PolarHBondContact O-N 3.35Å; Y220-R222 VanDerWaalsContact C-N 3.31Å; Y220-R222 PolarHBondContact O-N 3.45Å; Y220-V223 PolarHBondContact O-N 2.92Å; Y220-H224 HydrophobicContact CE1-CB 4.3Å; Y220-H224 WeakPolarHBondContact O-CB 3.48Å; Y220-H224 PolarHBondContact O-N 2.66Å; Y220-T306 HydrophobicContact CE2-CG2 4.49Å; Y220-T306 VanDerWaalsContact OH-CG2 3.23Å; Y220-T306 WeakPolarHBondContact OH-CG2 3.42Å
221	Q	91.4	Very high	90.3	Very high	108 Å²	108	51.7 Å²	51.7	51%	0.505	26%	0.259	S	S	.	.	H	α-helix	trans	-60.2	-42.2	178.2	-72.1	179.3	-0.3	0	0	111.8	E217 M218 I219 S225	E217-Q221 WeakPolarHBondContact O-CG 3.32Å; E217-Q221 PolarHBondContact O-N 3.36Å; E217-Q221 PolarHBondContact OE1-NE2 3Å; M218-Q221 PolarHBondContact O-N 3.11Å; I219-Q221 PolarHBondContact O-N 2.84Å; Q221-S225 WeakPolarHBondContact O-CB 3.22Å; Q221-S225 PolarHBondContact O-N 3.43Å
222	R	91.4	Very high	90.1	Very high	95 Å²	95	56.6 Å²	56.6	36%	0.358	28%	0.282	S	S	.	.	H	α-helix	trans	-60.8	-51	175.8	-74.4	-74	-164.5	132.4	-6.2	111.7	E137 F139 I159 M218 I219 Y220 A226	E137-R222 IonicContact OE1-CZ 3.22Å; E137-R222 IonicContact OE1-NH1 2.77Å; E137-R222 PolarHBondContact OE1-NH1 3.2Å; E137-R222 IonicContact OE1-NH2 2.75Å; E137-R222 PolarHBondContact OE1-NH2 3.39Å; E137-R222 IonicContact OE2-NH1 3.05Å; E137-R222 PolarHBondContact OE2-NH1 3.03Å; F139-R222 HydrophobicContact CE2-CG 4.42Å; F139-R222 HydrophobicContact CZ-CG 4.28Å; I159-R222 HydrophobicContact CB-CB 4.38Å; I159-R222 HydrophobicContact CG2-CB 4.29Å; M218-R222 VanDerWaalsContact O-CG 3.27Å; M218-R222 WeakPolarHBondContact O-CG 3.24Å; M218-R222 PolarHBondContact O-N 2.88Å; I219-R222 WeakPolarHBondContact O-CB 3.38Å; I219-R222 PolarHBondContact O-N 3.25Å; Y220-R222 VanDerWaalsContact C-N 3.31Å; Y220-R222 PolarHBondContact O-N 3.45Å; R222-A226 WeakPolarHBondContact O-CB 3.32Å; R222-A226 PolarHBondContact O-N 2.98Å
223	V	93.6	Very high	89.8	Confident	0 Å²	0	57 Å²	57	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-62.6	-45.4	179.1	171.3	0	0	0	0	111	I159 I164 L181 L184 Y187 F194 I219 Y220 A226 T227	I159-V223 HydrophobicContact CG1-CG2 3.86Å; I159-V223 HydrophobicContact CG2-CG2 3.92Å; I164-V223 HydrophobicContact CD1-CG1 4.33Å; I164-V223 HydrophobicContact CD1-CG2 3.83Å; I164-V223 HydrophobicContact CG1-CG2 4.43Å; L181-V223 HydrophobicContact CD2-CG1 3.88Å; L184-V223 HydrophobicContact CD1-CG1 4.08Å; Y187-V223 HydrophobicContact CD1-CG1 4.06Å; Y187-V223 HydrophobicContact CD2-CG1 4.26Å; Y187-V223 HydrophobicContact CE1-CG1 4.29Å; Y187-V223 HydrophobicContact CG-CG1 4.06Å; F194-V223 HydrophobicContact CZ-CB 4.42Å; F194-V223 HydrophobicContact CZ-CG2 3.93Å; I219-V223 HydrophobicContact CG2-CG2 4.34Å; I219-V223 WeakPolarHBondContact O-CG2 3.24Å; I219-V223 PolarHBondContact O-N 2.86Å; Y220-V223 PolarHBondContact O-N 2.92Å; V223-A226 PolarHBondContact O-N 3.12Å; V223-T227 WeakPolarHBondContact O-CB 3.3Å; V223-T227 PolarHBondContact O-N 2.93Å; V223-T227 PolarHBondContact O-OG1 3.03Å
224	H	92.8	Very high	89.6	Confident	60 Å²	60	61.1 Å²	61.1	28%	0.278	30%	0.303	S	S	.	.	H	α-helix	trans	-62.5	-48.1	-179.5	-173.9	61	0	0	0	111.6	Y187 Y220 T227 L228	Y187-H224 HydrophobicContact CE2-CB 3.95Å; Y187-H224 AromaticContact CE2-ND1 3.74Å; Y187-H224 AromaticContact CZ-ND1 3.75Å; Y187-H224 PolarHBondContact OH-ND1 2.93Å; Y220-H224 HydrophobicContact CE1-CB 4.3Å; Y220-H224 WeakPolarHBondContact O-CB 3.48Å; Y220-H224 PolarHBondContact O-N 2.66Å; H224-T227 PolarHBondContact O-N 3Å; H224-L228 WeakPolarHBondContact NE2-CD1 3.33Å; H224-L228 WeakPolarHBondContact O-CB 3.34Å; H224-L228 WeakPolarHBondContact O-CG 3.43Å; H224-L228 PolarHBondContact O-N 3.32Å
225	S	91.8	Very high	89.7	Confident	79 Å²	79	59 Å²	59	55%	0.552	30%	0.299	S	S	*	.	H	α-helix	trans	-60.8	-46.1	177.7	178.3	0	0	0	0	112.1	Q221 L228 A229	Q221-S225 WeakPolarHBondContact O-CB 3.22Å; Q221-S225 PolarHBondContact O-N 3.43Å; S225-L228 PolarHBondContact O-N 3.15Å; S225-A229 PolarHBondContact O-N 2.93Å
226	A	91.3	Very high	89.7	Confident	9 Å²	9	62 Å²	62	7%	0.074	31%	0.307	C	S	.	.	H	α-helix	trans	-64.7	-42.9	178.3	0	0	0	0	0	111.9	L181 R222 V223 L228 A229 I230	L181-A226 HydrophobicContact CD1-CB 3.47Å; L181-A226 VanDerWaalsContact CD1-CB 3.47Å; R222-A226 WeakPolarHBondContact O-CB 3.32Å; R222-A226 PolarHBondContact O-N 2.98Å; V223-A226 PolarHBondContact O-N 3.12Å; A226-L228 PolarHBondContact O-N 3.28Å; A226-A229 WeakPolarHBondContact O-CB 3.36Å; A226-A229 PolarHBondContact O-N 3.28Å; A226-I230 WeakPolarHBondContact O-CG1 3.49Å; A226-I230 PolarHBondContact O-N 2.83Å
227	T	91.9	Very high	89.5	Confident	22 Å²	22	67.3 Å²	67.3	14%	0.135	33%	0.333	C	S	.	.	H	α-helix	trans	-62	-42	177.2	-53.8	0	0	0	0	111.8	Y187 V223 H224 A229 I230 A231	Y187-T227 HydrophobicContact CE1-CG2 4.27Å; V223-T227 WeakPolarHBondContact O-CB 3.3Å; V223-T227 PolarHBondContact O-N 2.93Å; V223-T227 PolarHBondContact O-OG1 3.03Å; H224-T227 PolarHBondContact O-N 3Å; T227-A229 VanDerWaalsContact C-N 3.35Å; T227-I230 PolarHBondContact O-N 3.19Å; T227-A231 PolarHBondContact O-N 3.48Å
228	L	90.3	Very high	89.2	Confident	58 Å²	58	66.9 Å²	66.9	30%	0.304	33%	0.333	S	S	.	.	H	α-helix	trans	-63.5	-40.3	175.9	-74.7	176.9	0	0	0	112	H224 S225 A226 A231 Q232	H224-L228 WeakPolarHBondContact NE2-CD1 3.33Å; H224-L228 WeakPolarHBondContact O-CB 3.34Å; H224-L228 WeakPolarHBondContact O-CG 3.43Å; H224-L228 PolarHBondContact O-N 3.32Å; S225-L228 PolarHBondContact O-N 3.15Å; A226-L228 PolarHBondContact O-N 3.28Å; L228-A231 PolarHBondContact O-N 3.43Å; L228-Q232 WeakPolarHBondContact O-CG 3.3Å; L228-Q232 PolarHBondContact O-N 2.79Å
229	A	90.6	Very high	88.8	Confident	41 Å²	41	67 Å²	67	34%	0.339	33%	0.332	S	S	.	.	H	α-helix	trans	-62.4	-43.1	177.1	0	0	0	0	0	111.8	S225 A226 T227 Q232 Q233	S225-A229 PolarHBondContact O-N 2.93Å; A226-A229 WeakPolarHBondContact O-CB 3.36Å; A226-A229 PolarHBondContact O-N 3.28Å; T227-A229 VanDerWaalsContact C-N 3.35Å; A229-Q232 PolarHBondContact O-N 3.04Å; A229-Q233 WeakPolarHBondContact O-CG 2.91Å; A229-Q233 PolarHBondContact O-N 3.31Å
230	I	89.4	Confident	88.3	Confident	37 Å²	37	73.4 Å²	73.4	19%	0.19	36%	0.362	C	S	.	.	H	α-helix	trans	-61	-45.9	175.6	-64.2	165.8	0	0	0	110.7	H161 L181 A226 T227 Q232 Q233 H234	H161-I230 WeakPolarHBondContact O-CD1 3.44Å; L181-I230 HydrophobicContact CB-CD1 3.54Å; L181-I230 HydrophobicContact CD1-CD1 4.02Å; L181-I230 HydrophobicContact CG-CD1 4.44Å; A226-I230 WeakPolarHBondContact O-CG1 3.49Å; A226-I230 PolarHBondContact O-N 2.83Å; T227-I230 PolarHBondContact O-N 3.19Å; I230-Q232 PolarHBondContact O-N 3.27Å; I230-Q233 PolarHBondContact O-N 3.1Å; I230-H234 PolarHBondContact O-N 3Å
231	A	87.4	Confident	87.5	Confident	41 Å²	41	77.3 Å²	77.3	34%	0.339	38%	0.384	S	S	.	.	H	α-helix	trans	-61	-45.3	179.9	0	0	0	0	0	112	T227 L228 Q233 H234 E235	T227-A231 PolarHBondContact O-N 3.48Å; L228-A231 PolarHBondContact O-N 3.43Å; A231-Q233 VanDerWaalsContact C-N 3.35Å; A231-Q233 PolarHBondContact O-N 2.8Å; A231-H234 PolarHBondContact O-N 3.1Å; A231-E235 WeakPolarHBondContact O-CG 3.38Å; A231-E235 PolarHBondContact O-N 2.8Å
232	Q	89.3	Confident	86.8	Confident	103 Å²	103	77.3 Å²	77.3	48%	0.481	38%	0.383	S	S	.	.	H	α-helix	trans	-63.9	-37.9	177.4	-71.7	173.9	-5.5	0	0	112.8	L228 A229 I230 R236	L228-Q232 WeakPolarHBondContact O-CG 3.3Å; L228-Q232 PolarHBondContact O-N 2.79Å; A229-Q232 PolarHBondContact O-N 3.04Å; I230-Q232 PolarHBondContact O-N 3.27Å; Q232-R236 WeakPolarHBondContact O-CG 3.5Å; Q232-R236 PolarHBondContact O-N 2.88Å; Q232-R236 VanDerWaalsContact O-N 3.09Å
233	Q	85.1	Confident	86	Confident	99 Å²	99	78.8 Å²	78.8	46%	0.463	39%	0.392	S	S	.	.	H	α-helix	trans	-64.4	-42.2	174.4	-76	175	-40.7	0	0	111.3	A229 I230 A231 R236 M237	A229-Q233 WeakPolarHBondContact O-CG 2.91Å; A229-Q233 PolarHBondContact O-N 3.31Å; I230-Q233 PolarHBondContact O-N 3.1Å; A231-Q233 VanDerWaalsContact C-N 3.35Å; A231-Q233 PolarHBondContact O-N 2.8Å; Q233-R236 PolarHBondContact O-N 3.42Å; Q233-M237 WeakPolarHBondContact O-CG 3.45Å; Q233-M237 PolarHBondContact O-N 3.27Å
234	H	84.4	Confident	85	Confident	90 Å²	90	81.8 Å²	81.8	42%	0.417	41%	0.414	S	S	.	.	H	α-helix	trans	-64.1	-41.9	177.5	-169.5	-123.1	0	0	0	112.2	I230 A231 M237 I238	I230-H234 PolarHBondContact O-N 3Å; A231-H234 PolarHBondContact O-N 3.1Å; H234-M237 PolarHBondContact O-N 3.32Å; H234-I238 VanDerWaalsContact O-CG1 3.31Å; H234-I238 WeakPolarHBondContact O-CG1 3.41Å; H234-I238 PolarHBondContact O-N 3.03Å
235	E	85.4	Confident	83.5	Confident	111 Å²	111	82.6 Å²	82.6	52%	0.519	43%	0.426	S	S	.	.	H	α-helix	trans	-60.3	-48.4	174.7	-74.2	171.4	-177	0	0	111.9	A231 M237 I238 E239	A231-E235 WeakPolarHBondContact O-CG 3.38Å; A231-E235 PolarHBondContact O-N 2.8Å; E235-M237 VanDerWaalsContact C-N 3.34Å; E235-M237 PolarHBondContact O-N 3.48Å; E235-I238 PolarHBondContact O-N 2.68Å; E235-E239 PolarHBondContact O-N 3.49Å
236	R	86.2	Confident	81.9	Confident	134 Å²	134	85 Å²	85	51%	0.506	43%	0.428	S	S	.	.	H	α-helix	trans	-59.1	-43	177.3	-75	-170.5	-68	-118	-1.8	112.8	Q232 Q233 I238 E239 E240	Q232-R236 WeakPolarHBondContact O-CG 3.5Å; Q232-R236 PolarHBondContact O-N 2.88Å; Q232-R236 VanDerWaalsContact O-N 3.09Å; Q233-R236 PolarHBondContact O-N 3.42Å; R236-I238 VanDerWaalsContact C-N 3.33Å; R236-I238 PolarHBondContact O-N 2.73Å; R236-E239 PolarHBondContact O-N 3.18Å; R236-E240 WeakPolarHBondContact O-CG 3.34Å; R236-E240 PolarHBondContact O-N 2.94Å
237	M	82.9	Confident	80.2	Confident	112 Å²	112	91.7 Å²	91.7	55%	0.552	46%	0.456	S	S	*	.	H	α-helix	trans	-63.9	-38.6	177.8	-73.2	-172.5	-64.5	0	0	112	Q233 H234 E235 E240 M241	Q233-M237 WeakPolarHBondContact O-CG 3.45Å; Q233-M237 PolarHBondContact O-N 3.27Å; H234-M237 PolarHBondContact O-N 3.32Å; E235-M237 VanDerWaalsContact C-N 3.34Å; E235-M237 PolarHBondContact O-N 3.48Å; M237-E240 PolarHBondContact O-N 3.15Å; M237-M241 WeakPolarHBondContact O-CB 3.26Å; M237-M241 PolarHBondContact O-N 3.45Å
238	I	83.1	Confident	78.3	Confident	62 Å²	62	97.1 Å²	97.1	32%	0.318	48%	0.48	S	S	.	.	H	α-helix	trans	-64.8	-45.3	176.3	-69	165.6	0	0	0	110.4	H234 E235 R236 E240 M241 E242	H234-I238 VanDerWaalsContact O-CG1 3.31Å; H234-I238 WeakPolarHBondContact O-CG1 3.41Å; H234-I238 PolarHBondContact O-N 3.03Å; E235-I238 PolarHBondContact O-N 2.68Å; R236-I238 VanDerWaalsContact C-N 3.33Å; R236-I238 PolarHBondContact O-N 2.73Å; I238-E240 VanDerWaalsContact C-N 3.33Å; I238-E240 PolarHBondContact O-N 3.28Å; I238-M241 PolarHBondContact O-N 2.86Å; I238-E242 HydrophobicContact CG2-CG 4.42Å; I238-E242 WeakPolarHBondContact O-CG 3.36Å; I238-E242 PolarHBondContact O-N 2.68Å
239	E	81.6	Confident	76.3	Confident	103 Å²	103	97 Å²	97	48%	0.481	48%	0.484	S	S	.	.	H	α-helix	trans	-62.7	-38	178.2	-70.8	-179.3	-174.2	0	0	112.9	E235 R236 E242 K243	E235-E239 PolarHBondContact O-N 3.49Å; R236-E239 PolarHBondContact O-N 3.18Å; E239-E242 PolarHBondContact O-N 3.39Å; E239-K243 WeakPolarHBondContact O-CB 3.28Å; E239-K243 VanDerWaalsContact O-CG 3.32Å; E239-K243 WeakPolarHBondContact O-CG 3.43Å; E239-K243 PolarHBondContact O-N 3.38Å
240	E	81.1	Confident	74.3	Confident	133 Å²	133	105 Å²	105	62%	0.621	51%	0.505	S	S	*	.	H	α-helix	trans	-67.8	-37.9	174.3	-74.7	179.1	178.3	0	0	112.1	R236 M237 I238 K243 S244	R236-E240 WeakPolarHBondContact O-CG 3.34Å; R236-E240 PolarHBondContact O-N 2.94Å; M237-E240 PolarHBondContact O-N 3.15Å; I238-E240 VanDerWaalsContact C-N 3.33Å; I238-E240 PolarHBondContact O-N 3.28Å; E240-K243 PolarHBondContact O-N 2.79Å; E240-S244 WeakPolarHBondContact O-CB 3.27Å; E240-S244 PolarHBondContact O-N 2.86Å; E240-S244 PolarHBondContact O-OG 2.66Å
241	M	76	Confident	72.3	Confident	127 Å²	127	110.4 Å²	110.4	63%	0.626	53%	0.53	S	S	*	.	H	α-helix	trans	-67.8	-37.9	175.1	-166.9	164.3	65	0	0	111.7	M237 I238 S244 S245	M237-M241 WeakPolarHBondContact O-CB 3.26Å; M237-M241 PolarHBondContact O-N 3.45Å; I238-M241 PolarHBondContact O-N 2.86Å; M241-S244 WeakPolarHBondContact CA-OG 3.41Å; M241-S244 PolarHBondContact O-OG 2.95Å; M241-S244 VanDerWaalsContact O-OG 3.05Å; M241-S245 WeakPolarHBondContact O-CB 3.44Å; M241-S245 PolarHBondContact O-N 2.91Å
242	E	76.6	Confident	70.2	Confident	107 Å²	107	113.6 Å²	113.6	50%	0.5	55%	0.545	S	S	.	.	H	α-helix	trans	-66.3	-43.3	173.1	-73.3	-175.4	162.9	0	0	111.9	I238 E239 S245 Q246	I238-E242 HydrophobicContact CG2-CG 4.42Å; I238-E242 WeakPolarHBondContact O-CG 3.36Å; I238-E242 PolarHBondContact O-N 2.68Å; E239-E242 PolarHBondContact O-N 3.39Å; E242-S245 PolarHBondContact O-N 2.96Å; E242-Q246 WeakPolarHBondContact O-CG 3.46Å; E242-Q246 PolarHBondContact O-N 2.95Å
243	K	75.9	Confident	68.2	Low	126 Å²	126	115.1 Å²	115.1	55%	0.548	56%	0.556	S	S	.	*	H	α-helix	trans	-64.8	-42.1	176.6	-77	169.9	-176.6	162.1	0	112.6	E239 E240 Q246 F247	E239-K243 WeakPolarHBondContact O-CB 3.28Å; E239-K243 VanDerWaalsContact O-CG 3.32Å; E239-K243 WeakPolarHBondContact O-CG 3.43Å; E239-K243 PolarHBondContact O-N 3.38Å; E240-K243 PolarHBondContact O-N 2.79Å; K243-Q246 PolarHBondContact O-N 2.87Å; K243-F247 PolarHBondContact O-N 3.04Å; K243-F247 VanDerWaalsContact O-N 3.09Å
244	S	71.5	Confident	66.3	Low	64 Å²	64	116.1 Å²	116.1	45%	0.448	57%	0.569	S	S	.	*	H	α-helix	trans	-69.3	-35.6	177.2	54.4	0	0	0	0	112.5	E240 M241 F247 H248	E240-S244 WeakPolarHBondContact O-CB 3.27Å; E240-S244 PolarHBondContact O-N 2.86Å; E240-S244 PolarHBondContact O-OG 2.66Å; M241-S244 WeakPolarHBondContact CA-OG 3.41Å; M241-S244 PolarHBondContact O-OG 2.95Å; M241-S244 VanDerWaalsContact O-OG 3.05Å; S244-F247 PolarHBondContact O-N 2.91Å; S244-H248 PolarHBondContact O-N 2.86Å
245	S	60.7	Low	64.6	Low	76 Å²	76	120.7 Å²	120.7	53%	0.531	59%	0.588	S	S	.	*	H	α-helix	trans	-66.7	-38.1	171.8	-176.5	0	0	0	0	112.7	M241 E242 F247 H248 S249	M241-S245 WeakPolarHBondContact O-CB 3.44Å; M241-S245 PolarHBondContact O-N 2.91Å; E242-S245 PolarHBondContact O-N 2.96Å; S245-F247 VanDerWaalsContact C-N 3.35Å; S245-F247 PolarHBondContact O-N 3.5Å; S245-H248 PolarHBondContact O-N 2.9Å; S245-S249 WeakPolarHBondContact O-CB 3.45Å; S245-S249 PolarHBondContact O-N 2.77Å; S245-S249 PolarHBondContact O-OG 3.41Å
246	Q	58.3	Low	62.4	Low	129 Å²	129	120.5 Å²	120.5	60%	0.603	60%	0.598	S	S	*	*	H	α-helix	trans	-66	-34	173.5	-78.3	-179.6	12.7	0	0	113.1	E242 K243 S249 R250	E242-Q246 WeakPolarHBondContact O-CG 3.46Å; E242-Q246 PolarHBondContact O-N 2.95Å; K243-Q246 PolarHBondContact O-N 2.87Å; Q246-S249 WeakPolarHBondContact CA-OG 3.19Å; Q246-S249 PolarHBondContact O-OG 2.95Å; Q246-R250 PolarHBondContact O-N 2.91Å
247	F	55.9	Low	60.5	Low	151 Å²	151	121.2 Å²	121.2	66%	0.662	61%	0.611	S	S	*	*	H	α-helix	trans	-70.5	-43.7	173.8	-99.2	-92.9	0	0	0	112.2	K243 S244 S245 S249 R250 E251	K243-F247 PolarHBondContact O-N 3.04Å; K243-F247 VanDerWaalsContact O-N 3.09Å; S244-F247 PolarHBondContact O-N 2.91Å; S245-F247 VanDerWaalsContact C-N 3.35Å; S245-F247 PolarHBondContact O-N 3.5Å; F247-S249 VanDerWaalsContact C-N 3.34Å; F247-S249 PolarHBondContact O-N 2.88Å; F247-R250 PolarHBondContact O-N 2.82Å; F247-E251 PolarHBondContact O-N 3.3Å
248	H	52.3	Low	58.5	Low	136 Å²	136	121.2 Å²	121.2	63%	0.63	62%	0.622	S	S	*	*	H	α-helix	trans	-65.5	-33.6	176.7	-99.3	78.1	0	0	0	113.4	S244 S245 T252	S244-H248 PolarHBondContact O-N 2.86Å; S245-H248 PolarHBondContact O-N 2.9Å; H248-T252 PolarHBondContact O-N 2.98Å; H248-T252 PolarHBondContact O-OG1 3.04Å
249	S	48.6	Very low	56.7	Low	56 Å²	56	125.8 Å²	125.8	39%	0.392	65%	0.646	S	S	.	*	H	α-helix	trans	-75.3	-24	175.2	46.8	0	0	0	0	113.3	S245 Q246 F247	S245-S249 WeakPolarHBondContact O-CB 3.45Å; S245-S249 PolarHBondContact O-N 2.77Å; S245-S249 PolarHBondContact O-OG 3.41Å; Q246-S249 WeakPolarHBondContact CA-OG 3.19Å; Q246-S249 PolarHBondContact O-OG 2.95Å; F247-S249 VanDerWaalsContact C-N 3.34Å; F247-S249 PolarHBondContact O-N 2.88Å
250	R	47.8	Very low	54.9	Low	209 Å²	209	126.5 Å²	126.5	79%	0.789	66%	0.659	S	S	*	*	H	α-helix	trans	-76.5	-28	171.2	-104.2	171.1	76.9	154.7	-0.3	113.8	Q246 F247	Q246-R250 PolarHBondContact O-N 2.91Å; F247-R250 PolarHBondContact O-N 2.82Å
251	E	47.3	Very low	53.2	Low	150 Å²	150	132.1 Å²	132.1	70%	0.701	68%	0.675	S	S	*	*	H	α-helix	trans	-84.9	-23.7	176.2	-69.5	-170.5	165.2	0	0	113.3	F247	F247-E251 PolarHBondContact O-N 3.3Å
252	T	43.9	Very low	51.5	Low	107 Å²	107	130.4 Å²	130.4	66%	0.656	68%	0.675	S	S	*	*	H	α-helix	trans	-88.9	-6.3	176.6	42.2	0	0	0	0	114.9	H248	H248-T252 PolarHBondContact O-N 2.98Å; H248-T252 PolarHBondContact O-OG1 3.04Å
253	L	46.9	Very low	50.2	Low	135 Å²	135	129.3 Å²	129.3	71%	0.707	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.2	24.9	-179.1	-127.1	100.5	0	0	0	115.9
254	T	46.4	Very low	48.9	Very low	121 Å²	121	131.3 Å²	131.3	74%	0.742	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.1	4.8	171.4	52.6	0	0	0	0	115.3
255	K	48.2	Very low	47.4	Very low	186 Å²	186	137.6 Å²	137.6	81%	0.809	70%	0.704	S	S	*	*			trans	-141	59.1	166.8	-69.6	-172.7	-179.7	172.5	0	112.9	I257	K255-I257 VanDerWaalsContact C-N 3.34Å; K255-I257 PolarHBondContact O-N 2.97Å; K255-I257 VanDerWaalsContact O-N 3.17Å
256	S	39	Very low	46.7	Very low	106 Å²	106	141.7 Å²	141.7	74%	0.741	72%	0.715	S	S	*	*			trans	-79	88	157.6	61.3	0	0	0	0	108.8	S258	S256-S258 PolarHBondContact O-N 3.06Å
257	I	46.6	Very low	46	Very low	149 Å²	149	143.2 Å²	143.2	76%	0.764	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-66.2	117.2	162.7	-68.7	171.4	0	0	0	106.4	K255 L259	K255-I257 VanDerWaalsContact C-N 3.34Å; K255-I257 PolarHBondContact O-N 2.97Å; K255-I257 VanDerWaalsContact O-N 3.17Å; I257-L259 PolarHBondContact O-N 3.47Å
258	S	41.2	Very low	45.5	Very low	112 Å²	112	141.5 Å²	141.5	78%	0.783	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-59.8	117.2	172.8	38.2	0	0	0	0	109.9	S256	S256-S258 PolarHBondContact O-N 3.06Å
259	L	45.5	Very low	44.8	Very low	159 Å²	159	141.3 Å²	141.3	83%	0.832	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-74.1	133	169.6	-73	165.1	0	0	0	109.2	I257	I257-L259 PolarHBondContact O-N 3.47Å
260	P	44	Very low	44.5	Very low	117 Å²	117	149.6 Å²	149.6	76%	0.76	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-65.9	135.8	178.5	24.5	-29.8	0	0	0	110.7	S262	P260-S262 PolarHBondContact O-N 2.88Å; P260-S262 VanDerWaalsContact O-N 3.1Å
261	R	44.3	Very low	43.9	Very low	252 Å²	252	149.2 Å²	149.2	95%	0.951	76%	0.756	S	S	*	*			trans	-53	113.4	174.7	-87.9	175.8	154.9	163	-6.5	110.1	A263	R261-A263 PolarHBondContact O-N 2.9Å
262	S	39.6	Very low	43.3	Very low	91 Å²	91	146.9 Å²	146.9	64%	0.636	76%	0.763	S	S	*	*			trans	-62.4	128.8	169.7	174.8	0	0	0	0	110.7	P260 Y264	P260-S262 PolarHBondContact O-N 2.88Å; P260-S262 VanDerWaalsContact O-N 3.1Å; S262-Y264 PolarHBondContact O-N 2.9Å
263	A	51.1	Low	42.7	Very low	83 Å²	83	146.5 Å²	146.5	69%	0.686	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	25.1	-179.2	0	0	0	0	0	114.1	R261	R261-A263 PolarHBondContact O-N 2.9Å
264	Y	46.8	Very low	42	Very low	168 Å²	168	147.1 Å²	147.1	66%	0.659	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	-15.8	-176.1	-172.3	-108	0	0	0	114	S262 Q266	S262-Y264 PolarHBondContact O-N 2.9Å; Y264-Q266 PolarHBondContact O-N 3.48Å
265	W	41.8	Very low	41.3	Very low	197 Å²	197	145 Å²	145	75%	0.746	78%	0.776	S	S	*	*	G	3₁₀ helix	trans	-85	-3.3	-175.8	-71	106.6	0	0	0	115.4	H267 I268	W265-H267 PolarHBondContact O-N 3.36Å; W265-I268 HydrophobicContact CE3-CD1 4.14Å; W265-I268 HydrophobicContact CZ3-CD1 4.04Å
266	Q	45.5	Very low	40.5	Very low	162 Å²	162	143.5 Å²	143.5	76%	0.757	78%	0.777	S	S	*	*	G	3₁₀ helix	trans	-85.3	-2.1	-174.4	-67.9	-76.5	-23.3	0	0	114.4	Y264	Y264-Q266 PolarHBondContact O-N 3.48Å
267	H	43.6	Very low	40.1	Very low	161 Å²	161	146.3 Å²	146.3	75%	0.745	78%	0.782	S	S	*	*	G	3₁₀ helix	trans	-108.6	-4.3	-174.2	-70.3	-67.2	0	0	0	115.8	W265	W265-H267 PolarHBondContact O-N 3.36Å
268	I	45.3	Very low	39.3	Very low	115 Å²	115	149.1 Å²	149.1	59%	0.59	79%	0.785	S	S	*	*	S	Bend	trans	-90	-19.3	-171.8	-60.1	178	0	0	0	113.2	W265	W265-I268 HydrophobicContact CE3-CD1 4.14Å; W265-I268 HydrophobicContact CZ3-CD1 4.04Å
269	T	36.7	Very low	38.6	Very low	132 Å²	132	148.6 Å²	148.6	81%	0.81	78%	0.781	S	S	*	*	S	Bend	trans	-104.3	29.7	-174.1	39.7	0	0	0	0	115.2
270	R	42.4	Very low	38	Very low	230 Å²	230	151.8 Å²	151.8	87%	0.868	78%	0.784	S	S	*	*			trans	-145.8	56.4	179.1	-130	178.3	-179.3	-105.4	-0.3	115.7
271	Q	36.7	Very low	37.2	Very low	200 Å²	200	155.3 Å²	155.3	94%	0.935	79%	0.79	S	S	*	*			trans	-141	111.1	148.3	-71.9	-163.2	-20.6	0	0	110.1
272	A	34.3	Very low	36.5	Very low	102 Å²	102	146.5 Å²	146.5	84%	0.843	78%	0.778	S	S	*	*			trans	-93.6	143.2	157.5	0	0	0	0	0	107.7
273	S	31.6	Very low	36	Very low	99 Å²	99	148.2 Å²	148.2	69%	0.692	79%	0.789	S	S	*	*				161.7	131.1	125.8	-164.1	0	0	0	0	113
274	V	31.7	Very low	35	Very low	147 Å²	147	148.2 Å²	148.2	89%	0.891	80%	0.797	S	S	*	*			trans	57.1	132.3	149.8	-64.7	0	0	0	0	122.4
275	G	32.2	Very low	34.2	Very low	77 Å²	77	144 Å²	144	79%	0.794	81%	0.805	S	S	*	*			trans	163.2	94.1	159.5	0	0	0	0	0	113.2
276	D	30.7	Very low	33.7	Very low	155 Å²	155	143 Å²	143	83%	0.829	81%	0.809	S	S	*	*			trans	-49.3	146.2	170	-70.6	-51.2	0	0	0	114.2
277	L	30.4	Very low	32.9	Very low	164 Å²	164	141.3 Å²	141.3	86%	0.859	80%	0.801	S	S	*	*				-169.2	114.4	129.4	-125.6	80.9	0	0	0	113.6
278	Y	29.5	Very low	32.3	Very low	209 Å²	209	142.7 Å²	142.7	82%	0.82	80%	0.8	S	S	*	*			trans	19.1	125.9	149.2	-76.1	-88.8	0	0	0	125
279	S	27.5	Very low	31.4	Very low	100 Å²	100	143.9 Å²	143.9	70%	0.699	81%	0.807	S	S	*	*				63.3	118.2	127.9	71.1	0	0	0	0	122.5
280	Y	31.5	Very low	31.1	Very low	227 Å²	227	143.6 Å²	143.6	89%	0.89	81%	0.805	S	S	*	*				-162.2	136.7	109.8	-141.3	-103.2	0	0	0	111.2
281	Q	28.9	Very low	30.3	Very low	191 Å²	191	140.8 Å²	140.8	89%	0.893	81%	0.807	S	S	*	*			trans	-65.9	148.2	175	-80.3	163.3	-55.6	0	0	112.3
282	G	28.2	Very low	30	Very low	67 Å²	67	142.1 Å²	142.1	69%	0.691	80%	0.804	S	S	*	*			trans	171.4	54.9	168.1	0	0	0	0	0	116.3
283	S	29.9	Very low	29.8	Very low	126 Å²	126	140.9 Å²	140.9	88%	0.881	80%	0.8	S	S	*	*			trans	21.3	120.2	145.1	45.4	0	0	0	0	121
284	G	29.5	Very low	29.8	Very low	83 Å²	83	141.6 Å²	141.6	86%	0.856	81%	0.813	S	S	*	*				120.1	113.6	127.7	0	0	0	0	0	117.8
285	G	30.6	Very low	29.7	Very low	80 Å²	80	137.9 Å²	137.9	83%	0.825	80%	0.803	S	S	*	*			trans	114.8	103.9	145.7	0	0	0	0	0	117.9
286	E	31.2	Very low	30	Very low	177 Å²	177	142.9 Å²	142.9	83%	0.827	81%	0.811	S	S	*	*			trans	-31.3	159	154.8	-73.9	161.6	107.4	0	0	115.5
287	E	29.4	Very low	30	Very low	126 Å²	126	141 Å²	141	59%	0.589	81%	0.811	S	S	*	*			cis	-170.1	154.8	8	-121.5	-172.3	138.5	0	0	107
288	R	29.5	Very low	30.2	Very low	189 Å²	189	142.1 Å²	142.1	71%	0.713	80%	0.803	S	S	*	*			trans	75.8	113.9	142.7	-73	177.8	-168.4	-172.3	10.3	123.4
289	L	27.8	Very low	30.4	Very low	141 Å²	141	138.9 Å²	138.9	74%	0.738	81%	0.805	S	S	*	*				83	113.6	120	-72.2	159.4	0	0	0	120.7
290	T	28.6	Very low	30.8	Very low	125 Å²	125	141.2 Å²	141.2	77%	0.767	80%	0.803	S	S	*	*			trans	67.9	101.8	140.7	62.7	0	0	0	0	118.9
291	D	26.3	Very low	31.3	Very low	171 Å²	171	136.3 Å²	136.3	91%	0.914	79%	0.791	S	S	*	*			trans	-106.5	135.1	149	-167.2	18.3	0	0	0	110.2
292	R	31.5	Very low	31.7	Very low	229 Å²	229	132.5 Å²	132.5	86%	0.864	78%	0.783	S	S	*	*			trans	-131.9	109.1	-162	-170.6	-172.5	-173.3	-161	2.3	105.9
293	G	28.6	Very low	32.4	Very low	75 Å²	75	138.5 Å²	138.5	77%	0.773	78%	0.784	S	S	*	*			trans	59.4	102.8	151.2	0	0	0	0	0	117.7	G295	G293-G295 PolarHBondContact O-N 3.41Å; G293-G295 VanDerWaalsContact O-N 3.09Å
294	A	31.4	Very low	32.7	Very low	115 Å²	115	133.4 Å²	133.4	95%	0.95	75%	0.75	S	S	*	*			trans	-63.7	105.1	159.6	0	0	0	0	0	110.4
295	G	30.8	Very low	33.8	Very low	68 Å²	68	135.6 Å²	135.6	70%	0.701	74%	0.738	S	S	*	*			trans	-95.4	132.8	165.5	0	0	0	0	0	110.5	G293 S297	G293-G295 PolarHBondContact O-N 3.41Å; G293-G295 VanDerWaalsContact O-N 3.09Å; G295-S297 PolarHBondContact O-N 2.81Å
296	L	37.5	Very low	34.7	Very low	182 Å²	182	134.9 Å²	134.9	95%	0.953	72%	0.718	S	S	*	*			trans	-56.4	123	174.8	-69.1	156.3	0	0	0	110.8	R298	L296-R298 PolarHBondContact O-N 3.49Å
297	S	31.3	Very low	34.9	Very low	117 Å²	117	130.1 Å²	130.1	82%	0.818	69%	0.694	S	S	*	*			trans	-77.3	112.9	179.5	31.2	0	0	0	0	111.7	G295 T299	G295-S297 PolarHBondContact O-N 2.81Å; S297-T299 PolarHBondContact O-N 3.07Å
298	R	34.5	Very low	35.4	Very low	187 Å²	187	128.8 Å²	128.8	71%	0.706	70%	0.697	S	S	*	*			trans	-63.4	118.8	162.1	-98.7	166	68.7	166.9	5	109	L296 F300	L296-R298 PolarHBondContact O-N 3.49Å; R298-F300 HydrophobicContact CB-CD2 4.36Å; R298-F300 HydrophobicContact CB-CE2 4.24Å; R298-F300 VanDerWaalsContact NH2-CZ 3.34Å; R298-F300 PolarHBondContact O-N 3.22Å; R298-F300 VanDerWaalsContact O-N 3.16Å
299	T	33.7	Very low	35.5	Very low	140 Å²	140	124.4 Å²	124.4	86%	0.859	70%	0.695	S	S	*	*			trans	-78.6	99	172.1	-29.6	0	0	0	0	109	S297	S297-T299 PolarHBondContact O-N 3.07Å
300	F	36.5	Very low	35.9	Very low	150 Å²	150	127.8 Å²	127.8	66%	0.658	70%	0.704	S	S	*	*			trans	-74.4	128.5	165	-81	-94.3	0	0	0	108.6	R298 P302	R298-F300 HydrophobicContact CB-CD2 4.36Å; R298-F300 HydrophobicContact CB-CE2 4.24Å; R298-F300 VanDerWaalsContact NH2-CZ 3.34Å; R298-F300 PolarHBondContact O-N 3.22Å; R298-F300 VanDerWaalsContact O-N 3.16Å; F300-P302 VanDerWaalsContact O-CD 3.3Å; F300-P302 WeakPolarHBondContact O-CD 2.96Å
301	I	41.7	Very low	36.2	Very low	124 Å²	124	128.9 Å²	128.9	64%	0.636	70%	0.704	S	S	*	*			trans	-75.5	115.8	166.3	-59.6	173.5	0	0	0	106.3	R303	I301-R303 PolarHBondContact O-N 3.45Å
302	P	37.6	Very low	36.5	Very low	111 Å²	111	126.4 Å²	126.4	72%	0.721	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-66.6	136.8	179.7	-16.2	30.3	0	0	0	110.4	F300 A304	F300-P302 VanDerWaalsContact O-CD 3.3Å; F300-P302 WeakPolarHBondContact O-CD 2.96Å; P302-A304 PolarHBondContact O-N 3.16Å
303	R	41.9	Very low	36.4	Very low	192 Å²	192	123.2 Å²	123.2	73%	0.725	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-54.9	129.3	169.5	-175.8	-178.9	178.7	111.9	-2.8	109.4	I301 Q305	I301-R303 PolarHBondContact O-N 3.45Å; R303-Q305 PolarHBondContact O-N 2.98Å
304	A	37.7	Very low	36.4	Very low	19 Å²	19	128.2 Å²	128.2	16%	0.157	70%	0.704	C	S	.	*	P	Polyproline II helix	trans	-61.6	126	177.3	0	0	0	0	0	110.5	L184 R185 Y187 P302	L184-A304 WeakPolarHBondContact O-CB 3.48Å; R185-A304 CarbonylContact O-C 3.57Å; R185-A304 WeakPolarHBondContact O-CA 3.2Å; R185-A304 VanDerWaalsContact O-CB 3.31Å; R185-A304 WeakPolarHBondContact O-CB 3.46Å; Y187-A304 HydrophobicContact CE1-CB 4.01Å; P302-A304 PolarHBondContact O-N 3.16Å
305	Q	51.4	Low	36.5	Very low	130 Å²	130	128.2 Å²	128.2	61%	0.607	69%	0.694	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-93	134.3	-177.9	-66.8	-175.9	-2.3	0	0	110.6	R185 R186 R303	R185-Q305 PolarHBondContact O-N 2.97Å; R186-Q305 WeakPolarHBondContact CA-O 3.18Å; R186-Q305 WeakPolarHBondContact CB-O 3.47Å; R186-Q305 HydrophobicContact CG-CB 4.33Å; R186-Q305 VanDerWaalsContact CG-O 3.24Å; R186-Q305 WeakPolarHBondContact CG-O 3.4Å; R186-Q305 PolarHBondContact NE-O 3.36Å; R303-Q305 PolarHBondContact O-N 2.98Å
306	T	48.9	Very low	36.4	Very low	64 Å²	64	134.2 Å²	134.2	39%	0.393	70%	0.704	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-72.1	152.1	173.5	53.8	0	0	0	0	110.4	R186 Y187 Y220	R186-T306 PolarHBondContact NH2-O 3.17Å; Y187-T306 HydrophobicContact CE2-CG2 4.39Å; Y220-T306 HydrophobicContact CE2-CG2 4.49Å; Y220-T306 VanDerWaalsContact OH-CG2 3.23Å; Y220-T306 WeakPolarHBondContact OH-CG2 3.42Å
307	F	36.9	Very low	36	Very low	77 Å²	77	134.9 Å²	134.9	34%	0.338	70%	0.702	S	S	.	*	P	Polyproline II helix	trans	-70.3	137.1	168.4	-80.2	-85.7	0	0	0	109.7	R186 T195 L208 S309	R186-F307 HydrophobicContact CB-CD2 4.4Å; R186-F307 HydrophobicContact CB-CE2 3.92Å; R186-F307 HydrophobicContact CB-CZ 4.48Å; T195-F307 HydrophobicContact CG2-CD2 4.25Å; T195-F307 HydrophobicContact CG2-CE2 4.16Å; L208-F307 HydrophobicContact CD1-CE2 4.49Å; L208-F307 HydrophobicContact CD1-CZ 4.28Å; F307-S309 PolarHBondContact O-N 2.83Å
308	P	38.3	Very low	35.9	Very low	99 Å²	99	138.6 Å²	138.6	64%	0.643	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-64.4	122.4	170.2	-13.8	27.3	0	0	0	109	F310	P308-F310 PolarHBondContact O-N 3.02Å
309	S	33.3	Very low	35.6	Very low	97 Å²	97	138.9 Å²	138.9	68%	0.678	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-65.2	119	167	36	0	0	0	0	108.9	F307 L311	F307-S309 PolarHBondContact O-N 2.83Å; S309-L311 VanDerWaalsContact C-N 3.29Å; S309-L311 PolarHBondContact O-N 3.38Å
310	F	35.5	Very low	35.4	Very low	211 Å²	211	143.9 Å²	143.9	93%	0.925	72%	0.719	S	S	*	*			trans	-65.2	91.9	167.1	-83.4	-87.7	0	0	0	108.4	P308	P308-F310 PolarHBondContact O-N 3.02Å
311	L	34.2	Very low	34.9	Very low	148 Å²	148	141.2 Å²	141.2	78%	0.775	72%	0.719	S	S	*	*			trans	-82.9	124.5	162.4	-70.7	172.5	0	0	0	107	S309 D313	S309-L311 VanDerWaalsContact C-N 3.29Å; S309-L311 PolarHBondContact O-N 3.38Å; L311-D313 PolarHBondContact O-N 3.09Å
312	S	33.8	Very low	34.4	Very low	119 Å²	119	144.9 Å²	144.9	83%	0.832	73%	0.734	S	S	*	*			trans	-63.6	124	173.5	-53.9	0	0	0	0	109.5	E314	S312-E314 PolarHBondContact O-N 3.06Å
313	D	29.1	Very low	34	Very low	163 Å²	163	149.6 Å²	149.6	87%	0.872	74%	0.737	S	S	*	*			trans	-60	114.2	168	-72.5	-43.8	0	0	0	109.5	L311	L311-D313 PolarHBondContact O-N 3.09Å
314	E	29.2	Very low	33.4	Very low	180 Å²	180	147.6 Å²	147.6	84%	0.841	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-88.4	128.2	157.1	-81.8	-114.4	97.8	0	0	107.6	S312	S312-E314 PolarHBondContact O-N 3.06Å
315	P	32	Very low	33	Very low	115 Å²	115	154.2 Å²	154.2	75%	0.747	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-79.3	129.2	178.2	30.5	-30.1	0	0	0	110.8	Q317	P315-Q317 PolarHBondContact O-N 2.91Å
316	E	29.1	Very low	31.9	Very low	194 Å²	194	154.7 Å²	154.7	91%	0.907	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-57.7	128	170.8	-63.6	177.3	136.3	0	0	110.8
317	Q	29.2	Very low	31	Very low	195 Å²	195	159.6 Å²	159.6	91%	0.911	78%	0.784	S	S	*	*			trans	-80.4	113.8	170.7	-82.4	179.8	-0.5	0	0	110	P315	P315-Q317 PolarHBondContact O-N 2.91Å
318	E	28.8	Very low	30.8	Very low	195 Å²	195	160.2 Å²	160.2	91%	0.911	80%	0.803	S	S	*	*			trans	-72.3	128.7	165.1	-81.3	-177	139.9	0	0	111.3
319	E	28.9	Very low	30.8	Very low	193 Å²	193	161.2 Å²	161.2	90%	0.902	81%	0.809	S	S	*	*			trans	-67.4	123.9	163	-73.5	-177.2	126.4	0	0	110.8
320	R	28.7	Very low	30.8	Very low	245 Å²	245	162.3 Å²	162.3	93%	0.925	82%	0.817	S	S	*	*			trans	-153.3	117.6	146.3	-125.9	176.1	-178.5	-171	0.9	113.6
321	S	27.2	Very low	30.9	Very low	95 Å²	95	157.7 Å²	157.7	66%	0.664	81%	0.808	S	S	*	*			trans	-37	136.5	164.9	51.4	0	0	0	0	116.5
322	H	29.8	Very low	30.7	Very low	201 Å²	201	155.9 Å²	155.9	93%	0.931	81%	0.808	S	S	*	*			trans	-155.3	141.1	138.7	-95.9	-72.7	0	0	0	111.5
323	R	30.6	Very low	30.8	Very low	209 Å²	209	156.2 Å²	156.2	79%	0.789	81%	0.81	S	S	*	*			trans	-91.1	158.2	-173.8	-102.9	-179	177.3	-151	3.5	113
324	H	28.9	Very low	30.7	Very low	151 Å²	151	151.8 Å²	151.8	70%	0.699	80%	0.803	S	S	*	*			trans	75.8	142.2	158.6	-60.2	-14.6	0	0	0	114.9
325	Q	28.9	Very low	30.9	Very low	157 Å²	157	149.1 Å²	149.1	73%	0.734	80%	0.803	S	S	*	*			cis	-168.5	151.7	26.8	-151.6	166.1	-1.9	0	0	111.5
326	E	29.6	Very low	30.9	Very low	141 Å²	141	152.6 Å²	152.6	66%	0.659	81%	0.809	S	S	*	*			trans	36.7	130.3	148.9	-76.2	164.1	104.4	0	0	125.7
327	E	28.5	Very low	31.3	Very low	167 Å²	167	148.8 Å²	148.8	78%	0.78	80%	0.804	S	S	*	*			trans	63.6	114.1	131.6	-72.2	-171.5	122.8	0	0	124.8
328	A	32.3	Very low	31.5	Very low	89 Å²	89	144.4 Å²	144.4	74%	0.736	80%	0.795	S	S	*	*				71	170.1	127.3	0	0	0	0	0	120.2
329	P	38.8	Very low	31.7	Very low	120 Å²	120	140.6 Å²	140.6	78%	0.779	79%	0.788	S	S	*	*				-124.9	169.9	-62.6	35.5	-21.8	0	0	0	112.7
330	S	34.7	Very low	32	Very low	120 Å²	120	136.2 Å²	136.2	84%	0.839	78%	0.779	S	S	*	*			trans	-70	152.5	173.7	-43.5	0	0	0	0	113.3
331	P	37.3	Very low	32.6	Very low	115 Å²	115	132.6 Å²	132.6	75%	0.747	78%	0.777	S	S	*	*			trans	-125.4	130.1	149	32.7	-18.7	0	0	0	113.6
332	S	29.7	Very low	33.6	Very low	110 Å²	110	139.5 Å²	139.5	77%	0.769	79%	0.789	S	S	*	*			trans	32.8	127.9	137.9	65.1	0	0	0	0	121.8
333	S	34.9	Very low	34.7	Very low	125 Å²	125	135.4 Å²	135.4	87%	0.874	78%	0.78	S	S	*	*				172.4	137.7	114.3	48.6	0	0	0	0	107
334	G	28.8	Very low	35.4	Very low	70 Å²	70	133.4 Å²	133.4	72%	0.722	78%	0.784	S	S	*	*			cis	129.5	95.7	14.3	0	0	0	0	0	108.3
335	C	32	Very low	36	Very low	124 Å²	124	138.8 Å²	138.8	84%	0.838	81%	0.81	S	S	*	*			trans	163.4	130.2	158	45.3	0	0	0	0	105.8
336	E	33.1	Very low	36.4	Very low	189 Å²	189	137.9 Å²	137.9	88%	0.883	81%	0.813	S	S	*	*				-151.2	144.8	57.7	-65.7	179.8	115.3	0	0	113.2
337	S	36	Very low	36.8	Very low	113 Å²	113	137.7 Å²	137.7	79%	0.79	82%	0.822	S	S	*	*			trans	-54.8	159.9	153.5	-47.9	0	0	0	0	110.6
338	S	34.6	Very low	37.2	Very low	103 Å²	103	136.1 Å²	136.1	72%	0.72	82%	0.824	S	S	*	*			cis	-175.8	160.7	6.9	30.9	0	0	0	0	108.1
339	C	33.1	Very low	37.5	Very low	115 Å²	115	138.9 Å²	138.9	78%	0.777	83%	0.829	S	S	*	*			trans	84.2	112.7	147.8	-74.2	0	0	0	0	121.1
340	S	34.9	Very low	37.4	Very low	101 Å²	101	140.1 Å²	140.1	71%	0.706	83%	0.832	S	S	*	*				91.1	102.2	123.6	-61.5	0	0	0	0	118.5
341	L	41	Very low	37.6	Very low	170 Å²	170	141.4 Å²	141.4	89%	0.89	83%	0.832	S	S	*	*				167.5	124.8	101.4	-91.1	148.8	0	0	0	110.2
342	R	48.1	Very low	37.6	Very low	240 Å²	240	143.3 Å²	143.3	91%	0.906	84%	0.838	S	S	*	*			trans	-70.3	161	164.9	-76.2	-175.7	171.2	-176.1	-3.4	110.2
343	P	53.2	Low	38.3	Very low	115 Å²	115	145.8 Å²	145.8	75%	0.747	84%	0.843	S	S	*	*				-132.7	143.5	115.1	20.1	-1.4	0	0	0	113.9
344	L	45.7	Very low	38.5	Very low	166 Å²	166	147.6 Å²	147.6	87%	0.869	84%	0.841	S	S	*	*			trans	29.1	109.5	139.2	-67	150.3	0	0	0	117.9
345	Q	41.7	Very low	39.4	Very low	265 Å²	265	154.6 Å²	154.6	100%	1.238	85%	0.851	S	S	*	*				-161.6	0	93.5	-141.8	169.1	-6.8	0	0	110.5

Retrieved 345 of 345 residues in 540.5 ms (Link to these results)

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