A0A075B7G3_HUMAN Loading...

Zinc finger protein 595

May be involved in transcriptional regulation.

AlphaFold DB , UniProt , Accession A0A075B7G3, Species HUMAN (Homo sapiens, Human), Gene ZNF595, Length 465 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	43.2	Very low	49	Very low	222 Å²	222	115.4 Å²	115.4	100%	1.094	61%	0.61	S	S	*	*				0	-17.3	0	-85.1	-145.8	-102.8	0	0	115.8	T5	M1-T5 PolarHBondContact O-OG1 3.36Å
2	S	50.5	Low	49.6	Very low	96 Å²	96	111.4 Å²	111.4	67%	0.671	61%	0.606	S	S	*	*	H	α-helix	trans	-83.5	-22.6	-178.2	68.5	0	0	0	0	115.8	T5	S2-T5 PolarHBondContact O-OG1 3.43Å
3	H	46	Very low	50.3	Low	156 Å²	156	107.2 Å²	107.2	72%	0.722	61%	0.605	S	S	*	*	H	α-helix	trans	-79.7	-24.8	178.6	-103.7	-113.6	0	0	0	113.4	H7	H3-H7 PolarHBondContact O-N 2.81Å
4	L	44.8	Very low	51	Low	132 Å²	132	108.6 Å²	108.6	69%	0.691	60%	0.604	S	S	*	*	H	α-helix	trans	-79.3	-38.6	-177.7	-157.4	71.6	0	0	0	111.7	Q6 H7 T8	L4-Q6 VanDerWaalsContact C-N 3.32Å; L4-Q6 PolarHBondContact O-N 2.72Å; L4-H7 PolarHBondContact O-N 3.14Å; L4-T8 PolarHBondContact O-N 3.47Å; L4-T8 PolarHBondContact O-OG1 3.07Å
5	T	50.5	Low	52.6	Low	100 Å²	100	109.6 Å²	109.6	61%	0.613	60%	0.6	S	S	*	*	H	α-helix	trans	-68.6	-26.2	174.1	22.7	0	0	0	0	113.6	M1 S2 T8	M1-T5 PolarHBondContact O-OG1 3.36Å; S2-T5 PolarHBondContact O-OG1 3.43Å; T5-T8 PolarHBondContact O-OG1 3.26Å
6	Q	51.8	Low	53.9	Low	109 Å²	109	108.1 Å²	108.1	51%	0.509	60%	0.597	S	S	.	*	H	α-helix	trans	-78.5	-24.9	174.3	-158.4	177.8	72.3	0	0	112.4	L4 I10	L4-Q6 VanDerWaalsContact C-N 3.32Å; L4-Q6 PolarHBondContact O-N 2.72Å; Q6-I10 VanDerWaalsContact O-CD1 3.3Å; Q6-I10 WeakPolarHBondContact O-CD1 3.41Å; Q6-I10 WeakPolarHBondContact O-CG1 3.17Å
7	H	51.3	Low	55.1	Low	112 Å²	112	107.6 Å²	107.6	52%	0.519	59%	0.585	S	S	.	*	H	α-helix	trans	-81.9	-36.6	178.6	-164	-86.3	0	0	0	112.2	H3 L4 I10 H11	H3-H7 PolarHBondContact O-N 2.81Å; L4-H7 PolarHBondContact O-N 3.14Å; H7-I10 PolarHBondContact O-N 3.1Å; H7-H11 AromaticContact CE1-NE2 3.73Å
8	T	48.8	Very low	56.3	Low	89 Å²	89	109.8 Å²	109.8	55%	0.546	59%	0.588	S	S	.	*	H	α-helix	trans	-68	-34.1	179.3	50.6	0	0	0	0	113.4	L4 T5 I10 H11	L4-T8 PolarHBondContact O-N 3.47Å; L4-T8 PolarHBondContact O-OG1 3.07Å; T5-T8 PolarHBondContact O-OG1 3.26Å; T8-I10 VanDerWaalsContact C-N 3.32Å; T8-I10 PolarHBondContact O-N 3.08Å; T8-H11 PolarHBondContact O-N 3.35Å
9	G	50.7	Low	57.6	Low	25 Å²	25	104.2 Å²	104.2	26%	0.258	56%	0.558	S	S	.	*	H	α-helix	trans	-73.2	-15.8	176.2	0	0	0	0	0	115.5
10	I	50.8	Low	58.5	Low	73 Å²	73	108.6 Å²	108.6	37%	0.374	58%	0.575	S	S	.	*	H	α-helix	trans	-75.5	-30.4	177.6	-65.6	167.2	0	0	0	111	Q6 H7 T8	Q6-I10 VanDerWaalsContact O-CD1 3.3Å; Q6-I10 WeakPolarHBondContact O-CD1 3.41Å; Q6-I10 WeakPolarHBondContact O-CG1 3.17Å; H7-I10 PolarHBondContact O-N 3.1Å; T8-I10 VanDerWaalsContact C-N 3.32Å; T8-I10 PolarHBondContact O-N 3.08Å
11	H	51.1	Low	59.2	Low	155 Å²	155	110.9 Å²	110.9	72%	0.718	58%	0.58	S	S	*	*	H	α-helix	trans	-79.6	-23.6	177.4	-76	-77.3	0	0	0	113.5	H7 T8	H7-H11 AromaticContact CE1-NE2 3.73Å; T8-H11 PolarHBondContact O-N 3.35Å
12	A	55.2	Low	61	Low	68 Å²	68	102.8 Å²	102.8	56%	0.562	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.1	-2.9	-179.5	0	0	0	0	0	114.8	E14	A12-E14 HydrophobicContact CB-CG 4.18Å; A12-E14 PolarHBondContact O-N 2.79Å
13	G	59.3	Low	62.2	Low	57 Å²	57	101 Å²	101	59%	0.588	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.5	8.7	178.2	0	0	0	0	0	115.3	K15	G13-K15 PolarHBondContact O-N 3.34Å
14	E	60.3	Low	63.9	Low	127 Å²	127	99.6 Å²	99.6	59%	0.593	53%	0.533	S	S	*	.			trans	-64.8	132.8	-179.6	-64.8	-173	166.1	0	0	111.2	A12 P16	A12-E14 HydrophobicContact CB-CG 4.18Å; A12-E14 PolarHBondContact O-N 2.79Å; E14-P16 WeakPolarHBondContact O-CD 3.5Å
15	K	74.4	Confident	65.7	Low	123 Å²	123	94.9 Å²	94.9	54%	0.535	51%	0.513	S	S	.	.			trans	-122.7	76	178.8	-68.7	174	-178.5	173.1	0	110	G13 Y17 A25 F26	G13-K15 PolarHBondContact O-N 3.34Å; K15-Y17 PolarHBondContact O-N 3.17Å; K15-A25 HydrophobicContact CB-CB 3.56Å; K15-A25 HydrophobicContact CD-CB 4.09Å; K15-A25 HydrophobicContact CG-CB 4.45Å; K15-F26 CarbonylContact C-O 3.53Å; K15-F26 VanDerWaalsContact C-O 3.28Å; K15-F26 WeakPolarHBondContact CA-O 3.2Å
16	P	74	Confident	67.2	Low	86 Å²	86	92 Å²	92	56%	0.558	49%	0.492	S	S	*	.			trans	-67.5	-24.2	-171.1	-17.8	31.4	0	0	0	113.2	E14	E14-P16 WeakPolarHBondContact O-CD 3.5Å
17	Y	74.1	Confident	68.4	Low	100 Å²	100	90.5 Å²	90.5	39%	0.392	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	98	-169.8	-57.6	-80.8	0	0	0	111	K15 A25 F26	K15-Y17 PolarHBondContact O-N 3.17Å; Y17-A25 CarbonylContact O-C 3.57Å; Y17-A25 WeakPolarHBondContact O-CA 3.39Å; Y17-F26 WeakPolarHBondContact CB-O 3.4Å; Y17-F26 PolarHBondContact N-O 3.13Å; Y17-F26 VanDerWaalsContact N-O 3.07Å; Y17-F26 WeakPolarHBondContact O-CD2 3.47Å; Y17-F26 PolarHBondContact O-N 2.9Å
18	K	76.3	Confident	69.7	Low	147 Å²	147	90.5 Å²	90.5	64%	0.639	48%	0.483	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.5	142	-179.7	-66.6	-178.6	-178.1	175.7	0	112.6	K24 A25 L32	K18-K24 CarbonylContact C-O 3.53Å; K18-A25 HydrophobicContact CG-CB 3.78Å; K18-L32 WeakPolarHBondContact O-CD2 3.46Å
19	C	81.7	Confident	70.9	Confident	3 Å²	3	89 Å²	89	2%	0.02	48%	0.476	C	S	.	.			trans	-86.4	114.3	170.9	-177	0	0	0	0	109.9	K21 C22 G23 K24 F26 L32	C19-K21 VanDerWaalsContact C-N 3.25Å; C19-K21 PolarHBondContact O-N 2.97Å; C19-C22 PolarHBondContact O-N 3.16Å; C19-G23 VanDerWaalsContact O-CA 3.25Å; C19-G23 WeakPolarHBondContact O-CA 3.3Å; C19-G23 PolarHBondContact O-N 2.94Å; C19-K24 PolarHBondContact N-O 3.28Å; C19-F26 HydrophobicContact CB-CE2 4.36Å; C19-L32 HydrophobicContact CB-CD1 3.57Å
20	E	76.3	Confident	72.3	Confident	191 Å²	191	91.6 Å²	91.6	89%	0.893	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-29.4	180	-66.6	171.2	173.8	0	0	113.3
21	K	73.1	Confident	73.6	Confident	157 Å²	157	90 Å²	90	68%	0.683	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-23.8	-179	-71.9	-168.9	175.4	-173.9	0	114.8	C19 H39	C19-K21 VanDerWaalsContact C-N 3.25Å; C19-K21 PolarHBondContact O-N 2.97Å; K21-H39 HydrophobicContact CD-CB 3.86Å
22	C	79.9	Confident	75	Confident	53 Å²	53	83.3 Å²	83.3	36%	0.358	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142	9.3	-176.8	73.1	0	0	0	0	114.9	C19 K24 H35	C19-C22 PolarHBondContact O-N 3.16Å; C22-K24 PolarHBondContact O-N 3.04Å; C22-H35 PolarHBondContact SG-NE2 3.16Å
23	G	76.9	Confident	76.1	Confident	57 Å²	57	83.4 Å²	83.4	59%	0.588	45%	0.448	S	S	*	.			trans	68.9	-2.6	177.6	0	0	0	0	0	115.7	C19 A25	C19-G23 VanDerWaalsContact O-CA 3.25Å; C19-G23 WeakPolarHBondContact O-CA 3.3Å; C19-G23 PolarHBondContact O-N 2.94Å; G23-A25 PolarHBondContact O-N 2.87Å
24	K	81.3	Confident	77	Confident	128 Å²	128	86 Å²	86	56%	0.557	44%	0.443	S	S	*	.			trans	-69.1	127	-176.1	-74.2	-175.2	178.7	179.3	0	111.7	K18 C19 C22 F26	K18-K24 CarbonylContact C-O 3.53Å; C19-K24 PolarHBondContact N-O 3.28Å; C22-K24 PolarHBondContact O-N 3.04Å; K24-F26 HydrophobicContact CB-CE2 3.82Å; K24-F26 HydrophobicContact CB-CZ 3.91Å; K24-F26 WeakPolarHBondContact O-CD2 3.47Å; K24-F26 VanDerWaalsContact O-CE2 3.25Å; K24-F26 WeakPolarHBondContact O-CE2 3.49Å
25	A	81.9	Confident	78	Confident	32 Å²	32	80.6 Å²	80.6	26%	0.264	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	141.5	179.1	0	0	0	0	0	111.8	K15 Y17 K18 G23	K15-A25 HydrophobicContact CB-CB 3.56Å; K15-A25 HydrophobicContact CD-CB 4.09Å; K15-A25 HydrophobicContact CG-CB 4.45Å; Y17-A25 CarbonylContact O-C 3.57Å; Y17-A25 WeakPolarHBondContact O-CA 3.39Å; K18-A25 HydrophobicContact CG-CB 3.78Å; G23-A25 PolarHBondContact O-N 2.87Å
26	F	82.7	Confident	78.2	Confident	41 Å²	41	79.7 Å²	79.7	18%	0.18	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	147.6	-178.5	-58.1	-89.1	0	0	0	110.4	K15 Y17 C19 K24 R28 L32 H35	K15-F26 CarbonylContact C-O 3.53Å; K15-F26 VanDerWaalsContact C-O 3.28Å; K15-F26 WeakPolarHBondContact CA-O 3.2Å; Y17-F26 WeakPolarHBondContact CB-O 3.4Å; Y17-F26 PolarHBondContact N-O 3.13Å; Y17-F26 VanDerWaalsContact N-O 3.07Å; Y17-F26 WeakPolarHBondContact O-CD2 3.47Å; Y17-F26 PolarHBondContact O-N 2.9Å; C19-F26 HydrophobicContact CB-CE2 4.36Å; K24-F26 HydrophobicContact CB-CE2 3.82Å; K24-F26 HydrophobicContact CB-CZ 3.91Å; K24-F26 WeakPolarHBondContact O-CD2 3.47Å; K24-F26 VanDerWaalsContact O-CE2 3.25Å; K24-F26 WeakPolarHBondContact O-CE2 3.49Å; F26-R28 VanDerWaalsContact C-N 3.33Å; F26-L32 HydrophobicContact CB-CB 4.25Å; F26-L32 HydrophobicContact CD2-CB 3.8Å; F26-L32 HydrophobicContact CD2-CD1 3.63Å; F26-L32 HydrophobicContact CD2-CG 4.3Å; F26-L32 HydrophobicContact CE2-CD1 3.74Å; F26-L32 HydrophobicContact CG-CB 4.18Å; F26-H35 HydrophobicContact CE1-CB 3.97Å; F26-H35 HydrophobicContact CE2-CB 3.92Å; F26-H35 AromaticContact CE2-CD2 3.51Å; F26-H35 AromaticContact CE2-CG 3.65Å; F26-H35 HydrophobicContact CZ-CB 3.46Å; F26-H35 VanDerWaalsContact CZ-CB 3.46Å; F26-H35 AromaticContact CZ-CD2 3.55Å; F26-H35 AromaticContact CZ-CG 3.21Å; F26-H35 AromaticContact CZ-ND1 3.58Å
27	N	77.4	Confident	78.5	Confident	77 Å²	77	78.5 Å²	78.5	41%	0.412	40%	0.398	S	S	.	.	S	Bend	trans	-79.4	-15.1	177.9	60.3	-2.2	0	0	0	113.4
28	R	78.1	Confident	78.6	Confident	111 Å²	111	77.5 Å²	77.5	42%	0.419	40%	0.399	S	S	.	.	S	Bend	trans	-135.5	139	-179.2	-62.7	-179.4	-176.8	179	-0	110.2	F26 T30 S31 L32	F26-R28 VanDerWaalsContact C-N 3.33Å; R28-T30 VanDerWaalsContact C-N 3.27Å; R28-T30 PolarHBondContact O-N 3.34Å; R28-S31 WeakPolarHBondContact O-CB 3.48Å; R28-S31 PolarHBondContact O-N 3.15Å; R28-S31 VanDerWaalsContact O-N 3.11Å; R28-L32 PolarHBondContact O-N 2.87Å
29	S	74.6	Confident	78.7	Confident	57 Å²	57	74 Å²	74	40%	0.399	38%	0.384	S	S	.	.	H	α-helix	trans	-58.1	-39.3	175.9	60.1	0	0	0	0	111.9	S31 L32 S33	S29-S31 VanDerWaalsContact C-N 3.28Å; S29-S31 PolarHBondContact O-N 3.33Å; S29-L32 WeakPolarHBondContact O-CB 3Å; S29-L32 PolarHBondContact O-N 2.82Å; S29-L32 VanDerWaalsContact O-N 3.15Å; S29-S33 PolarHBondContact O-N 3.15Å; S29-S33 PolarHBondContact O-OG 3.02Å
30	T	78.6	Confident	78.5	Confident	80 Å²	80	77.5 Å²	77.5	49%	0.491	41%	0.406	S	S	.	.	H	α-helix	trans	-61.7	-33.3	177	56.5	0	0	0	0	113.2	R28 K34	R28-T30 VanDerWaalsContact C-N 3.27Å; R28-T30 PolarHBondContact O-N 3.34Å; T30-K34 WeakPolarHBondContact O-CG 3.38Å; T30-K34 PolarHBondContact O-N 3.48Å
31	S	79.3	Confident	78.4	Confident	39 Å²	39	70 Å²	70	27%	0.273	38%	0.381	S	S	.	.	H	α-helix	trans	-71.2	-40.9	175	-64	0	0	0	0	111.6	R28 S29 K34 H35	R28-S31 WeakPolarHBondContact O-CB 3.48Å; R28-S31 PolarHBondContact O-N 3.15Å; R28-S31 VanDerWaalsContact O-N 3.11Å; S29-S31 VanDerWaalsContact C-N 3.28Å; S29-S31 PolarHBondContact O-N 3.33Å; S31-K34 PolarHBondContact O-N 3.11Å; S31-H35 WeakPolarHBondContact O-CB 3.45Å; S31-H35 PolarHBondContact O-N 3.35Å
32	L	79.9	Confident	78.8	Confident	16 Å²	16	67.6 Å²	67.6	8%	0.084	37%	0.372	C	S	.	.	H	α-helix	trans	-63.3	-43.5	172.5	175.5	61.9	0	0	0	111.1	K18 C19 F26 R28 S29 K34 H35 K36	K18-L32 WeakPolarHBondContact O-CD2 3.46Å; C19-L32 HydrophobicContact CB-CD1 3.57Å; F26-L32 HydrophobicContact CB-CB 4.25Å; F26-L32 HydrophobicContact CD2-CB 3.8Å; F26-L32 HydrophobicContact CD2-CD1 3.63Å; F26-L32 HydrophobicContact CD2-CG 4.3Å; F26-L32 HydrophobicContact CE2-CD1 3.74Å; F26-L32 HydrophobicContact CG-CB 4.18Å; R28-L32 PolarHBondContact O-N 2.87Å; S29-L32 WeakPolarHBondContact O-CB 3Å; S29-L32 PolarHBondContact O-N 2.82Å; S29-L32 VanDerWaalsContact O-N 3.15Å; L32-K34 PolarHBondContact O-N 3.49Å; L32-H35 CarbonylContact O-C 3.58Å; L32-H35 WeakPolarHBondContact O-CA 3.48Å; L32-H35 WeakPolarHBondContact O-CB 3.46Å; L32-H35 PolarHBondContact O-N 3.07Å; L32-K36 HydrophobicContact CD1-CG 4.36Å; L32-K36 WeakPolarHBondContact O-CG 3.49Å; L32-K36 PolarHBondContact O-N 3.15Å
33	S	77.3	Confident	78.9	Confident	69 Å²	69	70.6 Å²	70.6	48%	0.483	38%	0.379	S	S	.	.	H	α-helix	trans	-62.2	-43.7	177	-60.1	0	0	0	0	112.3	S29 H35 K36	S29-S33 PolarHBondContact O-N 3.15Å; S29-S33 PolarHBondContact O-OG 3.02Å; S33-H35 PolarHBondContact O-N 3.32Å; S33-K36 PolarHBondContact O-N 3.49Å
34	K	80	Confident	79.3	Confident	112 Å²	112	71.2 Å²	71.2	49%	0.487	37%	0.372	S	S	.	.	H	α-helix	trans	-62.5	-31.4	172.4	-74	171.9	-175.7	175.6	0	112.4	T30 S31 L32	T30-K34 WeakPolarHBondContact O-CG 3.38Å; T30-K34 PolarHBondContact O-N 3.48Å; S31-K34 PolarHBondContact O-N 3.11Å; L32-K34 PolarHBondContact O-N 3.49Å
35	H	80.3	Confident	79.3	Confident	13 Å²	13	69 Å²	69	6%	0.06	36%	0.361	C	S	.	.	H	α-helix	trans	-76	-38.3	176.8	170.3	77.7	0	0	0	112.7	C22 F26 S31 L32 S33 R37 I38 H39	C22-H35 PolarHBondContact SG-NE2 3.16Å; F26-H35 HydrophobicContact CE1-CB 3.97Å; F26-H35 HydrophobicContact CE2-CB 3.92Å; F26-H35 AromaticContact CE2-CD2 3.51Å; F26-H35 AromaticContact CE2-CG 3.65Å; F26-H35 HydrophobicContact CZ-CB 3.46Å; F26-H35 VanDerWaalsContact CZ-CB 3.46Å; F26-H35 AromaticContact CZ-CD2 3.55Å; F26-H35 AromaticContact CZ-CG 3.21Å; F26-H35 AromaticContact CZ-ND1 3.58Å; S31-H35 WeakPolarHBondContact O-CB 3.45Å; S31-H35 PolarHBondContact O-N 3.35Å; L32-H35 CarbonylContact O-C 3.58Å; L32-H35 WeakPolarHBondContact O-CA 3.48Å; L32-H35 WeakPolarHBondContact O-CB 3.46Å; L32-H35 PolarHBondContact O-N 3.07Å; S33-H35 PolarHBondContact O-N 3.32Å; H35-R37 PolarHBondContact O-N 3.3Å; H35-R37 VanDerWaalsContact O-N 3.13Å; H35-I38 VanDerWaalsContact O-CB 3.23Å; H35-I38 WeakPolarHBondContact O-CB 3.36Å; H35-I38 VanDerWaalsContact O-CG1 3.31Å; H35-I38 WeakPolarHBondContact O-CG1 3.32Å; H35-I38 PolarHBondContact O-N 3.27Å; H35-H39 AromaticContact NE2-NE2 3.52Å
36	K	77.6	Confident	79	Confident	105 Å²	105	71.5 Å²	71.5	46%	0.457	37%	0.373	S	S	.	.	H	α-helix	trans	-55.8	-30.9	177.3	-77.3	-175.4	175.3	-172.5	0	112.8	L32 S33 I38 H39 T40	L32-K36 HydrophobicContact CD1-CG 4.36Å; L32-K36 WeakPolarHBondContact O-CG 3.49Å; L32-K36 PolarHBondContact O-N 3.15Å; S33-K36 PolarHBondContact O-N 3.49Å; K36-I38 PolarHBondContact O-N 3.33Å; K36-H39 PolarHBondContact O-N 3.42Å; K36-T40 PolarHBondContact O-N 3.45Å; K36-T40 VanDerWaalsContact O-N 3.16Å
37	R	82.1	Confident	79	Confident	60 Å²	60	69.6 Å²	69.6	23%	0.226	37%	0.365	C	S	.	.	H	α-helix	trans	-56.4	-20	172	-61.9	-179.1	-177.2	175.3	-0.8	114.3	H35 H39 T40 G41 E42 R55	H35-R37 PolarHBondContact O-N 3.3Å; H35-R37 VanDerWaalsContact O-N 3.13Å; R37-H39 VanDerWaalsContact C-N 3.34Å; R37-T40 WeakPolarHBondContact CA-OG1 3.44Å; R37-G41 PolarHBondContact O-N 3.17Å; R37-E42 HydrophobicContact CG-CB 4.36Å; R37-R55 PolarHBondContact NH1-O 3.18Å; R37-R55 PolarHBondContact O-NE 3.23Å; R37-R55 VanDerWaalsContact O-NE 3.16Å
38	I	76.4	Confident	79.3	Confident	79 Å²	79	74.4 Å²	74.4	41%	0.405	39%	0.385	S	S	.	.	H	α-helix	trans	-67.7	-39	174.6	-61.8	177.3	0	0	0	111.1	H35 K36 R55	H35-I38 VanDerWaalsContact O-CB 3.23Å; H35-I38 WeakPolarHBondContact O-CB 3.36Å; H35-I38 VanDerWaalsContact O-CG1 3.31Å; H35-I38 WeakPolarHBondContact O-CG1 3.32Å; H35-I38 PolarHBondContact O-N 3.27Å; K36-I38 PolarHBondContact O-N 3.33Å; I38-R55 PolarHBondContact O-NH2 3.19Å
39	H	77.2	Confident	79.2	Confident	73 Å²	73	75.4 Å²	75.4	34%	0.338	39%	0.394	S	S	.	.	H	α-helix	trans	-86.3	-33.9	-177.4	-60.7	-65.4	0	0	0	112.9	K21 H35 K36 R37	K21-H39 HydrophobicContact CD-CB 3.86Å; H35-H39 AromaticContact NE2-NE2 3.52Å; K36-H39 PolarHBondContact O-N 3.42Å; R37-H39 VanDerWaalsContact C-N 3.34Å
40	T	76.8	Confident	79.4	Confident	77 Å²	77	75.1 Å²	75.1	47%	0.472	39%	0.391	S	S	.	.	H	α-helix	trans	-83	-14.5	-179.5	60.5	0	0	0	0	113.2	K36 R37 E42	K36-T40 PolarHBondContact O-N 3.45Å; K36-T40 VanDerWaalsContact O-N 3.16Å; R37-T40 WeakPolarHBondContact CA-OG1 3.44Å; T40-E42 PolarHBondContact O-N 2.92Å; T40-E42 WeakPolarHBondContact OG1-CG 3.4Å
41	G	76.1	Confident	79.4	Confident	35 Å²	35	74.1 Å²	74.1	36%	0.361	40%	0.398	S	S	.	.			trans	81.3	-11.1	-178.3	0	0	0	0	0	114.5	R37 K43	R37-G41 PolarHBondContact O-N 3.17Å; G41-K43 WeakPolarHBondContact O-CG 3.48Å; G41-K43 PolarHBondContact O-N 2.85Å
42	E	79.8	Confident	79.3	Confident	106 Å²	106	78.2 Å²	78.2	50%	0.495	41%	0.41	S	S	.	.			trans	-51.2	126.4	-178.1	-76.2	171.3	-154.4	0	0	113	R37 T40 R55	R37-E42 HydrophobicContact CG-CB 4.36Å; T40-E42 PolarHBondContact O-N 2.92Å; T40-E42 WeakPolarHBondContact OG1-CG 3.4Å; E42-R55 WeakPolarHBondContact O-CG 3.23Å
43	K	83.7	Confident	79.5	Confident	116 Å²	116	79 Å²	79	50%	0.504	42%	0.419	S	S	.	.			trans	-127.6	77.5	178.9	-73.6	164.2	175.3	-171.1	0	110	G41 Y45 A53 F54 R55	G41-K43 WeakPolarHBondContact O-CG 3.48Å; G41-K43 PolarHBondContact O-N 2.85Å; K43-Y45 PolarHBondContact O-N 3.45Å; K43-Y45 VanDerWaalsContact O-N 3.14Å; K43-A53 HydrophobicContact CB-CB 3.53Å; K43-A53 HydrophobicContact CD-CB 4.08Å; K43-A53 WeakPolarHBondContact CD-O 3.48Å; K43-A53 HydrophobicContact CG-CB 4.4Å; K43-F54 CarbonylContact C-O 3.52Å; K43-F54 VanDerWaalsContact CA-O 3.3Å; K43-F54 WeakPolarHBondContact CA-O 3.31Å; K43-R55 HydrophobicContact CG-CG 3.79Å
44	P	83.8	Confident	79.8	Confident	69 Å²	69	77.4 Å²	77.4	45%	0.448	40%	0.404	S	S	.	.			trans	-69.6	-11.2	-170.3	-20.6	34.1	0	0	0	115.2
45	Y	82.7	Confident	79.9	Confident	82 Å²	82	76.1 Å²	76.1	32%	0.322	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	102.6	-172.5	-56.5	-78.7	0	0	0	110	K43 A53 F54 S57	K43-Y45 PolarHBondContact O-N 3.45Å; K43-Y45 VanDerWaalsContact O-N 3.14Å; Y45-A53 CarbonylContact O-C 3.59Å; Y45-A53 WeakPolarHBondContact O-CA 3.25Å; Y45-F54 PolarHBondContact N-O 3.4Å; Y45-F54 VanDerWaalsContact N-O 3.08Å; Y45-F54 PolarHBondContact O-N 2.87Å; Y45-S57 VanDerWaalsContact CD2-N 3.35Å
46	T	75	Confident	79.9	Confident	84 Å²	84	81.6 Å²	81.6	52%	0.515	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	142.4	-179.4	44.1	0	0	0	0	111.8	K52 A53 L60	T46-K52 CarbonylContact C-O 3.19Å; T46-A53 HydrophobicContact CG2-CB 3.78Å; T46-L60 WeakPolarHBondContact O-CD2 3.36Å
47	C	82.4	Confident	80.1	Confident	1 Å²	1	79 Å²	79	1%	0.007	41%	0.411	C	S	.	.			trans	-86.4	119.3	168.6	177.9	0	0	0	0	108.6	E49 C50 G51 K52 F54 L60 H67	C47-E49 VanDerWaalsContact C-N 3.31Å; C47-E49 PolarHBondContact O-N 3.06Å; C47-C50 VanDerWaalsContact SG-SG 3.66Å; C47-G51 WeakPolarHBondContact O-CA 3.46Å; C47-G51 PolarHBondContact O-N 2.92Å; C47-K52 WeakPolarHBondContact CB-O 3.34Å; C47-K52 PolarHBondContact N-O 2.99Å; C47-F54 HydrophobicContact CB-CE2 4.21Å; C47-L60 HydrophobicContact CB-CD1 3.57Å; C47-H67 PolarHBondContact SG-NE2 3.17Å
48	E	82.8	Confident	80	Confident	179 Å²	179	80.2 Å²	80.2	84%	0.836	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-30.4	-178.8	-66.9	173.3	174.7	0	0	112.4
49	E	76.5	Confident	80.1	Confident	131 Å²	131	79 Å²	79	61%	0.612	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-26.6	-178.8	-67.4	172.7	150.9	0	0	114.1	C47 H67	C47-E49 VanDerWaalsContact C-N 3.31Å; C47-E49 PolarHBondContact O-N 3.06Å; E49-H67 WeakPolarHBondContact OE2-CB 3.38Å; E49-H67 IonicContact OE2-CD2 2.9Å; E49-H67 PolarHBondContact OE2-CD2 3.41Å; E49-H67 IonicContact OE2-CG 3.12Å; E49-H67 IonicContact OE2-NE2 3.87Å
50	C	78.3	Confident	80.3	Confident	51 Å²	51	76.1 Å²	76.1	35%	0.345	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.5	5.9	-176.4	80.2	0	0	0	0	115	C47 K52 H63	C47-C50 VanDerWaalsContact SG-SG 3.66Å; C50-K52 PolarHBondContact O-N 3.44Å; C50-K52 VanDerWaalsContact O-N 3.07Å; C50-K52 VanDerWaalsContact SG-CG 3.57Å; C50-H63 PolarHBondContact SG-NE2 3.5Å
51	G	78.8	Confident	80.4	Confident	60 Å²	60	77 Å²	77	62%	0.619	41%	0.41	S	S	*	.			trans	68.2	0.5	179.9	0	0	0	0	0	115.6	C47 A53	C47-G51 WeakPolarHBondContact O-CA 3.46Å; C47-G51 PolarHBondContact O-N 2.92Å; G51-A53 PolarHBondContact O-N 3.41Å
52	K	78.4	Confident	80.4	Confident	125 Å²	125	78.7 Å²	78.7	54%	0.543	41%	0.409	S	S	.	.			trans	-71.8	129.2	-176.3	-74.2	179.6	-178	171.1	0	111.7	T46 C47 C50 F54	T46-K52 CarbonylContact C-O 3.19Å; C47-K52 WeakPolarHBondContact CB-O 3.34Å; C47-K52 PolarHBondContact N-O 2.99Å; C50-K52 PolarHBondContact O-N 3.44Å; C50-K52 VanDerWaalsContact O-N 3.07Å; C50-K52 VanDerWaalsContact SG-CG 3.57Å; K52-F54 HydrophobicContact CB-CE2 3.85Å; K52-F54 HydrophobicContact CB-CZ 3.9Å; K52-F54 WeakPolarHBondContact O-CD2 3.37Å; K52-F54 WeakPolarHBondContact O-CE2 3.45Å
53	A	83.6	Confident	80.4	Confident	33 Å²	33	74.6 Å²	74.6	27%	0.273	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	140.4	179.7	0	0	0	0	0	112.9	K43 Y45 T46 G51	K43-A53 HydrophobicContact CB-CB 3.53Å; K43-A53 HydrophobicContact CD-CB 4.08Å; K43-A53 WeakPolarHBondContact CD-O 3.48Å; K43-A53 HydrophobicContact CG-CB 4.4Å; Y45-A53 CarbonylContact O-C 3.59Å; Y45-A53 WeakPolarHBondContact O-CA 3.25Å; T46-A53 HydrophobicContact CG2-CB 3.78Å; G51-A53 PolarHBondContact O-N 3.41Å
54	F	83.2	Confident	80.1	Confident	35 Å²	35	73.2 Å²	73.2	15%	0.154	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	149.8	-175.8	-58	-87.2	0	0	0	111.8	K43 Y45 C47 K52 R56 V59 L60 H63	K43-F54 CarbonylContact C-O 3.52Å; K43-F54 VanDerWaalsContact CA-O 3.3Å; K43-F54 WeakPolarHBondContact CA-O 3.31Å; Y45-F54 PolarHBondContact N-O 3.4Å; Y45-F54 VanDerWaalsContact N-O 3.08Å; Y45-F54 PolarHBondContact O-N 2.87Å; C47-F54 HydrophobicContact CB-CE2 4.21Å; K52-F54 HydrophobicContact CB-CE2 3.85Å; K52-F54 HydrophobicContact CB-CZ 3.9Å; K52-F54 WeakPolarHBondContact O-CD2 3.37Å; K52-F54 WeakPolarHBondContact O-CE2 3.45Å; F54-R56 VanDerWaalsContact C-N 3.34Å; F54-V59 HydrophobicContact CD1-CB 4.31Å; F54-V59 HydrophobicContact CD1-CG1 3.61Å; F54-V59 HydrophobicContact CE1-CG1 4.18Å; F54-V59 HydrophobicContact CG-CG1 4.43Å; F54-L60 HydrophobicContact CB-CB 4.22Å; F54-L60 HydrophobicContact CD2-CB 3.81Å; F54-L60 HydrophobicContact CD2-CD1 3.6Å; F54-L60 HydrophobicContact CD2-CG 4.27Å; F54-L60 HydrophobicContact CE2-CD1 3.71Å; F54-L60 HydrophobicContact CG-CB 4.17Å; F54-H63 HydrophobicContact CE1-CB 3.97Å; F54-H63 HydrophobicContact CE2-CB 3.96Å; F54-H63 AromaticContact CE2-CD2 3.48Å; F54-H63 VanDerWaalsContact CE2-CD2 3.48Å; F54-H63 WeakPolarHBondContact CE2-CD2 3.23Å; F54-H63 AromaticContact CE2-CG 3.7Å; F54-H63 HydrophobicContact CZ-CB 3.48Å; F54-H63 VanDerWaalsContact CZ-CB 3.48Å; F54-H63 AromaticContact CZ-CD2 3.44Å; F54-H63 VanDerWaalsContact CZ-CD2 3.44Å; F54-H63 WeakPolarHBondContact CZ-CD2 3.33Å; F54-H63 AromaticContact CZ-CG 3.21Å; F54-H63 AromaticContact CZ-ND1 3.68Å; F54-H63 AromaticContact CZ-NE2 3.98Å
55	R	82.4	Confident	79.9	Confident	85 Å²	85	72.9 Å²	72.9	32%	0.321	38%	0.375	S	S	.	.	S	Bend	trans	-78.6	-18.9	-178.8	-57.7	-170.3	167.1	157.5	-12.9	113.6	R37 I38 E42 K43	R37-R55 PolarHBondContact NH1-O 3.18Å; R37-R55 PolarHBondContact O-NE 3.23Å; R37-R55 VanDerWaalsContact O-NE 3.16Å; I38-R55 PolarHBondContact O-NH2 3.19Å; E42-R55 WeakPolarHBondContact O-CG 3.23Å; K43-R55 HydrophobicContact CG-CG 3.79Å
56	R	81.2	Confident	79.4	Confident	127 Å²	127	74.2 Å²	74.2	48%	0.479	39%	0.387	S	S	.	.	S	Bend	trans	-139.3	140.4	-175.6	-63.2	-178.6	-178.6	179.7	-0.8	109.8	F54 T58 V59 L60	F54-R56 VanDerWaalsContact C-N 3.34Å; R56-T58 VanDerWaalsContact C-N 3.31Å; R56-T58 PolarHBondContact O-N 3.02Å; R56-V59 HydrophobicContact CB-CG2 4.16Å; R56-V59 PolarHBondContact O-N 3.11Å; R56-L60 PolarHBondContact O-N 3.17Å
57	S	80.7	Confident	79.3	Confident	51 Å²	51	73.9 Å²	73.9	36%	0.357	38%	0.379	S	S	.	.	H	α-helix	trans	-62	-36.1	177.5	54.2	0	0	0	0	112.8	Y45 V59 L60 N61	Y45-S57 VanDerWaalsContact CD2-N 3.35Å; S57-V59 VanDerWaalsContact C-N 3.29Å; S57-V59 PolarHBondContact O-N 3.39Å; S57-L60 WeakPolarHBondContact O-CB 3.49Å; S57-L60 PolarHBondContact O-N 3.28Å; S57-N61 PolarHBondContact O-N 2.76Å
58	T	79.9	Confident	79	Confident	85 Å²	85	77.8 Å²	77.8	52%	0.521	40%	0.403	S	S	.	.	H	α-helix	trans	-59.9	-38.8	177.4	54.6	0	0	0	0	112.6	R56 N61 E62	R56-T58 VanDerWaalsContact C-N 3.31Å; R56-T58 PolarHBondContact O-N 3.02Å; T58-N61 PolarHBondContact O-N 3.35Å; T58-E62 WeakPolarHBondContact O-CG 3.5Å; T58-E62 PolarHBondContact O-N 2.79Å
59	V	78.7	Confident	78.5	Confident	54 Å²	54	71.5 Å²	71.5	33%	0.327	39%	0.386	S	S	.	.	H	α-helix	trans	-73.2	-35.5	178.6	-175.6	0	0	0	0	111	F54 R56 S57 E62 H63	F54-V59 HydrophobicContact CD1-CB 4.31Å; F54-V59 HydrophobicContact CD1-CG1 3.61Å; F54-V59 HydrophobicContact CE1-CG1 4.18Å; F54-V59 HydrophobicContact CG-CG1 4.43Å; R56-V59 HydrophobicContact CB-CG2 4.16Å; R56-V59 PolarHBondContact O-N 3.11Å; S57-V59 VanDerWaalsContact C-N 3.29Å; S57-V59 PolarHBondContact O-N 3.39Å; V59-E62 PolarHBondContact O-N 2.98Å; V59-H63 WeakPolarHBondContact O-CB 3.44Å; V59-H63 PolarHBondContact O-N 3.25Å
60	L	81.2	Confident	78.4	Confident	13 Å²	13	70.5 Å²	70.5	7%	0.068	38%	0.382	C	S	.	.	H	α-helix	trans	-63.2	-45.2	171	172	62.2	0	0	0	111	T46 C47 F54 R56 S57 E62 H63 K64	T46-L60 WeakPolarHBondContact O-CD2 3.36Å; C47-L60 HydrophobicContact CB-CD1 3.57Å; F54-L60 HydrophobicContact CB-CB 4.22Å; F54-L60 HydrophobicContact CD2-CB 3.81Å; F54-L60 HydrophobicContact CD2-CD1 3.6Å; F54-L60 HydrophobicContact CD2-CG 4.27Å; F54-L60 HydrophobicContact CE2-CD1 3.71Å; F54-L60 HydrophobicContact CG-CB 4.17Å; R56-L60 PolarHBondContact O-N 3.17Å; S57-L60 WeakPolarHBondContact O-CB 3.49Å; S57-L60 PolarHBondContact O-N 3.28Å; L60-E62 VanDerWaalsContact C-N 3.34Å; L60-E62 PolarHBondContact O-N 3.24Å; L60-H63 CarbonylContact O-C 3.29Å; L60-H63 WeakPolarHBondContact O-CA 3.5Å; L60-H63 WeakPolarHBondContact O-CB 3.39Å; L60-H63 PolarHBondContact O-N 3.28Å; L60-K64 HydrophobicContact CD1-CG 4.33Å; L60-K64 WeakPolarHBondContact O-CG 3.34Å; L60-K64 PolarHBondContact O-N 3.45Å
61	N	79.6	Confident	78.4	Confident	95 Å²	95	73.4 Å²	73.4	51%	0.508	39%	0.388	S	S	.	.	H	α-helix	trans	-63.6	-38.8	178.1	-72.5	-5.7	0	0	0	112.1	S57 T58 H63 K64	S57-N61 PolarHBondContact O-N 2.76Å; T58-N61 PolarHBondContact O-N 3.35Å; N61-H63 VanDerWaalsContact C-N 3.32Å; N61-K64 PolarHBondContact O-N 3.19Å
62	E	76.6	Confident	78.5	Confident	71 Å²	71	74.1 Å²	74.1	33%	0.332	38%	0.382	S	S	.	.	H	α-helix	trans	-65.2	-35.5	171	-73.1	178.9	151.8	0	0	112.6	T58 V59 L60 K65 R84	T58-E62 WeakPolarHBondContact O-CG 3.5Å; T58-E62 PolarHBondContact O-N 2.79Å; V59-E62 PolarHBondContact O-N 2.98Å; L60-E62 VanDerWaalsContact C-N 3.34Å; L60-E62 PolarHBondContact O-N 3.24Å; E62-K65 WeakPolarHBondContact O-CB 3.36Å; E62-K65 PolarHBondContact O-N 3.07Å; E62-R84 IonicContact OE1-CZ 3.95Å; E62-R84 IonicContact OE1-NE 2.93Å; E62-R84 IonicContact OE2-CZ 3.69Å; E62-R84 IonicContact OE2-NE 3.52Å; E62-R84 PolarHBondContact OE2-NE 2.76Å; E62-R84 IonicContact OE2-NH1 3.07Å; E62-R84 IonicContact OE2-NH2 2.62Å; E62-R84 PolarHBondContact OE2-NH2 3.04Å
63	H	78.5	Confident	78.6	Confident	20 Å²	20	72.7 Å²	72.7	9%	0.093	37%	0.374	C	S	.	.	H	α-helix	trans	-68.5	-39.5	176.1	171.2	70.2	0	0	0	112.2	C50 F54 V59 L60 N61 K65 I66 H67	C50-H63 PolarHBondContact SG-NE2 3.5Å; F54-H63 HydrophobicContact CE1-CB 3.97Å; F54-H63 HydrophobicContact CE2-CB 3.96Å; F54-H63 AromaticContact CE2-CD2 3.48Å; F54-H63 VanDerWaalsContact CE2-CD2 3.48Å; F54-H63 WeakPolarHBondContact CE2-CD2 3.23Å; F54-H63 AromaticContact CE2-CG 3.7Å; F54-H63 HydrophobicContact CZ-CB 3.48Å; F54-H63 VanDerWaalsContact CZ-CB 3.48Å; F54-H63 AromaticContact CZ-CD2 3.44Å; F54-H63 VanDerWaalsContact CZ-CD2 3.44Å; F54-H63 WeakPolarHBondContact CZ-CD2 3.33Å; F54-H63 AromaticContact CZ-CG 3.21Å; F54-H63 AromaticContact CZ-ND1 3.68Å; F54-H63 AromaticContact CZ-NE2 3.98Å; V59-H63 WeakPolarHBondContact O-CB 3.44Å; V59-H63 PolarHBondContact O-N 3.25Å; L60-H63 CarbonylContact O-C 3.29Å; L60-H63 WeakPolarHBondContact O-CA 3.5Å; L60-H63 WeakPolarHBondContact O-CB 3.39Å; L60-H63 PolarHBondContact O-N 3.28Å; N61-H63 VanDerWaalsContact C-N 3.32Å; H63-K65 PolarHBondContact O-N 3.36Å; H63-I66 VanDerWaalsContact O-CB 3.23Å; H63-I66 WeakPolarHBondContact O-CB 3.47Å; H63-I66 WeakPolarHBondContact O-CG1 3.3Å; H63-I66 PolarHBondContact O-N 3.25Å; H63-H67 AromaticContact CD2-NE2 3.92Å; H63-H67 AromaticContact CE1-NE2 3.77Å; H63-H67 AromaticContact NE2-CE1 3.95Å; H63-H67 AromaticContact NE2-NE2 3.17Å; H63-H67 PolarHBondContact NE2-NE2 3.16Å; H63-H67 VanDerWaalsContact NE2-NE2 3.17Å
64	K	77.9	Confident	78.3	Confident	86 Å²	86	77.6 Å²	77.6	37%	0.374	39%	0.389	S	S	.	.	H	α-helix	trans	-56.6	-30.5	176.5	-74.9	-173.8	173.5	-166.1	0	112.6	L60 N61 I66 H67 T68	L60-K64 HydrophobicContact CD1-CG 4.33Å; L60-K64 WeakPolarHBondContact O-CG 3.34Å; L60-K64 PolarHBondContact O-N 3.45Å; N61-K64 PolarHBondContact O-N 3.19Å; K64-I66 PolarHBondContact O-N 3.49Å; K64-I66 VanDerWaalsContact O-N 3.11Å; K64-H67 PolarHBondContact O-N 3.49Å; K64-T68 PolarHBondContact O-N 3.06Å
65	K	79.7	Confident	78.3	Confident	62 Å²	62	76 Å²	76	27%	0.27	38%	0.382	S	S	.	.	H	α-helix	trans	-61.8	-17.1	173.9	-62.3	-177.9	177.7	-174	0	114.4	E62 H63 T68 G69 E70 T83	E62-K65 WeakPolarHBondContact O-CB 3.36Å; E62-K65 PolarHBondContact O-N 3.07Å; H63-K65 PolarHBondContact O-N 3.36Å; K65-T68 WeakPolarHBondContact CA-OG1 3.47Å; K65-G69 PolarHBondContact O-N 3.33Å; K65-E70 PolarHBondContact O-N 2.62Å; K65-T83 HydrophobicContact CB-CG2 4.46Å
66	I	72.6	Confident	78.2	Confident	111 Å²	111	80.1 Å²	80.1	57%	0.569	41%	0.405	S	S	*	.	H	α-helix	trans	-73.1	-37.6	174.3	-61.2	172.9	0	0	0	110.4	H63 K64	H63-I66 VanDerWaalsContact O-CB 3.23Å; H63-I66 WeakPolarHBondContact O-CB 3.47Å; H63-I66 WeakPolarHBondContact O-CG1 3.3Å; H63-I66 PolarHBondContact O-N 3.25Å; K64-I66 PolarHBondContact O-N 3.49Å; K64-I66 VanDerWaalsContact O-N 3.11Å
67	H	72.8	Confident	78	Confident	76 Å²	76	80.3 Å²	80.3	35%	0.352	41%	0.411	S	S	.	.	H	α-helix	trans	-79.8	-38.3	-178.4	-56.6	-53.8	0	0	0	111.8	C47 E49 H63 K64 G69	C47-H67 PolarHBondContact SG-NE2 3.17Å; E49-H67 WeakPolarHBondContact OE2-CB 3.38Å; E49-H67 IonicContact OE2-CD2 2.9Å; E49-H67 PolarHBondContact OE2-CD2 3.41Å; E49-H67 IonicContact OE2-CG 3.12Å; E49-H67 IonicContact OE2-NE2 3.87Å; H63-H67 AromaticContact CD2-NE2 3.92Å; H63-H67 AromaticContact CE1-NE2 3.77Å; H63-H67 AromaticContact NE2-CE1 3.95Å; H63-H67 AromaticContact NE2-NE2 3.17Å; H63-H67 PolarHBondContact NE2-NE2 3.16Å; H63-H67 VanDerWaalsContact NE2-NE2 3.17Å; K64-H67 PolarHBondContact O-N 3.49Å; H67-G69 PolarHBondContact O-N 3.16Å
68	T	76.1	Confident	77.8	Confident	83 Å²	83	80.4 Å²	80.4	51%	0.509	41%	0.411	S	S	.	.	S	Bend	trans	-76.1	-12.6	175.3	64.8	0	0	0	0	113.4	K64 K65 E70	K64-T68 PolarHBondContact O-N 3.06Å; K65-T68 WeakPolarHBondContact CA-OG1 3.47Å; T68-E70 PolarHBondContact O-N 3.34Å; T68-E70 VanDerWaalsContact O-N 3.17Å
69	G	71.1	Confident	77.6	Confident	47 Å²	47	79.2 Å²	79.2	49%	0.485	42%	0.416	S	S	.	.			trans	69.8	4	-177	0	0	0	0	0	114.7	K65 H67 K71	K65-G69 PolarHBondContact O-N 3.33Å; H67-G69 PolarHBondContact O-N 3.16Å; G69-K71 PolarHBondContact O-N 3.09Å; G69-K71 VanDerWaalsContact O-N 3.16Å
70	E	74.6	Confident	77.4	Confident	111 Å²	111	82.7 Å²	82.7	52%	0.519	43%	0.427	S	S	.	.			trans	-61.6	115.8	-179.8	-76	-175.5	176	0	0	111.5	K65 T68 P72	K65-E70 PolarHBondContact O-N 2.62Å; T68-E70 PolarHBondContact O-N 3.34Å; T68-E70 VanDerWaalsContact O-N 3.17Å; E70-P72 WeakPolarHBondContact O-CD 3.43Å
71	K	79.3	Confident	77.4	Confident	112 Å²	112	83.4 Å²	83.4	49%	0.487	44%	0.435	S	S	.	.			trans	-124.3	80.1	177.1	-70.5	166.3	174.7	-179.1	0	109.9	G69 Y73 A81 F82 T83	G69-K71 PolarHBondContact O-N 3.09Å; G69-K71 VanDerWaalsContact O-N 3.16Å; K71-Y73 PolarHBondContact O-N 3.05Å; K71-A81 HydrophobicContact CB-CB 3.39Å; K71-A81 HydrophobicContact CD-CB 3.95Å; K71-A81 WeakPolarHBondContact CD-O 3.45Å; K71-A81 HydrophobicContact CG-CB 4.27Å; K71-F82 CarbonylContact C-O 3.54Å; K71-F82 WeakPolarHBondContact CA-O 3.47Å; K71-T83 HydrophobicContact CG-CG2 4.1Å
72	P	80.3	Confident	77.4	Confident	75 Å²	75	80.8 Å²	80.8	49%	0.487	42%	0.419	S	S	.	.			trans	-65.7	-21.4	-171.6	-21.4	33.7	0	0	0	114	E70	E70-P72 WeakPolarHBondContact O-CD 3.43Å
73	Y	80.4	Confident	77.5	Confident	95 Å²	95	79.6 Å²	79.6	37%	0.373	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	97.3	-172.5	-57.1	-76.8	0	0	0	110.2	K71 A81 F82	K71-Y73 PolarHBondContact O-N 3.05Å; Y73-A81 CarbonylContact O-C 3.3Å; Y73-A81 WeakPolarHBondContact O-CA 3.25Å; Y73-F82 PolarHBondContact N-O 3.49Å; Y73-F82 VanDerWaalsContact N-O 3.14Å; Y73-F82 PolarHBondContact O-N 3.2Å
74	K	78.4	Confident	77.6	Confident	136 Å²	136	83.5 Å²	83.5	59%	0.591	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.4	143.7	179.6	-64.6	-177.6	-178.9	177.7	0	111.8	A81 L88	K74-A81 HydrophobicContact CG-CB 3.84Å; K74-L88 WeakPolarHBondContact O-CD2 3.49Å
75	C	82.4	Confident	77.7	Confident	1 Å²	1	82 Å²	82	1%	0.007	43%	0.43	C	S	.	.			trans	-91.9	112.7	170.2	177.9	0	0	0	0	108.8	E77 C78 G79 K80 F82 L88 H95	C75-E77 VanDerWaalsContact C-N 3.25Å; C75-E77 PolarHBondContact O-N 3.38Å; C75-C78 PolarHBondContact O-N 3.33Å; C75-G79 VanDerWaalsContact O-CA 3.28Å; C75-G79 WeakPolarHBondContact O-CA 3.38Å; C75-G79 PolarHBondContact O-N 3.34Å; C75-K80 WeakPolarHBondContact CB-O 3.4Å; C75-K80 PolarHBondContact N-O 3.03Å; C75-F82 HydrophobicContact CB-CE2 4.25Å; C75-L88 HydrophobicContact CB-CD1 3.53Å; C75-H95 PolarHBondContact SG-NE2 3.49Å
76	E	80.3	Confident	77.9	Confident	172 Å²	172	83.1 Å²	83.1	80%	0.804	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-29.8	-179.4	-58.5	-52.7	135.9	0	0	113.1
77	E	77.1	Confident	78.3	Confident	130 Å²	130	80 Å²	80	61%	0.607	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-23.6	-177.6	-67.5	171.9	145.8	0	0	114.2	C75 H95	C75-E77 VanDerWaalsContact C-N 3.25Å; C75-E77 PolarHBondContact O-N 3.38Å; E77-H95 WeakPolarHBondContact OE2-CB 3.25Å; E77-H95 IonicContact OE2-CD2 3.63Å; E77-H95 PolarHBondContact OE2-CD2 3.25Å; E77-H95 IonicContact OE2-CG 3.94Å; E77-H95 IonicContact OE2-NE2 3.94Å
78	C	76	Confident	78.8	Confident	53 Å²	53	77.1 Å²	77.1	36%	0.358	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-141	7.6	-176.5	73.1	0	0	0	0	115	C75 K80 H91 H95	C75-C78 PolarHBondContact O-N 3.33Å; C78-K80 PolarHBondContact O-N 2.77Å; C78-H91 PolarHBondContact SG-NE2 3.32Å; C78-H95 PolarHBondContact SG-NE2 3.47Å; C78-H95 VanDerWaalsContact SG-NE2 3.44Å
79	G	75.1	Confident	79.1	Confident	60 Å²	60	77.9 Å²	77.9	62%	0.619	42%	0.417	S	S	*	.			trans	67.3	-0.4	179.7	0	0	0	0	0	115.4	C75 A81	C75-G79 VanDerWaalsContact O-CA 3.28Å; C75-G79 WeakPolarHBondContact O-CA 3.38Å; C75-G79 PolarHBondContact O-N 3.34Å; G79-A81 PolarHBondContact O-N 3.15Å
80	K	76.4	Confident	79.6	Confident	127 Å²	127	80.8 Å²	80.8	55%	0.552	42%	0.418	S	S	*	.			trans	-70.4	130.6	-178.5	-73.4	-177.1	179.8	176.5	0	111.1	C75 C78 F82	C75-K80 WeakPolarHBondContact CB-O 3.4Å; C75-K80 PolarHBondContact N-O 3.03Å; C78-K80 PolarHBondContact O-N 2.77Å; K80-F82 HydrophobicContact CB-CE2 3.88Å; K80-F82 HydrophobicContact CB-CZ 3.99Å; K80-F82 WeakPolarHBondContact O-CE2 3.47Å
81	A	80	Confident	80	Confident	29 Å²	29	76.4 Å²	76.4	24%	0.24	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	142.1	-178.8	0	0	0	0	0	111.6	K71 Y73 K74 G79	K71-A81 HydrophobicContact CB-CB 3.39Å; K71-A81 HydrophobicContact CD-CB 3.95Å; K71-A81 WeakPolarHBondContact CD-O 3.45Å; K71-A81 HydrophobicContact CG-CB 4.27Å; Y73-A81 CarbonylContact O-C 3.3Å; Y73-A81 WeakPolarHBondContact O-CA 3.25Å; K74-A81 HydrophobicContact CG-CB 3.84Å; G79-A81 PolarHBondContact O-N 3.15Å
82	F	80.6	Confident	80.1	Confident	40 Å²	40	75.4 Å²	75.4	18%	0.175	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	152.2	-175.2	-58.3	-91.2	0	0	0	111	K71 Y73 C75 K80 R84 L88 H91	K71-F82 CarbonylContact C-O 3.54Å; K71-F82 WeakPolarHBondContact CA-O 3.47Å; Y73-F82 PolarHBondContact N-O 3.49Å; Y73-F82 VanDerWaalsContact N-O 3.14Å; Y73-F82 PolarHBondContact O-N 3.2Å; C75-F82 HydrophobicContact CB-CE2 4.25Å; K80-F82 HydrophobicContact CB-CE2 3.88Å; K80-F82 HydrophobicContact CB-CZ 3.99Å; K80-F82 WeakPolarHBondContact O-CE2 3.47Å; F82-R84 VanDerWaalsContact C-N 3.35Å; F82-L88 HydrophobicContact CB-CB 4.29Å; F82-L88 HydrophobicContact CD2-CB 3.86Å; F82-L88 HydrophobicContact CD2-CD1 3.64Å; F82-L88 HydrophobicContact CD2-CG 4.33Å; F82-L88 HydrophobicContact CE2-CD1 3.75Å; F82-L88 HydrophobicContact CG-CB 4.2Å; F82-H91 HydrophobicContact CE1-CB 3.91Å; F82-H91 HydrophobicContact CE2-CB 3.97Å; F82-H91 AromaticContact CE2-CD2 3.57Å; F82-H91 AromaticContact CE2-CG 3.7Å; F82-H91 HydrophobicContact CZ-CB 3.46Å; F82-H91 VanDerWaalsContact CZ-CB 3.46Å; F82-H91 AromaticContact CZ-CD2 3.52Å; F82-H91 AromaticContact CZ-CG 3.19Å; F82-H91 AromaticContact CZ-ND1 3.58Å
83	T	78.8	Confident	80.2	Confident	45 Å²	45	74.7 Å²	74.7	28%	0.276	38%	0.382	S	S	.	.	S	Bend	trans	-81.1	-16.8	178.1	54.1	0	0	0	0	112.7	K65 K71	K65-T83 HydrophobicContact CB-CG2 4.46Å; K71-T83 HydrophobicContact CG-CG2 4.1Å
84	R	79.9	Confident	80.2	Confident	103 Å²	103	73.6 Å²	73.6	39%	0.389	38%	0.382	S	S	.	.	S	Bend	trans	-134.3	144.5	179.8	-58.3	-179.7	-177.3	-179.9	-0.3	112.1	E62 F82 T86 T87 L88	E62-R84 IonicContact OE1-CZ 3.95Å; E62-R84 IonicContact OE1-NE 2.93Å; E62-R84 IonicContact OE2-CZ 3.69Å; E62-R84 IonicContact OE2-NE 3.52Å; E62-R84 PolarHBondContact OE2-NE 2.76Å; E62-R84 IonicContact OE2-NH1 3.07Å; E62-R84 IonicContact OE2-NH2 2.62Å; E62-R84 PolarHBondContact OE2-NH2 3.04Å; F82-R84 VanDerWaalsContact C-N 3.35Å; R84-T86 VanDerWaalsContact C-N 3.34Å; R84-T86 PolarHBondContact O-N 3.4Å; R84-T87 HydrophobicContact CB-CG2 4.36Å; R84-T87 PolarHBondContact O-N 3.34Å; R84-T87 PolarHBondContact O-OG1 3.36Å; R84-L88 PolarHBondContact O-N 3.17Å
85	S	80.7	Confident	80.2	Confident	53 Å²	53	70.5 Å²	70.5	37%	0.371	37%	0.37	S	S	.	.	H	α-helix	trans	-64.5	-36.8	175.4	59.8	0	0	0	0	112.6	T87 L88 N89	S85-T87 VanDerWaalsContact C-N 3.34Å; S85-T87 PolarHBondContact O-N 2.8Å; S85-L88 WeakPolarHBondContact O-CB 3.49Å; S85-L88 PolarHBondContact O-N 2.76Å; S85-N89 PolarHBondContact O-N 2.78Å
86	T	82.2	Confident	80.1	Confident	86 Å²	86	74.2 Å²	74.2	53%	0.528	39%	0.392	S	S	.	.	H	α-helix	trans	-61.2	-42.8	177.6	54.3	0	0	0	0	111.8	R84 L88 N89 E90	R84-T86 VanDerWaalsContact C-N 3.34Å; R84-T86 PolarHBondContact O-N 3.4Å; T86-L88 VanDerWaalsContact C-N 3.35Å; T86-N89 PolarHBondContact O-N 3.12Å; T86-E90 WeakPolarHBondContact O-CG 3.27Å; T86-E90 PolarHBondContact O-N 3.27Å
87	T	82.1	Confident	80	Confident	47 Å²	47	67.8 Å²	67.8	29%	0.288	37%	0.373	S	S	.	.	H	α-helix	trans	-68.5	-33.5	177	51.2	0	0	0	0	112.6	R84 S85 H91	R84-T87 HydrophobicContact CB-CG2 4.36Å; R84-T87 PolarHBondContact O-N 3.34Å; R84-T87 PolarHBondContact O-OG1 3.36Å; S85-T87 VanDerWaalsContact C-N 3.34Å; S85-T87 PolarHBondContact O-N 2.8Å; T87-H91 VanDerWaalsContact O-CB 3.28Å; T87-H91 WeakPolarHBondContact O-CB 3.46Å; T87-H91 PolarHBondContact O-N 3.24Å
88	L	83.1	Confident	80.2	Confident	14 Å²	14	66.4 Å²	66.4	7%	0.073	37%	0.366	C	S	.	.	H	α-helix	trans	-65.5	-44	171.1	171.9	63.4	0	0	0	110.9	K74 C75 F82 R84 S85 T86 E90 H91 K92	K74-L88 WeakPolarHBondContact O-CD2 3.49Å; C75-L88 HydrophobicContact CB-CD1 3.53Å; F82-L88 HydrophobicContact CB-CB 4.29Å; F82-L88 HydrophobicContact CD2-CB 3.86Å; F82-L88 HydrophobicContact CD2-CD1 3.64Å; F82-L88 HydrophobicContact CD2-CG 4.33Å; F82-L88 HydrophobicContact CE2-CD1 3.75Å; F82-L88 HydrophobicContact CG-CB 4.2Å; R84-L88 PolarHBondContact O-N 3.17Å; S85-L88 WeakPolarHBondContact O-CB 3.49Å; S85-L88 PolarHBondContact O-N 2.76Å; T86-L88 VanDerWaalsContact C-N 3.35Å; L88-E90 PolarHBondContact O-N 3.44Å; L88-H91 CarbonylContact O-C 3.58Å; L88-H91 WeakPolarHBondContact O-CA 3.41Å; L88-H91 WeakPolarHBondContact O-CB 3.34Å; L88-H91 PolarHBondContact O-N 3.14Å; L88-H91 VanDerWaalsContact O-N 3.14Å; L88-K92 HydrophobicContact CD1-CG 4.38Å; L88-K92 WeakPolarHBondContact O-CG 3.47Å; L88-K92 PolarHBondContact O-N 3.47Å
89	N	81.4	Confident	80.6	Confident	99 Å²	99	69.5 Å²	69.5	53%	0.529	37%	0.373	S	S	.	.	H	α-helix	trans	-64.3	-39.6	177.5	-81.3	-5.9	0	0	0	112.4	S85 T86 H91 K92	S85-N89 PolarHBondContact O-N 2.78Å; T86-N89 PolarHBondContact O-N 3.12Å; N89-H91 VanDerWaalsContact C-N 3.31Å; N89-K92 PolarHBondContact O-N 2.94Å
90	E	82.1	Confident	81.1	Confident	109 Å²	109	70.1 Å²	70.1	51%	0.509	37%	0.367	S	S	.	.	H	α-helix	trans	-64.1	-37.5	171.6	-72.8	-178.9	162.9	0	0	112.2	T86 L88 K93	T86-E90 WeakPolarHBondContact O-CG 3.27Å; T86-E90 PolarHBondContact O-N 3.27Å; L88-E90 PolarHBondContact O-N 3.44Å; E90-K93 WeakPolarHBondContact O-CB 3.27Å; E90-K93 PolarHBondContact O-N 3.19Å
91	H	83.1	Confident	81.6	Confident	19 Å²	19	68.3 Å²	68.3	9%	0.088	36%	0.357	C	S	.	.	H	α-helix	trans	-66.5	-38.5	174.5	171.7	75.4	0	0	0	112.7	C78 F82 T87 L88 N89 K93 I94 H95	C78-H91 PolarHBondContact SG-NE2 3.32Å; F82-H91 HydrophobicContact CE1-CB 3.91Å; F82-H91 HydrophobicContact CE2-CB 3.97Å; F82-H91 AromaticContact CE2-CD2 3.57Å; F82-H91 AromaticContact CE2-CG 3.7Å; F82-H91 HydrophobicContact CZ-CB 3.46Å; F82-H91 VanDerWaalsContact CZ-CB 3.46Å; F82-H91 AromaticContact CZ-CD2 3.52Å; F82-H91 AromaticContact CZ-CG 3.19Å; F82-H91 AromaticContact CZ-ND1 3.58Å; T87-H91 VanDerWaalsContact O-CB 3.28Å; T87-H91 WeakPolarHBondContact O-CB 3.46Å; T87-H91 PolarHBondContact O-N 3.24Å; L88-H91 CarbonylContact O-C 3.58Å; L88-H91 WeakPolarHBondContact O-CA 3.41Å; L88-H91 WeakPolarHBondContact O-CB 3.34Å; L88-H91 PolarHBondContact O-N 3.14Å; L88-H91 VanDerWaalsContact O-N 3.14Å; N89-H91 VanDerWaalsContact C-N 3.31Å; H91-K93 PolarHBondContact O-N 3.4Å; H91-I94 WeakPolarHBondContact O-CA 3.39Å; H91-I94 WeakPolarHBondContact O-CB 3.39Å; H91-I94 WeakPolarHBondContact O-CG1 3.45Å; H91-I94 PolarHBondContact O-N 3.02Å; H91-H95 AromaticContact CD2-NE2 3.88Å; H91-H95 AromaticContact CE1-NE2 3.72Å; H91-H95 AromaticContact NE2-CD2 3.92Å; H91-H95 AromaticContact NE2-CE1 3.96Å; H91-H95 AromaticContact NE2-NE2 3.08Å; H91-H95 PolarHBondContact NE2-NE2 3.19Å
92	K	81	Confident	81.9	Confident	91 Å²	91	74.1 Å²	74.1	40%	0.396	38%	0.377	S	S	.	.	H	α-helix	trans	-58.4	-29.5	177.4	-77.1	-177.7	174.9	-171.9	0	112.9	L88 N89 I94 H95 T96	L88-K92 HydrophobicContact CD1-CG 4.38Å; L88-K92 WeakPolarHBondContact O-CG 3.47Å; L88-K92 PolarHBondContact O-N 3.47Å; N89-K92 PolarHBondContact O-N 2.94Å; K92-I94 PolarHBondContact O-N 2.97Å; K92-H95 PolarHBondContact O-N 3.38Å; K92-T96 PolarHBondContact O-N 2.93Å; K92-T96 VanDerWaalsContact O-N 3.15Å
93	K	83.1	Confident	82.3	Confident	59 Å²	59	72.3 Å²	72.3	26%	0.257	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-18.4	171.3	-59.8	179.3	178.9	178.7	0	113.2	E90 H91 T96 G97 R111	E90-K93 WeakPolarHBondContact O-CB 3.27Å; E90-K93 PolarHBondContact O-N 3.19Å; H91-K93 PolarHBondContact O-N 3.4Å; K93-T96 WeakPolarHBondContact CA-OG1 2.97Å; K93-G97 PolarHBondContact O-N 3.04Å; K93-R111 HydrophobicContact CB-CG 4.15Å; K93-R111 PolarHBondContact O-NE 3.29Å; K93-R111 PolarHBondContact O-NH2 2.96Å
94	I	80.3	Confident	82.6	Confident	72 Å²	72	80.2 Å²	80.2	37%	0.369	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-46.8	173.5	-58.2	-177.9	0	0	0	111.5	H91 K92 R111	H91-I94 WeakPolarHBondContact O-CA 3.39Å; H91-I94 WeakPolarHBondContact O-CB 3.39Å; H91-I94 WeakPolarHBondContact O-CG1 3.45Å; H91-I94 PolarHBondContact O-N 3.02Å; K92-I94 PolarHBondContact O-N 2.97Å; I94-R111 PolarHBondContact O-NH2 3.17Å
95	H	78.8	Confident	82.8	Confident	72 Å²	72	81.4 Å²	81.4	33%	0.333	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-39.9	-175.2	-55.3	-52.6	0	0	0	111.9	C75 E77 C78 H91 K92 G97	C75-H95 PolarHBondContact SG-NE2 3.49Å; E77-H95 WeakPolarHBondContact OE2-CB 3.25Å; E77-H95 IonicContact OE2-CD2 3.63Å; E77-H95 PolarHBondContact OE2-CD2 3.25Å; E77-H95 IonicContact OE2-CG 3.94Å; E77-H95 IonicContact OE2-NE2 3.94Å; C78-H95 PolarHBondContact SG-NE2 3.47Å; C78-H95 VanDerWaalsContact SG-NE2 3.44Å; H91-H95 AromaticContact CD2-NE2 3.88Å; H91-H95 AromaticContact CE1-NE2 3.72Å; H91-H95 AromaticContact NE2-CD2 3.92Å; H91-H95 AromaticContact NE2-CE1 3.96Å; H91-H95 AromaticContact NE2-NE2 3.08Å; H91-H95 PolarHBondContact NE2-NE2 3.19Å; K92-H95 PolarHBondContact O-N 3.38Å; H95-G97 PolarHBondContact O-N 2.93Å; H95-G97 VanDerWaalsContact O-N 3.16Å
96	T	79.2	Confident	83	Confident	78 Å²	78	81.7 Å²	81.7	48%	0.479	41%	0.411	S	S	.	.	S	Bend	trans	-70.6	-11.1	178	66.3	0	0	0	0	113.9	K92 K93 E98	K92-T96 PolarHBondContact O-N 2.93Å; K92-T96 VanDerWaalsContact O-N 3.15Å; K93-T96 WeakPolarHBondContact CA-OG1 2.97Å; T96-E98 PolarHBondContact O-N 3.22Å; T96-E98 VanDerWaalsContact O-N 3.08Å; T96-E98 WeakPolarHBondContact OG1-CG 3.49Å
97	G	79	Confident	83.1	Confident	38 Å²	38	80.1 Å²	80.1	39%	0.392	41%	0.412	S	S	.	.			trans	68	5.2	-178	0	0	0	0	0	114.5	K93 H95 K99	K93-G97 PolarHBondContact O-N 3.04Å; H95-G97 PolarHBondContact O-N 2.93Å; H95-G97 VanDerWaalsContact O-N 3.16Å; G97-K99 PolarHBondContact O-N 3.23Å
98	E	80.7	Confident	83.3	Confident	100 Å²	100	84.2 Å²	84.2	47%	0.467	43%	0.426	S	S	.	.			trans	-55.7	127.5	-178.2	-80.5	178.5	-164.5	0	0	111.8	T96	T96-E98 PolarHBondContact O-N 3.22Å; T96-E98 VanDerWaalsContact O-N 3.08Å; T96-E98 WeakPolarHBondContact OG1-CG 3.49Å
99	K	85.9	Confident	83.5	Confident	118 Å²	118	85.1 Å²	85.1	51%	0.513	44%	0.436	S	S	.	.			trans	-128	75.5	176.9	-70.3	168.2	-178.7	178.7	0	110.1	G97 Y101 A109 F110	G97-K99 PolarHBondContact O-N 3.23Å; K99-Y101 PolarHBondContact O-N 3.35Å; K99-A109 HydrophobicContact CB-CB 3.56Å; K99-A109 HydrophobicContact CD-CB 4.17Å; K99-A109 WeakPolarHBondContact CD-O 3.47Å; K99-A109 HydrophobicContact CG-CB 4.46Å; K99-F110 CarbonylContact C-O 3.22Å; K99-F110 VanDerWaalsContact CA-O 3.28Å; K99-F110 WeakPolarHBondContact CA-O 3.5Å
100	P	85.4	Confident	83.7	Confident	74 Å²	74	82.4 Å²	82.4	48%	0.481	42%	0.419	S	S	.	.			trans	-66.6	-21.8	-172.3	-20.7	33.8	0	0	0	113.8
101	Y	86.6	Confident	83.9	Confident	88 Å²	88	79.9 Å²	79.9	35%	0.345	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	96.2	-170.2	-56.9	-79.1	0	0	0	110.7	K99 A109 F110 R111	K99-Y101 PolarHBondContact O-N 3.35Å; Y101-A109 CarbonylContact O-C 3.55Å; Y101-A109 WeakPolarHBondContact O-CA 3.43Å; Y101-F110 WeakPolarHBondContact CB-O 3.45Å; Y101-F110 PolarHBondContact N-O 3.47Å; Y101-F110 PolarHBondContact O-N 3.27Å; Y101-R111 WeakPolarHBondContact CD2-O 3.43Å; Y101-R111 WeakPolarHBondContact CE2-O 3.43Å
102	K	86.3	Confident	84	Confident	151 Å²	151	84.9 Å²	84.9	66%	0.657	42%	0.423	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.9	135.4	179	-65.4	-177.7	-179.2	178.9	0	112.2	A109	K102-A109 HydrophobicContact CG-CB 3.83Å
103	C	89.1	Confident	84.2	Confident	2 Å²	2	83.5 Å²	83.5	1%	0.014	43%	0.425	C	S	.	.			trans	-75.2	124.7	169.7	-172.7	0	0	0	0	109.3	E105 G107 K108 F110 L116	C103-E105 VanDerWaalsContact C-N 3.28Å; C103-E105 PolarHBondContact O-N 3.12Å; C103-G107 WeakPolarHBondContact O-CA 3.48Å; C103-G107 PolarHBondContact O-N 3.16Å; C103-K108 WeakPolarHBondContact CB-O 3.4Å; C103-K108 PolarHBondContact N-O 2.9Å; C103-F110 HydrophobicContact CB-CE2 4.31Å; C103-L116 HydrophobicContact CB-CD1 3.6Å
104	K	85.5	Confident	84.2	Confident	212 Å²	212	84.9 Å²	84.9	92%	0.922	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-24.7	-178.7	-66.4	-172.8	176.7	-173.9	0	113
105	E	84.1	Confident	84.5	Confident	128 Å²	128	83.2 Å²	83.2	60%	0.598	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-35.6	-174.3	-66.9	173.5	-158.1	0	0	113.7	C103 H123	C103-E105 VanDerWaalsContact C-N 3.28Å; C103-E105 PolarHBondContact O-N 3.12Å; E105-H123 WeakPolarHBondContact OE2-CB 3.22Å; E105-H123 IonicContact OE2-CD2 3.09Å; E105-H123 PolarHBondContact OE2-CD2 3.47Å; E105-H123 IonicContact OE2-CG 3.98Å; E105-H123 IonicContact OE2-ND1 2.94Å
106	C	84.9	Confident	84.9	Confident	58 Å²	58	80.7 Å²	80.7	39%	0.392	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.9	5.3	-179.5	71.3	0	0	0	0	114.6	K108 H119 H123	C106-K108 PolarHBondContact O-N 2.95Å; C106-H119 PolarHBondContact SG-NE2 3.32Å; C106-H123 PolarHBondContact SG-NE2 3.03Å; C106-H123 VanDerWaalsContact SG-NE2 3.38Å
107	G	83.9	Confident	85.1	Confident	54 Å²	54	81.8 Å²	81.8	56%	0.557	43%	0.425	S	S	*	.			trans	70.8	-4.9	178.5	0	0	0	0	0	115.6	C103 A109	C103-G107 WeakPolarHBondContact O-CA 3.48Å; C103-G107 PolarHBondContact O-N 3.16Å; G107-A109 PolarHBondContact O-N 3.35Å
108	K	84.9	Confident	85.4	Confident	132 Å²	132	84.1 Å²	84.1	57%	0.574	43%	0.426	S	S	*	.			trans	-62.7	130.1	-179.3	-82.3	-174.7	176.3	178.2	0	111.7	C103 C106 F110	C103-K108 WeakPolarHBondContact CB-O 3.4Å; C103-K108 PolarHBondContact N-O 2.9Å; C106-K108 PolarHBondContact O-N 2.95Å; K108-F110 HydrophobicContact CB-CE2 3.82Å; K108-F110 HydrophobicContact CB-CZ 4Å; K108-F110 WeakPolarHBondContact O-CD2 3.26Å; K108-F110 WeakPolarHBondContact O-CE2 3.34Å
109	A	88.4	Confident	85.7	Confident	34 Å²	34	80.3 Å²	80.3	28%	0.281	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	139.3	179.3	0	0	0	0	0	111.8	K99 Y101 K102 G107	K99-A109 HydrophobicContact CB-CB 3.56Å; K99-A109 HydrophobicContact CD-CB 4.17Å; K99-A109 WeakPolarHBondContact CD-O 3.47Å; K99-A109 HydrophobicContact CG-CB 4.46Å; Y101-A109 CarbonylContact O-C 3.55Å; Y101-A109 WeakPolarHBondContact O-CA 3.43Å; K102-A109 HydrophobicContact CG-CB 3.83Å; G107-A109 PolarHBondContact O-N 3.35Å
110	F	86.4	Confident	85.7	Confident	41 Å²	41	79 Å²	79	18%	0.18	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	148.7	-178.7	-60.1	-90.5	0	0	0	110.7	K99 Y101 C103 K108 L116 H119	K99-F110 CarbonylContact C-O 3.22Å; K99-F110 VanDerWaalsContact CA-O 3.28Å; K99-F110 WeakPolarHBondContact CA-O 3.5Å; Y101-F110 WeakPolarHBondContact CB-O 3.45Å; Y101-F110 PolarHBondContact N-O 3.47Å; Y101-F110 PolarHBondContact O-N 3.27Å; C103-F110 HydrophobicContact CB-CE2 4.31Å; K108-F110 HydrophobicContact CB-CE2 3.82Å; K108-F110 HydrophobicContact CB-CZ 4Å; K108-F110 WeakPolarHBondContact O-CD2 3.26Å; K108-F110 WeakPolarHBondContact O-CE2 3.34Å; F110-L116 HydrophobicContact CB-CB 4.21Å; F110-L116 HydrophobicContact CD2-CB 3.9Å; F110-L116 HydrophobicContact CD2-CD1 3.69Å; F110-L116 HydrophobicContact CD2-CG 4.39Å; F110-L116 HydrophobicContact CE2-CD1 3.88Å; F110-L116 HydrophobicContact CG-CB 4.19Å; F110-H119 HydrophobicContact CE1-CB 3.85Å; F110-H119 HydrophobicContact CE2-CB 3.92Å; F110-H119 AromaticContact CE2-CD2 3.36Å; F110-H119 WeakPolarHBondContact CE2-CD2 3.37Å; F110-H119 AromaticContact CE2-CG 3.61Å; F110-H119 AromaticContact CE2-NE2 3.97Å; F110-H119 HydrophobicContact CZ-CB 3.42Å; F110-H119 VanDerWaalsContact CZ-CB 3.42Å; F110-H119 AromaticContact CZ-CD2 3.4Å; F110-H119 WeakPolarHBondContact CZ-CD2 3.47Å; F110-H119 AromaticContact CZ-CG 3.15Å; F110-H119 AromaticContact CZ-ND1 3.6Å; F110-H119 AromaticContact CZ-NE2 3.92Å
111	R	85.7	Confident	85.7	Confident	57 Å²	57	76.2 Å²	76.2	22%	0.215	38%	0.383	C	S	.	.	S	Bend	trans	-74.1	-30.2	177.6	-176.6	172.6	-69.8	151.1	-6	112.9	K93 I94 Y101	K93-R111 HydrophobicContact CB-CG 4.15Å; K93-R111 PolarHBondContact O-NE 3.29Å; K93-R111 PolarHBondContact O-NH2 2.96Å; I94-R111 PolarHBondContact O-NH2 3.17Å; Y101-R111 WeakPolarHBondContact CD2-O 3.43Å; Y101-R111 WeakPolarHBondContact CE2-O 3.43Å
112	W	84.4	Confident	85.6	Confident	123 Å²	123	76.1 Å²	76.1	47%	0.466	39%	0.388	S	S	.	.	S	Bend	trans	-126.7	145.7	-176.8	-54.8	-49.5	0	0	0	111.4	T114 S115 L116	W112-T114 VanDerWaalsContact C-N 3.31Å; W112-T114 PolarHBondContact O-N 3.44Å; W112-S115 PolarHBondContact O-N 2.92Å; W112-L116 PolarHBondContact O-N 3.17Å
113	S	85.3	Confident	85.4	Confident	63 Å²	63	72.6 Å²	72.6	44%	0.441	37%	0.373	S	S	.	.	H	α-helix	trans	-63.8	-36.3	178.1	56.8	0	0	0	0	112.3	S115 L116 N117	S113-S115 VanDerWaalsContact C-N 3.35Å; S113-S115 PolarHBondContact O-N 3.29Å; S113-L116 PolarHBondContact O-N 2.82Å; S113-N117 PolarHBondContact O-N 3.39Å
114	T	84.1	Confident	85.1	Confident	88 Å²	88	76.1 Å²	76.1	54%	0.54	40%	0.395	S	S	.	.	H	α-helix	trans	-59.9	-43.7	175.6	50.4	0	0	0	0	111.7	W112 N117 E118	W112-T114 VanDerWaalsContact C-N 3.31Å; W112-T114 PolarHBondContact O-N 3.44Å; T114-N117 PolarHBondContact O-N 2.99Å; T114-E118 PolarHBondContact O-N 3.15Å
115	S	85.6	Confident	84.9	Confident	36 Å²	36	67.8 Å²	67.8	25%	0.252	37%	0.37	S	S	.	.	H	α-helix	trans	-66	-38.1	176.9	-53.8	0	0	0	0	112.6	W112 S113 N117 H119	W112-S115 PolarHBondContact O-N 2.92Å; S113-S115 VanDerWaalsContact C-N 3.35Å; S113-S115 PolarHBondContact O-N 3.29Å; S115-N117 VanDerWaalsContact C-N 3.34Å; S115-H119 VanDerWaalsContact O-CB 3.27Å; S115-H119 WeakPolarHBondContact O-CB 3.28Å; S115-H119 PolarHBondContact O-N 3.2Å
116	L	87.3	Confident	84.8	Confident	19 Å²	19	67.2 Å²	67.2	10%	0.099	37%	0.367	C	S	.	.	H	α-helix	trans	-63.2	-42.3	171.9	172.9	62.1	0	0	0	110.8	C103 F110 W112 S113 H119 K120	C103-L116 HydrophobicContact CB-CD1 3.6Å; F110-L116 HydrophobicContact CB-CB 4.21Å; F110-L116 HydrophobicContact CD2-CB 3.9Å; F110-L116 HydrophobicContact CD2-CD1 3.69Å; F110-L116 HydrophobicContact CD2-CG 4.39Å; F110-L116 HydrophobicContact CE2-CD1 3.88Å; F110-L116 HydrophobicContact CG-CB 4.19Å; W112-L116 PolarHBondContact O-N 3.17Å; S113-L116 PolarHBondContact O-N 2.82Å; L116-H119 WeakPolarHBondContact O-CB 3.33Å; L116-H119 PolarHBondContact O-N 3.42Å; L116-K120 HydrophobicContact CD1-CG 4.5Å; L116-K120 WeakPolarHBondContact O-CG 3.35Å; L116-K120 PolarHBondContact O-N 2.93Å
117	N	84.4	Confident	84.9	Confident	101 Å²	101	69.4 Å²	69.4	54%	0.54	37%	0.37	S	S	.	.	H	α-helix	trans	-65.2	-43.5	-179.9	-158.7	62.5	0	0	0	112	S113 T114 S115 H119 K120 N121	S113-N117 PolarHBondContact O-N 3.39Å; T114-N117 PolarHBondContact O-N 2.99Å; S115-N117 VanDerWaalsContact C-N 3.34Å; N117-H119 VanDerWaalsContact C-N 3.28Å; N117-H119 PolarHBondContact O-N 3.09Å; N117-K120 PolarHBondContact O-N 3.25Å; N117-N121 PolarHBondContact O-OD1 3.44Å
118	E	85.3	Confident	85	Confident	87 Å²	87	70.5 Å²	70.5	41%	0.407	37%	0.367	S	S	.	.	H	α-helix	trans	-62	-37.4	172.2	-71.8	-176.4	-172.1	0	0	112.5	T114 N121 Q140	T114-E118 PolarHBondContact O-N 3.15Å; E118-N121 WeakPolarHBondContact O-CB 3.38Å; E118-N121 PolarHBondContact O-N 3.21Å; E118-Q140 PolarHBondContact OE2-NE2 2.94Å
119	H	86.8	Confident	85.2	Confident	20 Å²	20	68.6 Å²	68.6	9%	0.093	36%	0.357	C	S	.	.	H	α-helix	trans	-66.4	-36.5	176.8	169.1	70.4	0	0	0	112.5	C106 F110 S115 L116 N117 N121 I122 H123	C106-H119 PolarHBondContact SG-NE2 3.32Å; F110-H119 HydrophobicContact CE1-CB 3.85Å; F110-H119 HydrophobicContact CE2-CB 3.92Å; F110-H119 AromaticContact CE2-CD2 3.36Å; F110-H119 WeakPolarHBondContact CE2-CD2 3.37Å; F110-H119 AromaticContact CE2-CG 3.61Å; F110-H119 AromaticContact CE2-NE2 3.97Å; F110-H119 HydrophobicContact CZ-CB 3.42Å; F110-H119 VanDerWaalsContact CZ-CB 3.42Å; F110-H119 AromaticContact CZ-CD2 3.4Å; F110-H119 WeakPolarHBondContact CZ-CD2 3.47Å; F110-H119 AromaticContact CZ-CG 3.15Å; F110-H119 AromaticContact CZ-ND1 3.6Å; F110-H119 AromaticContact CZ-NE2 3.92Å; S115-H119 VanDerWaalsContact O-CB 3.27Å; S115-H119 WeakPolarHBondContact O-CB 3.28Å; S115-H119 PolarHBondContact O-N 3.2Å; L116-H119 WeakPolarHBondContact O-CB 3.33Å; L116-H119 PolarHBondContact O-N 3.42Å; N117-H119 VanDerWaalsContact C-N 3.28Å; N117-H119 PolarHBondContact O-N 3.09Å; H119-N121 PolarHBondContact O-N 3.22Å; H119-I122 WeakPolarHBondContact O-CB 3.48Å; H119-I122 VanDerWaalsContact O-CG1 3.3Å; H119-I122 WeakPolarHBondContact O-CG1 3.28Å; H119-I122 PolarHBondContact O-N 3.39Å; H119-H123 AromaticContact CE1-NE2 3.62Å; H119-H123 AromaticContact NE2-CD2 3.92Å; H119-H123 AromaticContact NE2-NE2 3.27Å; H119-H123 PolarHBondContact NE2-NE2 2.79Å
120	K	84.9	Confident	85.1	Confident	91 Å²	91	74.1 Å²	74.1	40%	0.396	38%	0.375	S	S	.	.	H	α-helix	trans	-57.5	-32	176.3	-75.8	179.4	175.3	-172.3	0	112.8	L116 N117 I122 H123 T124	L116-K120 HydrophobicContact CD1-CG 4.5Å; L116-K120 WeakPolarHBondContact O-CG 3.35Å; L116-K120 PolarHBondContact O-N 2.93Å; N117-K120 PolarHBondContact O-N 3.25Å; K120-I122 PolarHBondContact O-N 2.9Å; K120-H123 PolarHBondContact O-N 2.94Å; K120-T124 PolarHBondContact O-N 2.81Å; K120-T124 VanDerWaalsContact O-N 3.1Å; K120-T124 PolarHBondContact O-OG1 3.31Å
121	N	86.7	Confident	85.2	Confident	15 Å²	15	72.4 Å²	72.4	8%	0.08	37%	0.368	C	S	.	.	H	α-helix	trans	-59.5	-17.1	174.4	-59	-13.3	0	0	0	113.3	N117 E118 H119 T124 G125 R139	N117-N121 PolarHBondContact O-OD1 3.44Å; E118-N121 WeakPolarHBondContact O-CB 3.38Å; E118-N121 PolarHBondContact O-N 3.21Å; H119-N121 PolarHBondContact O-N 3.22Å; N121-T124 WeakPolarHBondContact CA-OG1 3.29Å; N121-G125 PolarHBondContact O-N 2.72Å; N121-R139 HydrophobicContact CB-CB 4.4Å; N121-R139 HydrophobicContact CB-CG 4.34Å; N121-R139 PolarHBondContact O-NE 2.85Å
122	I	83.1	Confident	85.2	Confident	87 Å²	87	79.8 Å²	79.8	45%	0.446	40%	0.401	S	S	.	.	H	α-helix	trans	-68.8	-42.6	173.2	-59.5	-178.4	0	0	0	110.9	H119 K120 R139	H119-I122 WeakPolarHBondContact O-CB 3.48Å; H119-I122 VanDerWaalsContact O-CG1 3.3Å; H119-I122 WeakPolarHBondContact O-CG1 3.28Å; H119-I122 PolarHBondContact O-N 3.39Å; K120-I122 PolarHBondContact O-N 2.9Å; I122-R139 PolarHBondContact O-NH2 2.92Å; I122-R139 VanDerWaalsContact O-NH2 3.17Å
123	H	83.1	Confident	85.2	Confident	76 Å²	76	80 Å²	80	35%	0.352	41%	0.408	S	S	.	.	H	α-helix	trans	-83.1	-44.9	-175.2	-61.2	-69.4	0	0	0	112.5	E105 C106 H119 K120 G125	E105-H123 WeakPolarHBondContact OE2-CB 3.22Å; E105-H123 IonicContact OE2-CD2 3.09Å; E105-H123 PolarHBondContact OE2-CD2 3.47Å; E105-H123 IonicContact OE2-CG 3.98Å; E105-H123 IonicContact OE2-ND1 2.94Å; C106-H123 PolarHBondContact SG-NE2 3.03Å; C106-H123 VanDerWaalsContact SG-NE2 3.38Å; H119-H123 AromaticContact CE1-NE2 3.62Å; H119-H123 AromaticContact NE2-CD2 3.92Å; H119-H123 AromaticContact NE2-NE2 3.27Å; H119-H123 PolarHBondContact NE2-NE2 2.79Å; K120-H123 PolarHBondContact O-N 2.94Å; H123-G125 PolarHBondContact O-N 3.38Å
124	T	81.6	Confident	85.2	Confident	76 Å²	76	79.7 Å²	79.7	47%	0.466	40%	0.404	S	S	.	.	S	Bend	trans	-70.5	-15.2	177.8	62.1	0	0	0	0	112.6	K120 N121 E126	K120-T124 PolarHBondContact O-N 2.81Å; K120-T124 VanDerWaalsContact O-N 3.1Å; K120-T124 PolarHBondContact O-OG1 3.31Å; N121-T124 WeakPolarHBondContact CA-OG1 3.29Å; T124-E126 PolarHBondContact O-N 3.01Å; T124-E126 VanDerWaalsContact O-N 3.14Å; T124-E126 WeakPolarHBondContact OG1-CB 3.43Å; T124-E126 WeakPolarHBondContact OG1-CG 3.48Å; T124-E126 PolarHBondContact OG1-N 3.02Å
125	G	81.2	Confident	85.3	Confident	38 Å²	38	78.1 Å²	78.1	39%	0.392	41%	0.406	S	S	.	.			trans	70.4	0.7	-173.5	0	0	0	0	0	113.7	N121 H123 K127	N121-G125 PolarHBondContact O-N 2.72Å; H123-G125 PolarHBondContact O-N 3.38Å; G125-K127 PolarHBondContact O-N 3.12Å
126	E	82.6	Confident	85.3	Confident	116 Å²	116	82.6 Å²	82.6	54%	0.542	42%	0.421	S	S	.	.			trans	-59.2	133.5	-178.5	-74.3	-177.2	164.4	0	0	111.3	T124	T124-E126 PolarHBondContact O-N 3.01Å; T124-E126 VanDerWaalsContact O-N 3.14Å; T124-E126 WeakPolarHBondContact OG1-CB 3.43Å; T124-E126 WeakPolarHBondContact OG1-CG 3.48Å; T124-E126 PolarHBondContact OG1-N 3.02Å
127	K	86.9	Confident	85.4	Confident	104 Å²	104	83.1 Å²	83.1	45%	0.452	43%	0.428	S	S	.	.			trans	-127.2	79.7	176.7	-66.7	177.7	-174.9	-179.6	0	108.6	G125 Y129 A137 F138 R139	G125-K127 PolarHBondContact O-N 3.12Å; K127-Y129 PolarHBondContact O-N 2.78Å; K127-Y129 VanDerWaalsContact O-N 3.17Å; K127-A137 HydrophobicContact CB-CB 3.44Å; K127-A137 VanDerWaalsContact CB-CB 3.44Å; K127-A137 HydrophobicContact CD-CB 3.99Å; K127-A137 WeakPolarHBondContact CD-O 3.42Å; K127-A137 HydrophobicContact CG-CB 4.36Å; K127-F138 CarbonylContact C-O 3.54Å; K127-F138 VanDerWaalsContact C-O 3.23Å; K127-F138 WeakPolarHBondContact CA-O 3.37Å; K127-R139 HydrophobicContact CG-CG 3.99Å
128	P	86.6	Confident	85.5	Confident	77 Å²	77	80.3 Å²	80.3	50%	0.5	41%	0.411	S	S	.	.			trans	-63.8	-23.9	-170.7	-22.9	34.3	0	0	0	113.7
129	Y	87.9	Confident	85.4	Confident	91 Å²	91	80.5 Å²	80.5	36%	0.357	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	95.5	-171.7	-56.9	-81.1	0	0	0	110.5	K127 A137 F138 R139 Q140	K127-Y129 PolarHBondContact O-N 2.78Å; K127-Y129 VanDerWaalsContact O-N 3.17Å; Y129-A137 CarbonylContact O-C 3.55Å; Y129-A137 WeakPolarHBondContact O-CA 3.4Å; Y129-F138 PolarHBondContact N-O 2.76Å; Y129-F138 VanDerWaalsContact N-O 3.08Å; Y129-F138 PolarHBondContact O-N 3.08Å; Y129-R139 WeakPolarHBondContact CE2-O 3.45Å; Y129-Q140 VanDerWaalsContact CD2-C 3.41Å
130	K	87.1	Confident	85.4	Confident	151 Å²	151	83.5 Å²	83.5	66%	0.657	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.6	134.3	179.9	-61.9	-175.2	-178.9	179	0	112.1	A137	K130-A137 HydrophobicContact CG-CB 3.88Å
131	C	89.6	Confident	85.4	Confident	4 Å²	4	82.4 Å²	82.4	3%	0.027	43%	0.426	C	S	.	.			trans	-75.2	125.4	168.6	-179.4	0	0	0	0	109.3	E133 C134 G135 K136 F138 L144 H151	C131-E133 VanDerWaalsContact C-N 3.35Å; C131-C134 VanDerWaalsContact SG-SG 3.64Å; C131-G135 VanDerWaalsContact O-CA 3.22Å; C131-G135 WeakPolarHBondContact O-CA 3.27Å; C131-G135 PolarHBondContact O-N 3.31Å; C131-K136 VanDerWaalsContact CB-O 3.29Å; C131-K136 WeakPolarHBondContact CB-O 3.48Å; C131-K136 PolarHBondContact N-O 3.29Å; C131-F138 HydrophobicContact CB-CE2 4.4Å; C131-L144 HydrophobicContact CB-CD1 3.64Å; C131-H151 PolarHBondContact SG-NE2 2.91Å
132	K	85.7	Confident	85.3	Confident	213 Å²	213	90.6 Å²	90.6	93%	0.926	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-27.4	-179.8	-65.9	-172.9	177	-174.8	0	113
133	E	84.6	Confident	85.4	Confident	128 Å²	128	88.4 Å²	88.4	60%	0.598	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-36.9	-174.4	-69.5	161.9	171.4	0	0	113.1	C131 H151	C131-E133 VanDerWaalsContact C-N 3.35Å; E133-H151 WeakPolarHBondContact OE2-CB 3.42Å; E133-H151 IonicContact OE2-CD2 3.99Å; E133-H151 PolarHBondContact OE2-CD2 3.19Å; E133-H151 IonicContact OE2-CG 3.49Å; E133-H151 IonicContact OE2-NE2 3.16Å
134	C	85.3	Confident	85.7	Confident	55 Å²	55	85.7 Å²	85.7	37%	0.372	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.8	5.3	-176.6	74.2	0	0	0	0	114.4	C131 K136 H147 H151	C131-C134 VanDerWaalsContact SG-SG 3.64Å; C134-K136 PolarHBondContact O-N 2.97Å; C134-H147 PolarHBondContact SG-NE2 3.45Å; C134-H151 PolarHBondContact SG-NE2 3.47Å; C134-H151 VanDerWaalsContact SG-NE2 3.4Å
135	G	84.3	Confident	85.8	Confident	55 Å²	55	86.7 Å²	86.7	57%	0.567	44%	0.438	S	S	*	.			trans	69.8	-4.9	179.9	0	0	0	0	0	115.5	C131 A137	C131-G135 VanDerWaalsContact O-CA 3.22Å; C131-G135 WeakPolarHBondContact O-CA 3.27Å; C131-G135 PolarHBondContact O-N 3.31Å; G135-A137 PolarHBondContact O-N 3.44Å
136	K	86.3	Confident	86	Confident	130 Å²	130	88 Å²	88	57%	0.565	43%	0.434	S	S	*	.			trans	-63.6	130.9	-179.6	-75.5	-177.9	178.8	175.2	0	111.2	C131 C134 F138	C131-K136 VanDerWaalsContact CB-O 3.29Å; C131-K136 WeakPolarHBondContact CB-O 3.48Å; C131-K136 PolarHBondContact N-O 3.29Å; C134-K136 PolarHBondContact O-N 2.97Å; K136-F138 HydrophobicContact CB-CE2 3.95Å; K136-F138 HydrophobicContact CB-CZ 4.1Å; K136-F138 WeakPolarHBondContact O-CE2 3.5Å
137	A	88.8	Confident	86.2	Confident	30 Å²	30	83.3 Å²	83.3	25%	0.248	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	146.1	-180	0	0	0	0	0	111.9	K127 Y129 K130 G135	K127-A137 HydrophobicContact CB-CB 3.44Å; K127-A137 VanDerWaalsContact CB-CB 3.44Å; K127-A137 HydrophobicContact CD-CB 3.99Å; K127-A137 WeakPolarHBondContact CD-O 3.42Å; K127-A137 HydrophobicContact CG-CB 4.36Å; Y129-A137 CarbonylContact O-C 3.55Å; Y129-A137 WeakPolarHBondContact O-CA 3.4Å; K130-A137 HydrophobicContact CG-CB 3.88Å; G135-A137 PolarHBondContact O-N 3.44Å
138	F	87.3	Confident	86.1	Confident	42 Å²	42	82.8 Å²	82.8	18%	0.184	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	152.1	-178.2	-58.8	-90.4	0	0	0	111.1	K127 Y129 C131 K136 L144 H147	K127-F138 CarbonylContact C-O 3.54Å; K127-F138 VanDerWaalsContact C-O 3.23Å; K127-F138 WeakPolarHBondContact CA-O 3.37Å; Y129-F138 PolarHBondContact N-O 2.76Å; Y129-F138 VanDerWaalsContact N-O 3.08Å; Y129-F138 PolarHBondContact O-N 3.08Å; C131-F138 HydrophobicContact CB-CE2 4.4Å; K136-F138 HydrophobicContact CB-CE2 3.95Å; K136-F138 HydrophobicContact CB-CZ 4.1Å; K136-F138 WeakPolarHBondContact O-CE2 3.5Å; F138-L144 HydrophobicContact CB-CB 4.28Å; F138-L144 HydrophobicContact CD2-CB 3.84Å; F138-L144 HydrophobicContact CD2-CD1 3.72Å; F138-L144 HydrophobicContact CD2-CG 4.38Å; F138-L144 HydrophobicContact CE2-CD1 3.87Å; F138-L144 HydrophobicContact CG-CB 4.21Å; F138-H147 HydrophobicContact CE1-CB 3.93Å; F138-H147 HydrophobicContact CE2-CB 3.83Å; F138-H147 AromaticContact CE2-CD2 3.45Å; F138-H147 VanDerWaalsContact CE2-CD2 3.45Å; F138-H147 WeakPolarHBondContact CE2-CD2 3.09Å; F138-H147 AromaticContact CE2-CG 3.64Å; F138-H147 HydrophobicContact CZ-CB 3.38Å; F138-H147 AromaticContact CZ-CD2 3.48Å; F138-H147 VanDerWaalsContact CZ-CD2 3.48Å; F138-H147 WeakPolarHBondContact CZ-CD2 3.37Å; F138-H147 AromaticContact CZ-CG 3.2Å; F138-H147 AromaticContact CZ-ND1 3.73Å
139	R	84.3	Confident	86	Confident	91 Å²	91	79.9 Å²	79.9	34%	0.343	39%	0.39	S	S	.	.	S	Bend	trans	-80	-22.8	178	-65.9	-176.8	172.1	157.7	-4.5	113.3	N121 I122 K127 Y129	N121-R139 HydrophobicContact CB-CB 4.4Å; N121-R139 HydrophobicContact CB-CG 4.34Å; N121-R139 PolarHBondContact O-NE 2.85Å; I122-R139 PolarHBondContact O-NH2 2.92Å; I122-R139 VanDerWaalsContact O-NH2 3.17Å; K127-R139 HydrophobicContact CG-CG 3.99Å; Y129-R139 WeakPolarHBondContact CE2-O 3.45Å
140	Q	85.4	Confident	85.8	Confident	83 Å²	83	80.5 Å²	80.5	39%	0.388	40%	0.399	S	S	.	.	S	Bend	trans	-130.5	143.5	-176.8	-70.7	178.2	-19.8	0	0	110.8	E118 Y129 R142 S143 L144	E118-Q140 PolarHBondContact OE2-NE2 2.94Å; Y129-Q140 VanDerWaalsContact CD2-C 3.41Å; Q140-R142 VanDerWaalsContact C-N 3.34Å; Q140-R142 PolarHBondContact O-N 3.14Å; Q140-S143 PolarHBondContact O-N 3.41Å; Q140-L144 PolarHBondContact O-N 2.9Å
141	S	85.9	Confident	85.5	Confident	68 Å²	68	77 Å²	77	48%	0.476	38%	0.384	S	S	.	.	H	α-helix	trans	-60.8	-40.8	177.8	-175.9	0	0	0	0	112.3	S143 L144 N145	S141-S143 VanDerWaalsContact C-N 3.32Å; S141-S143 PolarHBondContact O-N 3.2Å; S141-L144 WeakPolarHBondContact O-CB 3.42Å; S141-L144 PolarHBondContact O-N 2.58Å; S141-L144 VanDerWaalsContact O-N 3.16Å; S141-N145 PolarHBondContact O-N 2.82Å
142	R	84	Confident	85.1	Confident	188 Å²	188	80.4 Å²	80.4	71%	0.709	41%	0.405	S	S	*	.	H	α-helix	trans	-56.4	-45.6	177	-178.7	-177.6	-67.9	171.6	-1.1	111.9	Q140 L144 N145 E146	Q140-R142 VanDerWaalsContact C-N 3.34Å; Q140-R142 PolarHBondContact O-N 3.14Å; R142-L144 VanDerWaalsContact C-N 3.32Å; R142-L144 PolarHBondContact O-N 3.09Å; R142-N145 WeakPolarHBondContact O-CB 3.36Å; R142-N145 PolarHBondContact O-N 2.82Å; R142-N145 VanDerWaalsContact O-N 3.12Å; R142-E146 WeakPolarHBondContact O-CG 3.25Å; R142-E146 PolarHBondContact O-N 3.14Å
143	S	85.5	Confident	84.8	Confident	40 Å²	40	72.6 Å²	72.6	28%	0.28	39%	0.385	S	S	.	.	H	α-helix	trans	-65.1	-36.2	179.8	-51.2	0	0	0	0	112.4	Q140 S141 H147	Q140-S143 PolarHBondContact O-N 3.41Å; S141-S143 VanDerWaalsContact C-N 3.32Å; S141-S143 PolarHBondContact O-N 3.2Å; S143-H147 VanDerWaalsContact O-CB 3.27Å; S143-H147 WeakPolarHBondContact O-CB 3.43Å; S143-H147 PolarHBondContact O-N 3.45Å
144	L	87.9	Confident	84.6	Confident	19 Å²	19	71.9 Å²	71.9	10%	0.099	38%	0.382	C	S	.	.	H	α-helix	trans	-64.6	-42	171.7	172.7	62.9	0	0	0	111	C131 F138 Q140 S141 R142 H147 K148	C131-L144 HydrophobicContact CB-CD1 3.64Å; F138-L144 HydrophobicContact CB-CB 4.28Å; F138-L144 HydrophobicContact CD2-CB 3.84Å; F138-L144 HydrophobicContact CD2-CD1 3.72Å; F138-L144 HydrophobicContact CD2-CG 4.38Å; F138-L144 HydrophobicContact CE2-CD1 3.87Å; F138-L144 HydrophobicContact CG-CB 4.21Å; Q140-L144 PolarHBondContact O-N 2.9Å; S141-L144 WeakPolarHBondContact O-CB 3.42Å; S141-L144 PolarHBondContact O-N 2.58Å; S141-L144 VanDerWaalsContact O-N 3.16Å; R142-L144 VanDerWaalsContact C-N 3.32Å; R142-L144 PolarHBondContact O-N 3.09Å; L144-H147 WeakPolarHBondContact O-CB 3.27Å; L144-H147 PolarHBondContact O-N 3.37Å; L144-K148 HydrophobicContact CD1-CG 4.47Å; L144-K148 WeakPolarHBondContact O-CG 3.4Å; L144-K148 PolarHBondContact O-N 3.49Å
145	N	84.9	Confident	84.5	Confident	97 Å²	97	75.1 Å²	75.1	52%	0.519	39%	0.39	S	S	.	.	H	α-helix	trans	-64.5	-45.7	179.2	-159.2	70.5	0	0	0	112	S141 R142 H147 K148 N149	S141-N145 PolarHBondContact O-N 2.82Å; R142-N145 WeakPolarHBondContact O-CB 3.36Å; R142-N145 PolarHBondContact O-N 2.82Å; R142-N145 VanDerWaalsContact O-N 3.12Å; N145-H147 PolarHBondContact O-N 3.18Å; N145-K148 WeakPolarHBondContact O-CB 3.49Å; N145-K148 PolarHBondContact O-N 3.44Å; N145-N149 PolarHBondContact O-N 3.15Å; N145-N149 PolarHBondContact O-OD1 3.17Å
146	E	84.9	Confident	84.5	Confident	66 Å²	66	76.1 Å²	76.1	31%	0.308	39%	0.386	S	S	.	.	H	α-helix	trans	-61.3	-34.1	173	-71	174.1	-172.2	0	0	112.3	R142 N149	R142-E146 WeakPolarHBondContact O-CG 3.25Å; R142-E146 PolarHBondContact O-N 3.14Å; E146-N149 WeakPolarHBondContact O-CB 3.43Å
147	H	86.6	Confident	84.5	Confident	18 Å²	18	74.4 Å²	74.4	8%	0.083	38%	0.377	C	S	.	.	H	α-helix	trans	-68.8	-38.2	175.3	173.4	65.3	0	0	0	112.6	C134 F138 S143 L144 N145 N149 I150 H151	C134-H147 PolarHBondContact SG-NE2 3.45Å; F138-H147 HydrophobicContact CE1-CB 3.93Å; F138-H147 HydrophobicContact CE2-CB 3.83Å; F138-H147 AromaticContact CE2-CD2 3.45Å; F138-H147 VanDerWaalsContact CE2-CD2 3.45Å; F138-H147 WeakPolarHBondContact CE2-CD2 3.09Å; F138-H147 AromaticContact CE2-CG 3.64Å; F138-H147 HydrophobicContact CZ-CB 3.38Å; F138-H147 AromaticContact CZ-CD2 3.48Å; F138-H147 VanDerWaalsContact CZ-CD2 3.48Å; F138-H147 WeakPolarHBondContact CZ-CD2 3.37Å; F138-H147 AromaticContact CZ-CG 3.2Å; F138-H147 AromaticContact CZ-ND1 3.73Å; S143-H147 VanDerWaalsContact O-CB 3.27Å; S143-H147 WeakPolarHBondContact O-CB 3.43Å; S143-H147 PolarHBondContact O-N 3.45Å; L144-H147 WeakPolarHBondContact O-CB 3.27Å; L144-H147 PolarHBondContact O-N 3.37Å; N145-H147 PolarHBondContact O-N 3.18Å; H147-N149 PolarHBondContact O-N 3.08Å; H147-I150 VanDerWaalsContact O-CB 3.25Å; H147-I150 WeakPolarHBondContact O-CB 3.44Å; H147-I150 WeakPolarHBondContact O-CG1 3.19Å; H147-I150 PolarHBondContact O-N 3.43Å; H147-H151 AromaticContact CD2-NE2 3.82Å; H147-H151 AromaticContact CE1-NE2 3.57Å; H147-H151 AromaticContact NE2-CD2 3.86Å; H147-H151 AromaticContact NE2-CE1 3.88Å; H147-H151 AromaticContact NE2-NE2 3.02Å; H147-H151 PolarHBondContact NE2-NE2 3.3Å
148	K	85.3	Confident	84.3	Confident	93 Å²	93	76.6 Å²	76.6	40%	0.404	39%	0.387	S	S	.	.	H	α-helix	trans	-58.6	-32.1	177.6	-76.1	-179.6	175.7	-171.3	0	112.6	L144 N145 I150 H151 T152	L144-K148 HydrophobicContact CD1-CG 4.47Å; L144-K148 WeakPolarHBondContact O-CG 3.4Å; L144-K148 PolarHBondContact O-N 3.49Å; N145-K148 WeakPolarHBondContact O-CB 3.49Å; N145-K148 PolarHBondContact O-N 3.44Å; K148-I150 PolarHBondContact O-N 3.48Å; K148-H151 PolarHBondContact O-N 2.93Å; K148-T152 PolarHBondContact O-N 3.46Å; K148-T152 PolarHBondContact O-OG1 2.86Å
149	N	85.4	Confident	84.2	Confident	16 Å²	16	74.8 Å²	74.8	9%	0.086	38%	0.38	C	S	.	.	H	α-helix	trans	-57.1	-21.4	174.2	-61.6	-6.3	0	0	0	113.3	N145 E146 H147 T152 G153 E154 N167	N145-N149 PolarHBondContact O-N 3.15Å; N145-N149 PolarHBondContact O-OD1 3.17Å; E146-N149 WeakPolarHBondContact O-CB 3.43Å; H147-N149 PolarHBondContact O-N 3.08Å; N149-T152 WeakPolarHBondContact CA-OG1 3.32Å; N149-G153 CarbonylContact O-C 3.28Å; N149-G153 WeakPolarHBondContact O-CA 2.96Å; N149-G153 PolarHBondContact O-N 3.17Å; N149-G153 VanDerWaalsContact O-N 3.17Å; N149-E154 WeakPolarHBondContact CB-O 3.4Å; N149-E154 PolarHBondContact O-N 3.46Å; N149-N167 HydrophobicContact CB-CB 4.06Å; N149-N167 PolarHBondContact ND2-O 3.38Å
150	I	81.9	Confident	84.2	Confident	104 Å²	104	78.7 Å²	78.7	53%	0.533	40%	0.402	S	S	.	.	H	α-helix	trans	-72.9	-37.5	175.5	-58.5	175	0	0	0	110.9	H147 K148	H147-I150 VanDerWaalsContact O-CB 3.25Å; H147-I150 WeakPolarHBondContact O-CB 3.44Å; H147-I150 WeakPolarHBondContact O-CG1 3.19Å; H147-I150 PolarHBondContact O-N 3.43Å; K148-I150 PolarHBondContact O-N 3.48Å
151	H	81.6	Confident	84	Confident	76 Å²	76	82.1 Å²	82.1	35%	0.352	42%	0.416	S	S	.	.	H	α-helix	trans	-81.8	-40.8	-178.3	-59	-55	0	0	0	112	C131 E133 C134 H147 K148 G153	C131-H151 PolarHBondContact SG-NE2 2.91Å; E133-H151 WeakPolarHBondContact OE2-CB 3.42Å; E133-H151 IonicContact OE2-CD2 3.99Å; E133-H151 PolarHBondContact OE2-CD2 3.19Å; E133-H151 IonicContact OE2-CG 3.49Å; E133-H151 IonicContact OE2-NE2 3.16Å; C134-H151 PolarHBondContact SG-NE2 3.47Å; C134-H151 VanDerWaalsContact SG-NE2 3.4Å; H147-H151 AromaticContact CD2-NE2 3.82Å; H147-H151 AromaticContact CE1-NE2 3.57Å; H147-H151 AromaticContact NE2-CD2 3.86Å; H147-H151 AromaticContact NE2-CE1 3.88Å; H147-H151 AromaticContact NE2-NE2 3.02Å; H147-H151 PolarHBondContact NE2-NE2 3.3Å; K148-H151 PolarHBondContact O-N 2.93Å; H151-G153 PolarHBondContact O-N 2.91Å
152	T	81.2	Confident	83.9	Confident	76 Å²	76	81.6 Å²	81.6	47%	0.466	41%	0.411	S	S	.	.	H	α-helix	trans	-75.1	-15.3	176.8	61.1	0	0	0	0	112.6	K148 N149 E154	K148-T152 PolarHBondContact O-N 3.46Å; K148-T152 PolarHBondContact O-OG1 2.86Å; N149-T152 WeakPolarHBondContact CA-OG1 3.32Å; T152-E154 PolarHBondContact O-N 3.27Å; T152-E154 VanDerWaalsContact O-N 3.16Å; T152-E154 WeakPolarHBondContact OG1-CB 3.35Å; T152-E154 WeakPolarHBondContact OG1-CG 3.48Å; T152-E154 PolarHBondContact OG1-N 2.81Å
153	G	79.9	Confident	83.8	Confident	49 Å²	49	75.4 Å²	75.4	51%	0.505	41%	0.406	S	S	.	.			trans	68.3	3.8	-172	0	0	0	0	0	113.7	N149 H151 K155	N149-G153 CarbonylContact O-C 3.28Å; N149-G153 WeakPolarHBondContact O-CA 2.96Å; N149-G153 PolarHBondContact O-N 3.17Å; N149-G153 VanDerWaalsContact O-N 3.17Å; H151-G153 PolarHBondContact O-N 2.91Å; G153-K155 PolarHBondContact O-N 2.95Å
154	E	80.2	Confident	83.7	Confident	114 Å²	114	79.7 Å²	79.7	53%	0.533	42%	0.42	S	S	.	.			trans	-61.2	127.6	179.8	-74.4	-179.5	167.9	0	0	110.3	N149 T152 P156	N149-E154 WeakPolarHBondContact CB-O 3.4Å; N149-E154 PolarHBondContact O-N 3.46Å; T152-E154 PolarHBondContact O-N 3.27Å; T152-E154 VanDerWaalsContact O-N 3.16Å; T152-E154 WeakPolarHBondContact OG1-CB 3.35Å; T152-E154 WeakPolarHBondContact OG1-CG 3.48Å; T152-E154 PolarHBondContact OG1-N 2.81Å; E154-P156 WeakPolarHBondContact O-CD 3.39Å
155	K	83.8	Confident	83.6	Confident	123 Å²	123	80.4 Å²	80.4	54%	0.535	43%	0.428	S	S	.	.			trans	-124.4	77.6	176.8	-71.1	170.3	178.7	179.8	0	108.8	G153 Y157 A165 F166	G153-K155 PolarHBondContact O-N 2.95Å; K155-Y157 PolarHBondContact O-N 2.95Å; K155-A165 HydrophobicContact CB-CB 3.4Å; K155-A165 VanDerWaalsContact CB-CB 3.4Å; K155-A165 HydrophobicContact CD-CB 3.89Å; K155-A165 WeakPolarHBondContact CD-O 3.49Å; K155-A165 HydrophobicContact CG-CB 4.27Å; K155-F166 CarbonylContact C-O 3.24Å; K155-F166 VanDerWaalsContact C-O 3.22Å; K155-F166 VanDerWaalsContact CA-O 3.27Å; K155-F166 WeakPolarHBondContact CA-O 3.43Å
156	P	84.6	Confident	83.5	Confident	76 Å²	76	77.8 Å²	77.8	49%	0.494	41%	0.412	S	S	.	.			trans	-64.1	-15.6	-170.6	-20.3	32.5	0	0	0	113.9	E154	E154-P156 WeakPolarHBondContact O-CD 3.39Å
157	Y	85.6	Confident	83.4	Confident	93 Å²	93	76.9 Å²	76.9	37%	0.365	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	94.2	-172.3	-55.7	-72.4	0	0	0	110.2	K155 A165 F166 S169	K155-Y157 PolarHBondContact O-N 2.95Å; Y157-A165 CarbonylContact O-C 3.58Å; Y157-A165 WeakPolarHBondContact O-CA 3.27Å; Y157-F166 WeakPolarHBondContact CB-O 3.44Å; Y157-F166 PolarHBondContact N-O 3Å; Y157-F166 VanDerWaalsContact N-O 3.15Å; Y157-F166 WeakPolarHBondContact O-CD2 3.3Å; Y157-F166 PolarHBondContact O-N 3.01Å; Y157-S169 VanDerWaalsContact CD2-N 3.31Å; Y157-S169 VanDerWaalsContact CE2-N 3.33Å
158	T	84.7	Confident	83.2	Confident	77 Å²	77	79.2 Å²	79.2	47%	0.472	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	143.2	179.2	49	0	0	0	0	112.2	A165 L172	T158-A165 HydrophobicContact CG2-CB 3.72Å; T158-L172 WeakPolarHBondContact O-CD2 3.34Å
159	C	85.3	Confident	83	Confident	3 Å²	3	77.4 Å²	77.4	2%	0.02	42%	0.42	C	S	.	.			trans	-88.3	112.6	171	-174.9	0	0	0	0	109.6	K161 C162 G163 K164 F166 L172 H179	C159-K161 PolarHBondContact O-N 3.45Å; C159-C162 PolarHBondContact O-N 2.92Å; C159-G163 VanDerWaalsContact O-CA 3.27Å; C159-G163 WeakPolarHBondContact O-CA 3.19Å; C159-G163 PolarHBondContact O-N 3.32Å; C159-K164 WeakPolarHBondContact CB-O 3.43Å; C159-K164 PolarHBondContact N-O 3.37Å; C159-F166 HydrophobicContact CB-CE2 4.49Å; C159-L172 HydrophobicContact CB-CD1 3.66Å; C159-H179 VanDerWaalsContact SG-CD2 3.51Å
160	E	84.2	Confident	82.8	Confident	174 Å²	174	79.3 Å²	79.3	81%	0.813	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-31.4	179.3	-69.9	162.5	-154.9	0	0	113.2
161	K	80.9	Confident	82.8	Confident	155 Å²	155	76.1 Å²	76.1	67%	0.674	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-31.1	-178.7	-76.3	-171.2	174.4	-167	0	114.8	C159 H179	C159-K161 PolarHBondContact O-N 3.45Å; K161-H179 HydrophobicContact CD-CB 3.63Å; K161-H179 PolarHBondContact NZ-O 3.15Å; K161-H179 VanDerWaalsContact NZ-O 3.17Å
162	C	83.1	Confident	82.9	Confident	56 Å²	56	73.1 Å²	73.1	38%	0.378	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135.8	6.7	-174.1	73.3	0	0	0	0	114.6	C159 K164 H175 H179	C159-C162 PolarHBondContact O-N 2.92Å; C162-K164 PolarHBondContact O-N 3.14Å; C162-H175 PolarHBondContact SG-NE2 3.17Å; C162-H179 PolarHBondContact SG-NE2 3.04Å
163	G	82.6	Confident	82.8	Confident	59 Å²	59	74.4 Å²	74.4	61%	0.608	41%	0.411	S	S	*	.			trans	69	-3.3	-179.9	0	0	0	0	0	115.6	C159 A165	C159-G163 VanDerWaalsContact O-CA 3.27Å; C159-G163 WeakPolarHBondContact O-CA 3.19Å; C159-G163 PolarHBondContact O-N 3.32Å; G163-A165 PolarHBondContact O-N 3.33Å
164	K	82.5	Confident	82.5	Confident	130 Å²	130	74.1 Å²	74.1	57%	0.565	40%	0.397	S	S	*	.			trans	-67	127.7	-178.6	-79.7	-173.6	176.2	178.5	0	111.6	C159 C162 F166	C159-K164 WeakPolarHBondContact CB-O 3.43Å; C159-K164 PolarHBondContact N-O 3.37Å; C162-K164 PolarHBondContact O-N 3.14Å; K164-F166 HydrophobicContact CB-CE2 3.96Å; K164-F166 HydrophobicContact CB-CZ 4.04Å; K164-F166 WeakPolarHBondContact O-CE2 3.15Å
165	A	86.1	Confident	82.5	Confident	34 Å²	34	69.6 Å²	69.6	28%	0.281	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	143.4	-179.8	0	0	0	0	0	112.1	K155 Y157 T158 G163	K155-A165 HydrophobicContact CB-CB 3.4Å; K155-A165 VanDerWaalsContact CB-CB 3.4Å; K155-A165 HydrophobicContact CD-CB 3.89Å; K155-A165 WeakPolarHBondContact CD-O 3.49Å; K155-A165 HydrophobicContact CG-CB 4.27Å; Y157-A165 CarbonylContact O-C 3.58Å; Y157-A165 WeakPolarHBondContact O-CA 3.27Å; T158-A165 HydrophobicContact CG2-CB 3.72Å; G163-A165 PolarHBondContact O-N 3.33Å
166	F	84.1	Confident	82.1	Confident	42 Å²	42	69 Å²	69	18%	0.184	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	149.9	-178.9	-57.5	-89.1	0	0	0	110.8	K155 Y157 C159 K164 L172 H175	K155-F166 CarbonylContact C-O 3.24Å; K155-F166 VanDerWaalsContact C-O 3.22Å; K155-F166 VanDerWaalsContact CA-O 3.27Å; K155-F166 WeakPolarHBondContact CA-O 3.43Å; Y157-F166 WeakPolarHBondContact CB-O 3.44Å; Y157-F166 PolarHBondContact N-O 3Å; Y157-F166 VanDerWaalsContact N-O 3.15Å; Y157-F166 WeakPolarHBondContact O-CD2 3.3Å; Y157-F166 PolarHBondContact O-N 3.01Å; C159-F166 HydrophobicContact CB-CE2 4.49Å; K164-F166 HydrophobicContact CB-CE2 3.96Å; K164-F166 HydrophobicContact CB-CZ 4.04Å; K164-F166 WeakPolarHBondContact O-CE2 3.15Å; F166-L172 HydrophobicContact CB-CB 4.4Å; F166-L172 HydrophobicContact CD2-CB 3.9Å; F166-L172 HydrophobicContact CD2-CD1 3.77Å; F166-L172 HydrophobicContact CD2-CG 4.45Å; F166-L172 HydrophobicContact CE2-CD1 3.94Å; F166-L172 HydrophobicContact CG-CB 4.34Å; F166-H175 HydrophobicContact CE1-CB 3.99Å; F166-H175 HydrophobicContact CE2-CB 3.71Å; F166-H175 AromaticContact CE2-CD2 3.45Å; F166-H175 VanDerWaalsContact CE2-CD2 3.45Å; F166-H175 WeakPolarHBondContact CE2-CD2 3.48Å; F166-H175 AromaticContact CE2-CG 3.54Å; F166-H175 HydrophobicContact CZ-CB 3.38Å; F166-H175 AromaticContact CZ-CD2 3.53Å; F166-H175 AromaticContact CZ-CG 3.17Å; F166-H175 AromaticContact CZ-ND1 3.57Å
167	N	82.3	Confident	81.5	Confident	46 Å²	46	66 Å²	66	25%	0.246	35%	0.352	C	S	.	.	S	Bend	trans	-83.8	-10.9	177.5	60.7	4.3	0	0	0	113.4	N149	N149-N167 HydrophobicContact CB-CB 4.06Å; N149-N167 PolarHBondContact ND2-O 3.38Å
168	Q	82	Confident	80.8	Confident	67 Å²	67	67.2 Å²	67.2	31%	0.313	36%	0.363	S	S	.	.	S	Bend	trans	-134.1	140	-179.3	-68.3	176.4	-0.5	0	0	110.8	S170 S171 L172	Q168-S170 PolarHBondContact O-N 3.19Å; Q168-S171 WeakPolarHBondContact O-CB 3.4Å; Q168-S171 PolarHBondContact O-N 3.01Å; Q168-L172 PolarHBondContact O-N 2.91Å
169	S	82.3	Confident	80.1	Confident	56 Å²	56	66.5 Å²	66.5	39%	0.392	35%	0.354	S	S	.	.	H	α-helix	trans	-64.7	-38.3	179.2	60	0	0	0	0	112.5	Y157 S171 L172 I173	Y157-S169 VanDerWaalsContact CD2-N 3.31Å; Y157-S169 VanDerWaalsContact CE2-N 3.33Å; S169-S171 VanDerWaalsContact C-N 3.29Å; S169-S171 PolarHBondContact O-N 3.21Å; S169-L172 PolarHBondContact O-N 2.94Å; S169-L172 VanDerWaalsContact O-N 3.17Å; S169-I173 WeakPolarHBondContact O-CG1 3.36Å; S169-I173 PolarHBondContact O-N 2.97Å
170	S	80.4	Confident	79.1	Confident	56 Å²	56	68.4 Å²	68.4	39%	0.392	37%	0.368	S	S	.	.	H	α-helix	trans	-57.4	-42.7	175.4	54.9	0	0	0	0	111.8	Q168 I173 I174	Q168-S170 PolarHBondContact O-N 3.19Å; S170-I173 PolarHBondContact O-N 3.21Å; S170-I174 WeakPolarHBondContact O-CB 3.49Å; S170-I174 WeakPolarHBondContact O-CD1 3.41Å; S170-I174 VanDerWaalsContact O-CG1 3.25Å; S170-I174 WeakPolarHBondContact O-CG1 3.34Å; S170-I174 PolarHBondContact O-N 3.37Å
171	S	81.8	Confident	77.7	Confident	36 Å²	36	69 Å²	69	25%	0.252	37%	0.37	S	S	.	.	H	α-helix	trans	-64.3	-39.4	177.2	-66.4	0	0	0	0	112.1	Q168 S169 H175	Q168-S171 WeakPolarHBondContact O-CB 3.4Å; Q168-S171 PolarHBondContact O-N 3.01Å; S169-S171 VanDerWaalsContact C-N 3.29Å; S169-S171 PolarHBondContact O-N 3.21Å; S171-H175 VanDerWaalsContact O-CB 3.26Å; S171-H175 WeakPolarHBondContact O-CB 3.28Å; S171-H175 PolarHBondContact O-N 3.22Å
172	L	83.4	Confident	76.6	Confident	13 Å²	13	68.7 Å²	68.7	7%	0.068	37%	0.371	C	S	.	.	H	α-helix	trans	-65.9	-43.8	173.5	174.7	64	0	0	0	111.8	T158 C159 F166 Q168 S169 I174 H175 R176	T158-L172 WeakPolarHBondContact O-CD2 3.34Å; C159-L172 HydrophobicContact CB-CD1 3.66Å; F166-L172 HydrophobicContact CB-CB 4.4Å; F166-L172 HydrophobicContact CD2-CB 3.9Å; F166-L172 HydrophobicContact CD2-CD1 3.77Å; F166-L172 HydrophobicContact CD2-CG 4.45Å; F166-L172 HydrophobicContact CE2-CD1 3.94Å; F166-L172 HydrophobicContact CG-CB 4.34Å; Q168-L172 PolarHBondContact O-N 2.91Å; S169-L172 PolarHBondContact O-N 2.94Å; S169-L172 VanDerWaalsContact O-N 3.17Å; L172-I174 VanDerWaalsContact C-N 3.31Å; L172-I174 PolarHBondContact O-N 3.28Å; L172-H175 PolarHBondContact O-N 2.93Å; L172-R176 HydrophobicContact CD1-CG 4.21Å; L172-R176 HydrophobicContact CG-CG 4.46Å; L172-R176 WeakPolarHBondContact O-CG 3.39Å; L172-R176 PolarHBondContact O-N 3.42Å
173	I	80	Confident	75.4	Confident	104 Å²	104	71.5 Å²	71.5	53%	0.533	38%	0.377	S	S	.	.	H	α-helix	trans	-59.1	-46.2	177.1	-68.9	166	0	0	0	110.2	S169 S170 R176 S177	S169-I173 WeakPolarHBondContact O-CG1 3.36Å; S169-I173 PolarHBondContact O-N 2.97Å; S170-I173 PolarHBondContact O-N 3.21Å; I173-R176 PolarHBondContact O-N 3.04Å; I173-S177 PolarHBondContact O-N 3.31Å
174	I	73.6	Confident	74.7	Confident	43 Å²	43	72.5 Å²	72.5	22%	0.221	37%	0.368	C	S	.	.	H	α-helix	trans	-60.7	-46	175.1	-72.8	161.1	0	0	0	110.7	S170 L172 R176 S177 T195	S170-I174 WeakPolarHBondContact O-CB 3.49Å; S170-I174 WeakPolarHBondContact O-CD1 3.41Å; S170-I174 VanDerWaalsContact O-CG1 3.25Å; S170-I174 WeakPolarHBondContact O-CG1 3.34Å; S170-I174 PolarHBondContact O-N 3.37Å; L172-I174 VanDerWaalsContact C-N 3.31Å; L172-I174 PolarHBondContact O-N 3.28Å; I174-R176 VanDerWaalsContact C-N 3.32Å; I174-R176 PolarHBondContact O-N 2.75Å; I174-S177 WeakPolarHBondContact O-CB 3.5Å; I174-S177 PolarHBondContact O-N 3.5Å; I174-S177 VanDerWaalsContact O-N 3.14Å; I174-S177 PolarHBondContact O-OG 3.42Å; I174-T195 HydrophobicContact CG2-CG2 3.14Å
175	H	79.1	Confident	74.3	Confident	19 Å²	19	70.9 Å²	70.9	9%	0.088	36%	0.359	C	S	.	.	H	α-helix	trans	-63	-37.9	178.8	176.2	70.6	0	0	0	112.7	C162 F166 S171 L172 S177 I178 H179	C162-H175 PolarHBondContact SG-NE2 3.17Å; F166-H175 HydrophobicContact CE1-CB 3.99Å; F166-H175 HydrophobicContact CE2-CB 3.71Å; F166-H175 AromaticContact CE2-CD2 3.45Å; F166-H175 VanDerWaalsContact CE2-CD2 3.45Å; F166-H175 WeakPolarHBondContact CE2-CD2 3.48Å; F166-H175 AromaticContact CE2-CG 3.54Å; F166-H175 HydrophobicContact CZ-CB 3.38Å; F166-H175 AromaticContact CZ-CD2 3.53Å; F166-H175 AromaticContact CZ-CG 3.17Å; F166-H175 AromaticContact CZ-ND1 3.57Å; S171-H175 VanDerWaalsContact O-CB 3.26Å; S171-H175 WeakPolarHBondContact O-CB 3.28Å; S171-H175 PolarHBondContact O-N 3.22Å; L172-H175 PolarHBondContact O-N 2.93Å; H175-S177 PolarHBondContact O-N 3.41Å; H175-I178 VanDerWaalsContact O-CB 3.27Å; H175-I178 WeakPolarHBondContact O-CB 3.41Å; H175-I178 WeakPolarHBondContact O-CG1 3.47Å; H175-I178 PolarHBondContact O-N 3.31Å; H175-H179 AromaticContact CD2-NE2 3.7Å; H175-H179 AromaticContact CE1-NE2 3.57Å; H175-H179 AromaticContact NE2-CD2 3.74Å; H175-H179 AromaticContact NE2-CE1 3.96Å; H175-H179 AromaticContact NE2-NE2 2.96Å; H175-H179 PolarHBondContact NE2-NE2 2.85Å
176	R	76.3	Confident	73.9	Confident	109 Å²	109	74.4 Å²	74.4	41%	0.411	37%	0.368	S	S	.	.	H	α-helix	trans	-58.3	-30.4	175.8	-76.5	176.3	178.6	-159.4	-3.9	111.9	L172 I173 I174 I178 H179 S180	L172-R176 HydrophobicContact CD1-CG 4.21Å; L172-R176 HydrophobicContact CG-CG 4.46Å; L172-R176 WeakPolarHBondContact O-CG 3.39Å; L172-R176 PolarHBondContact O-N 3.42Å; I173-R176 PolarHBondContact O-N 3.04Å; I174-R176 VanDerWaalsContact C-N 3.32Å; I174-R176 PolarHBondContact O-N 2.75Å; R176-I178 PolarHBondContact O-N 3.22Å; R176-I178 VanDerWaalsContact O-N 3.15Å; R176-H179 PolarHBondContact O-N 2.76Å; R176-S180 PolarHBondContact O-N 2.86Å; R176-S180 PolarHBondContact O-OG 3.1Å; R176-S180 VanDerWaalsContact O-OG 3.09Å
177	S	70.9	Confident	73.9	Confident	15 Å²	15	72.5 Å²	72.5	11%	0.105	36%	0.36	C	S	.	.	H	α-helix	trans	-66.1	-9.5	174	78.4	0	0	0	0	115	I173 I174 H175	I173-S177 PolarHBondContact O-N 3.31Å; I174-S177 WeakPolarHBondContact O-CB 3.5Å; I174-S177 PolarHBondContact O-N 3.5Å; I174-S177 VanDerWaalsContact O-N 3.14Å; I174-S177 PolarHBondContact O-OG 3.42Å; H175-S177 PolarHBondContact O-N 3.41Å
178	I	70.4	Confident	73.9	Confident	117 Å²	117	78.3 Å²	78.3	60%	0.6	39%	0.385	S	S	*	.	H	α-helix	trans	-80.4	-32.2	170.9	-56.1	174.9	0	0	0	110.3	H175 R176	H175-I178 VanDerWaalsContact O-CB 3.27Å; H175-I178 WeakPolarHBondContact O-CB 3.41Å; H175-I178 WeakPolarHBondContact O-CG1 3.47Å; H175-I178 PolarHBondContact O-N 3.31Å; R176-I178 PolarHBondContact O-N 3.22Å; R176-I178 VanDerWaalsContact O-N 3.15Å
179	H	70.1	Confident	74	Confident	62 Å²	62	81.1 Å²	81.1	29%	0.287	40%	0.399	S	S	.	.	H	α-helix	trans	-92.2	-9.3	-177.7	-59	-61.2	0	0	0	114.1	C159 K161 C162 H175 R176	C159-H179 VanDerWaalsContact SG-CD2 3.51Å; K161-H179 HydrophobicContact CD-CB 3.63Å; K161-H179 PolarHBondContact NZ-O 3.15Å; K161-H179 VanDerWaalsContact NZ-O 3.17Å; C162-H179 PolarHBondContact SG-NE2 3.04Å; H175-H179 AromaticContact CD2-NE2 3.7Å; H175-H179 AromaticContact CE1-NE2 3.57Å; H175-H179 AromaticContact NE2-CD2 3.74Å; H175-H179 AromaticContact NE2-CE1 3.96Å; H175-H179 AromaticContact NE2-NE2 2.96Å; H175-H179 PolarHBondContact NE2-NE2 2.85Å; R176-H179 PolarHBondContact O-N 2.76Å
180	S	64.3	Low	74.1	Confident	44 Å²	44	81.2 Å²	81.2	31%	0.308	40%	0.398	S	S	.	.	S	Bend	trans	-117.6	136.4	174.1	51.4	0	0	0	0	107.9	R176 Q182	R176-S180 PolarHBondContact O-N 2.86Å; R176-S180 PolarHBondContact O-OG 3.1Å; R176-S180 VanDerWaalsContact O-OG 3.09Å; S180-Q182 PolarHBondContact O-N 3.16Å
181	E	56.3	Low	74	Confident	186 Å²	186	81 Å²	81	87%	0.869	41%	0.405	S	S	*	.	S	Bend	trans	-63.4	-0.3	170.9	-60.7	-170.2	162.4	0	0	113.1	K183	E181-K183 PolarHBondContact O-N 3.08Å
182	Q	57.8	Low	73.8	Confident	148 Å²	148	85.6 Å²	85.6	69%	0.692	42%	0.421	S	S	*	.			trans	-66.9	65.7	164.3	-66.7	-84	-26.5	0	0	110.4	S180 L184	S180-Q182 PolarHBondContact O-N 3.16Å; Q182-L184 PolarHBondContact O-N 3.08Å; Q182-L184 VanDerWaalsContact O-N 3.09Å
183	K	57.1	Low	73.5	Confident	115 Å²	115	86.3 Å²	86.3	50%	0.5	43%	0.429	S	S	.	.			trans	-56.5	104.7	161	-86.3	157.7	161	-172.5	0	108.6	E181 Y185 K186 A193	E181-K183 PolarHBondContact O-N 3.08Å; K183-Y185 PolarHBondContact O-N 3.04Å; K183-Y185 VanDerWaalsContact O-N 3.17Å; K183-K186 HydrophobicContact CB-CD 4.49Å; K183-K186 HydrophobicContact CB-CG 3.99Å; K183-A193 HydrophobicContact CB-CB 3.41Å; K183-A193 VanDerWaalsContact CB-CB 3.41Å; K183-A193 HydrophobicContact CD-CB 3.17Å; K183-A193 HydrophobicContact CG-CB 3.24Å
184	L	67.8	Low	73.3	Confident	80 Å²	80	83.6 Å²	83.6	42%	0.419	41%	0.413	S	S	.	.	S	Bend	trans	-57.6	-32.1	-171.4	-68.6	168.1	0	0	0	113.9	Q182	Q182-L184 PolarHBondContact O-N 3.08Å; Q182-L184 VanDerWaalsContact O-N 3.09Å
185	Y	74.8	Confident	73.3	Confident	96 Å²	96	84.3 Å²	84.3	38%	0.376	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	93.5	-175.9	-56.1	-73.6	0	0	0	110.7	K183 A193 F194 S197	K183-Y185 PolarHBondContact O-N 3.04Å; K183-Y185 VanDerWaalsContact O-N 3.17Å; Y185-A193 WeakPolarHBondContact O-CA 2.83Å; Y185-F194 PolarHBondContact N-O 3.24Å; Y185-F194 PolarHBondContact O-N 3.07Å; Y185-S197 VanDerWaalsContact CD2-N 3.26Å
186	K	77.8	Confident	73.1	Confident	109 Å²	109	90.1 Å²	90.1	47%	0.474	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	147.2	176.6	-64.2	-178	-178	178.1	0	111.1	K183 A193 L200	K183-K186 HydrophobicContact CB-CD 4.49Å; K183-K186 HydrophobicContact CB-CG 3.99Å; K186-A193 HydrophobicContact CG-CB 4.15Å; K186-L200 WeakPolarHBondContact O-CD2 3.47Å
187	C	83.8	Confident	73.3	Confident	1 Å²	1	87.6 Å²	87.6	1%	0.007	44%	0.44	C	S	.	.			trans	-92.9	115.5	169.8	178.5	0	0	0	0	108.5	E189 C190 G191 K192 F194 L200 H207	C187-E189 VanDerWaalsContact C-N 3.26Å; C187-E189 PolarHBondContact O-N 3.29Å; C187-C190 PolarHBondContact O-N 3.28Å; C187-C190 VanDerWaalsContact SG-SG 3.64Å; C187-G191 VanDerWaalsContact O-CA 3.24Å; C187-G191 WeakPolarHBondContact O-CA 3.26Å; C187-G191 PolarHBondContact O-N 3.34Å; C187-K192 VanDerWaalsContact CB-O 3.26Å; C187-K192 WeakPolarHBondContact CB-O 3.38Å; C187-K192 PolarHBondContact N-O 3.15Å; C187-F194 HydrophobicContact CB-CE2 4.46Å; C187-L200 HydrophobicContact CB-CD1 3.58Å; C187-H207 PolarHBondContact SG-NE2 3.16Å
188	E	82.9	Confident	73.8	Confident	168 Å²	168	89.7 Å²	89.7	79%	0.785	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-33.6	-178.6	-58.4	-51.5	132.9	0	0	112.9	C190	E188-C190 PolarHBondContact O-N 3.3Å
189	E	84.2	Confident	74.5	Confident	127 Å²	127	85.8 Å²	85.8	59%	0.593	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-24.9	-174.5	-65.9	171.9	-137	0	0	114.5	C187 H207	C187-E189 VanDerWaalsContact C-N 3.26Å; C187-E189 PolarHBondContact O-N 3.29Å; E189-H207 WeakPolarHBondContact OE2-CB 3.45Å; E189-H207 IonicContact OE2-CD2 3.13Å; E189-H207 PolarHBondContact OE2-CD2 3.36Å; E189-H207 IonicContact OE2-CG 3.6Å
190	C	83.8	Confident	75.3	Confident	57 Å²	57	83.5 Å²	83.5	39%	0.385	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.9	6.3	-177	72.5	0	0	0	0	114.5	C187 E188 K192 H203 H207	C187-C190 PolarHBondContact O-N 3.28Å; C187-C190 VanDerWaalsContact SG-SG 3.64Å; E188-C190 PolarHBondContact O-N 3.3Å; C190-K192 PolarHBondContact O-N 3.21Å; C190-H203 PolarHBondContact SG-NE2 3.43Å; C190-H207 PolarHBondContact SG-NE2 3.31Å; C190-H207 VanDerWaalsContact SG-NE2 3.41Å
191	G	78.3	Confident	76.2	Confident	52 Å²	52	86 Å²	86	54%	0.536	44%	0.437	S	S	.	.			trans	65.6	-2.7	-178.9	0	0	0	0	0	115.5	C187	C187-G191 VanDerWaalsContact O-CA 3.24Å; C187-G191 WeakPolarHBondContact O-CA 3.26Å; C187-G191 PolarHBondContact O-N 3.34Å
192	K	76.5	Confident	77.6	Confident	132 Å²	132	82.2 Å²	82.2	57%	0.574	42%	0.418	S	S	*	.			trans	-66.1	140.6	178.9	-77.5	-175.6	179.3	174.3	0	110.6	C187 C190 F194	C187-K192 VanDerWaalsContact CB-O 3.26Å; C187-K192 WeakPolarHBondContact CB-O 3.38Å; C187-K192 PolarHBondContact N-O 3.15Å; C190-K192 PolarHBondContact O-N 3.21Å; K192-F194 HydrophobicContact CB-CE2 4.03Å; K192-F194 HydrophobicContact CB-CZ 4.18Å
193	A	77.5	Confident	79	Confident	29 Å²	29	75.8 Å²	75.8	24%	0.24	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	149.8	-176.5	0	0	0	0	0	113.1	K183 Y185 K186	K183-A193 HydrophobicContact CB-CB 3.41Å; K183-A193 VanDerWaalsContact CB-CB 3.41Å; K183-A193 HydrophobicContact CD-CB 3.17Å; K183-A193 HydrophobicContact CG-CB 3.24Å; Y185-A193 WeakPolarHBondContact O-CA 2.83Å; K186-A193 HydrophobicContact CG-CB 4.15Å
194	F	76.8	Confident	80.4	Confident	46 Å²	46	74.3 Å²	74.3	20%	0.202	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	145.7	-175	-58.4	-88.7	0	0	0	110.6	Y185 C187 K192 W196 L200 H203	Y185-F194 PolarHBondContact N-O 3.24Å; Y185-F194 PolarHBondContact O-N 3.07Å; C187-F194 HydrophobicContact CB-CE2 4.46Å; K192-F194 HydrophobicContact CB-CE2 4.03Å; K192-F194 HydrophobicContact CB-CZ 4.18Å; F194-W196 VanDerWaalsContact C-N 3.27Å; F194-W196 PolarHBondContact O-N 3.43Å; F194-L200 HydrophobicContact CB-CB 4.16Å; F194-L200 HydrophobicContact CD2-CB 3.81Å; F194-L200 HydrophobicContact CD2-CD1 3.64Å; F194-L200 HydrophobicContact CD2-CG 4.33Å; F194-L200 HydrophobicContact CE2-CD1 3.88Å; F194-L200 HydrophobicContact CG-CB 4.15Å; F194-H203 HydrophobicContact CE1-CB 3.84Å; F194-H203 HydrophobicContact CE2-CB 3.74Å; F194-H203 AromaticContact CE2-CD2 3.35Å; F194-H203 WeakPolarHBondContact CE2-CD2 3.49Å; F194-H203 AromaticContact CE2-CG 3.52Å; F194-H203 HydrophobicContact CZ-CB 3.32Å; F194-H203 AromaticContact CZ-CD2 3.47Å; F194-H203 VanDerWaalsContact CZ-CD2 3.47Å; F194-H203 WeakPolarHBondContact CZ-CD2 3.49Å; F194-H203 AromaticContact CZ-CG 3.15Å; F194-H203 AromaticContact CZ-ND1 3.62Å
195	T	72.5	Confident	81.2	Confident	59 Å²	59	73.7 Å²	73.7	36%	0.362	37%	0.373	S	S	.	.	S	Bend	trans	-70.8	-25.6	175.8	-49.8	0	0	0	0	112.2	I174	I174-T195 HydrophobicContact CG2-CG2 3.14Å
196	W	75.9	Confident	81.7	Confident	141 Å²	141	73.5 Å²	73.5	53%	0.534	38%	0.378	S	S	.	.	S	Bend	trans	-131	140.2	-178.9	-61.1	-48.3	0	0	0	111.9	F194 S198 S199 L200	F194-W196 VanDerWaalsContact C-N 3.27Å; F194-W196 PolarHBondContact O-N 3.43Å; W196-S198 VanDerWaalsContact C-N 3.26Å; W196-S198 PolarHBondContact O-N 3.24Å; W196-S199 WeakPolarHBondContact O-CB 3.37Å; W196-S199 PolarHBondContact O-N 2.78Å; W196-L200 PolarHBondContact O-N 3.1Å; W196-L200 VanDerWaalsContact O-N 3.1Å
197	S	79.7	Confident	81.9	Confident	55 Å²	55	71.6 Å²	71.6	39%	0.385	37%	0.371	S	S	.	.	H	α-helix	trans	-57.7	-38	174.6	60.4	0	0	0	0	112.6	Y185 S199 L200 N201	Y185-S197 VanDerWaalsContact CD2-N 3.26Å; S197-S199 PolarHBondContact O-N 3.27Å; S197-L200 PolarHBondContact O-N 3.05Å; S197-N201 PolarHBondContact O-N 2.8Å
198	S	82.7	Confident	81.9	Confident	59 Å²	59	75.4 Å²	75.4	41%	0.413	39%	0.394	S	S	.	.	H	α-helix	trans	-62.5	-31	175.8	64.9	0	0	0	0	112.8	W196 K202	W196-S198 VanDerWaalsContact C-N 3.26Å; W196-S198 PolarHBondContact O-N 3.24Å; S198-K202 VanDerWaalsContact O-CG 3.26Å; S198-K202 WeakPolarHBondContact O-CG 3.35Å; S198-K202 PolarHBondContact O-N 3.17Å; S198-K202 VanDerWaalsContact O-N 3.16Å
199	S	84.4	Confident	81.9	Confident	35 Å²	35	69.5 Å²	69.5	25%	0.245	38%	0.378	C	S	.	.	H	α-helix	trans	-77.4	-40.1	176.6	-62.4	0	0	0	0	111.2	W196 S197 K202 H203	W196-S199 WeakPolarHBondContact O-CB 3.37Å; W196-S199 PolarHBondContact O-N 2.78Å; S197-S199 PolarHBondContact O-N 3.27Å; S199-K202 PolarHBondContact O-N 3.38Å; S199-H203 WeakPolarHBondContact O-CB 2.81Å; S199-H203 PolarHBondContact O-N 3.43Å
200	L	85.5	Confident	81.8	Confident	14 Å²	14	68.9 Å²	68.9	7%	0.073	38%	0.375	C	S	.	.	H	α-helix	trans	-59.2	-47.4	170.8	174.5	62.6	0	0	0	111.2	K186 C187 F194 W196 S197 K202 H203 K204	K186-L200 WeakPolarHBondContact O-CD2 3.47Å; C187-L200 HydrophobicContact CB-CD1 3.58Å; F194-L200 HydrophobicContact CB-CB 4.16Å; F194-L200 HydrophobicContact CD2-CB 3.81Å; F194-L200 HydrophobicContact CD2-CD1 3.64Å; F194-L200 HydrophobicContact CD2-CG 4.33Å; F194-L200 HydrophobicContact CE2-CD1 3.88Å; F194-L200 HydrophobicContact CG-CB 4.15Å; W196-L200 PolarHBondContact O-N 3.1Å; W196-L200 VanDerWaalsContact O-N 3.1Å; S197-L200 PolarHBondContact O-N 3.05Å; L200-K202 VanDerWaalsContact C-N 3.33Å; L200-K202 PolarHBondContact O-N 3.4Å; L200-H203 CarbonylContact O-C 3.32Å; L200-H203 WeakPolarHBondContact O-CA 3.46Å; L200-H203 WeakPolarHBondContact O-CB 3.37Å; L200-H203 PolarHBondContact O-N 2.76Å; L200-K204 HydrophobicContact CD1-CG 4.26Å; L200-K204 HydrophobicContact CG-CG 4.47Å; L200-K204 WeakPolarHBondContact O-CG 3.27Å; L200-K204 PolarHBondContact O-N 2.8Å
201	N	85	Confident	82	Confident	98 Å²	98	72 Å²	72	52%	0.524	38%	0.382	S	S	.	.	H	α-helix	trans	-61.3	-40	178.4	-79.3	-5.2	0	0	0	112.4	S197 H203 K204	S197-N201 PolarHBondContact O-N 2.8Å; N201-H203 VanDerWaalsContact C-N 3.27Å; N201-H203 PolarHBondContact O-N 3.31Å; N201-K204 PolarHBondContact O-N 3.15Å
202	K	85.4	Confident	82.5	Confident	105 Å²	105	72.9 Å²	72.9	46%	0.457	38%	0.378	S	S	.	.	H	α-helix	trans	-65.5	-31.7	172.9	-73	170.8	-172.8	176.2	0	112.5	S198 S199 L200	S198-K202 VanDerWaalsContact O-CG 3.26Å; S198-K202 WeakPolarHBondContact O-CG 3.35Å; S198-K202 PolarHBondContact O-N 3.17Å; S198-K202 VanDerWaalsContact O-N 3.16Å; S199-K202 PolarHBondContact O-N 3.38Å; L200-K202 VanDerWaalsContact C-N 3.33Å; L200-K202 PolarHBondContact O-N 3.4Å
203	H	86.9	Confident	83.2	Confident	14 Å²	14	70.2 Å²	70.2	7%	0.065	37%	0.365	C	S	.	.	H	α-helix	trans	-74.2	-40.9	177.3	168.3	71.1	0	0	0	112.3	C190 F194 S199 L200 N201 R205 I206 H207	C190-H203 PolarHBondContact SG-NE2 3.43Å; F194-H203 HydrophobicContact CE1-CB 3.84Å; F194-H203 HydrophobicContact CE2-CB 3.74Å; F194-H203 AromaticContact CE2-CD2 3.35Å; F194-H203 WeakPolarHBondContact CE2-CD2 3.49Å; F194-H203 AromaticContact CE2-CG 3.52Å; F194-H203 HydrophobicContact CZ-CB 3.32Å; F194-H203 AromaticContact CZ-CD2 3.47Å; F194-H203 VanDerWaalsContact CZ-CD2 3.47Å; F194-H203 WeakPolarHBondContact CZ-CD2 3.49Å; F194-H203 AromaticContact CZ-CG 3.15Å; F194-H203 AromaticContact CZ-ND1 3.62Å; S199-H203 WeakPolarHBondContact O-CB 2.81Å; S199-H203 PolarHBondContact O-N 3.43Å; L200-H203 CarbonylContact O-C 3.32Å; L200-H203 WeakPolarHBondContact O-CA 3.46Å; L200-H203 WeakPolarHBondContact O-CB 3.37Å; L200-H203 PolarHBondContact O-N 2.76Å; N201-H203 VanDerWaalsContact C-N 3.27Å; N201-H203 PolarHBondContact O-N 3.31Å; H203-R205 PolarHBondContact O-N 3.14Å; H203-R205 VanDerWaalsContact O-N 3.08Å; H203-I206 VanDerWaalsContact O-CB 3.24Å; H203-I206 WeakPolarHBondContact O-CB 3.43Å; H203-I206 WeakPolarHBondContact O-CG1 3.39Å; H203-I206 PolarHBondContact O-N 2.78Å; H203-H207 AromaticContact CD2-NE2 3.99Å; H203-H207 AromaticContact CE1-NE2 3.75Å; H203-H207 AromaticContact NE2-CE1 3.91Å; H203-H207 AromaticContact NE2-NE2 3.21Å; H203-H207 PolarHBondContact NE2-NE2 3.26Å
204	K	85.3	Confident	83.8	Confident	83 Å²	83	72.9 Å²	72.9	36%	0.361	38%	0.379	S	S	.	.	H	α-helix	trans	-53.8	-30.4	178	-75.4	-173.5	171.7	-167.2	0	113.2	L200 N201 I206 H207 T208	L200-K204 HydrophobicContact CD1-CG 4.26Å; L200-K204 HydrophobicContact CG-CG 4.47Å; L200-K204 WeakPolarHBondContact O-CG 3.27Å; L200-K204 PolarHBondContact O-N 2.8Å; N201-K204 PolarHBondContact O-N 3.15Å; K204-I206 PolarHBondContact O-N 3.16Å; K204-I206 VanDerWaalsContact O-N 3.09Å; K204-H207 PolarHBondContact O-N 2.9Å; K204-T208 PolarHBondContact O-N 3.2Å; K204-T208 VanDerWaalsContact O-N 3.15Å
205	R	86.6	Confident	84.6	Confident	67 Å²	67	70.8 Å²	70.8	25%	0.253	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-22.1	173.3	-62.8	-179.6	-177.4	-174.6	-4.8	114.6	H203 H207 T208 G209 E210 Y223	H203-R205 PolarHBondContact O-N 3.14Å; H203-R205 VanDerWaalsContact O-N 3.08Å; R205-H207 VanDerWaalsContact C-N 3.32Å; R205-T208 WeakPolarHBondContact CA-OG1 3.38Å; R205-G209 PolarHBondContact O-N 2.99Å; R205-E210 PolarHBondContact O-N 3.3Å; R205-Y223 PolarHBondContact NH1-O 3.25Å
206	I	83.4	Confident	85.5	Confident	93 Å²	93	76.4 Å²	76.4	48%	0.477	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-36.5	176.5	-65.3	169.2	0	0	0	110.1	H203 K204	H203-I206 VanDerWaalsContact O-CB 3.24Å; H203-I206 WeakPolarHBondContact O-CB 3.43Å; H203-I206 WeakPolarHBondContact O-CG1 3.39Å; H203-I206 PolarHBondContact O-N 2.78Å; K204-I206 PolarHBondContact O-N 3.16Å; K204-I206 VanDerWaalsContact O-N 3.09Å
207	H	83.7	Confident	86.1	Confident	68 Å²	68	75.5 Å²	75.5	32%	0.315	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-39	-177.3	-49.8	-53.5	0	0	0	112.6	C187 E189 C190 H203 K204 R205 G209	C187-H207 PolarHBondContact SG-NE2 3.16Å; E189-H207 WeakPolarHBondContact OE2-CB 3.45Å; E189-H207 IonicContact OE2-CD2 3.13Å; E189-H207 PolarHBondContact OE2-CD2 3.36Å; E189-H207 IonicContact OE2-CG 3.6Å; C190-H207 PolarHBondContact SG-NE2 3.31Å; C190-H207 VanDerWaalsContact SG-NE2 3.41Å; H203-H207 AromaticContact CD2-NE2 3.99Å; H203-H207 AromaticContact CE1-NE2 3.75Å; H203-H207 AromaticContact NE2-CE1 3.91Å; H203-H207 AromaticContact NE2-NE2 3.21Å; H203-H207 PolarHBondContact NE2-NE2 3.26Å; K204-H207 PolarHBondContact O-N 2.9Å; R205-H207 VanDerWaalsContact C-N 3.32Å; H207-G209 PolarHBondContact O-N 3.42Å
208	T	82.9	Confident	86.6	Confident	82 Å²	82	75.4 Å²	75.4	50%	0.503	39%	0.393	S	S	.	.	S	Bend	trans	-69.7	-13.6	174.6	63.2	0	0	0	0	112.8	K204 R205 E210	K204-T208 PolarHBondContact O-N 3.2Å; K204-T208 VanDerWaalsContact O-N 3.15Å; R205-T208 WeakPolarHBondContact CA-OG1 3.38Å; T208-E210 PolarHBondContact O-N 2.84Å; T208-E210 VanDerWaalsContact O-N 3.09Å; T208-E210 WeakPolarHBondContact OG1-CG 3.48Å; T208-E210 PolarHBondContact OG1-N 2.98Å
209	G	82.1	Confident	86.9	Confident	43 Å²	43	75.3 Å²	75.3	44%	0.443	40%	0.401	S	S	.	.			trans	68.1	2.7	-174.8	0	0	0	0	0	114	R205 H207 K211	R205-G209 PolarHBondContact O-N 2.99Å; H207-G209 PolarHBondContact O-N 3.42Å; G209-K211 PolarHBondContact O-N 2.86Å
210	E	83.6	Confident	87.2	Confident	115 Å²	115	79.8 Å²	79.8	54%	0.537	42%	0.416	S	S	.	.			trans	-59.3	123	179.9	-76.6	-176.4	173.9	0	0	110.9	R205 T208 P212	R205-E210 PolarHBondContact O-N 3.3Å; T208-E210 PolarHBondContact O-N 2.84Å; T208-E210 VanDerWaalsContact O-N 3.09Å; T208-E210 WeakPolarHBondContact OG1-CG 3.48Å; T208-E210 PolarHBondContact OG1-N 2.98Å; E210-P212 WeakPolarHBondContact O-CD 3.26Å
211	K	87.9	Confident	87.4	Confident	121 Å²	121	80.8 Å²	80.8	53%	0.526	43%	0.426	S	S	.	.			trans	-123.1	77.6	177.6	-71	165.5	-178.9	179.2	0	109.7	G209 Y213 A221 F222	G209-K211 PolarHBondContact O-N 2.86Å; K211-Y213 PolarHBondContact O-N 3.37Å; K211-A221 HydrophobicContact CB-CB 3.45Å; K211-A221 VanDerWaalsContact CB-CB 3.45Å; K211-A221 HydrophobicContact CD-CB 3.96Å; K211-A221 WeakPolarHBondContact CD-O 3.35Å; K211-A221 HydrophobicContact CG-CB 4.31Å; K211-F222 CarbonylContact C-O 3.54Å; K211-F222 VanDerWaalsContact C-O 3.24Å; K211-F222 VanDerWaalsContact CA-O 3.3Å; K211-F222 WeakPolarHBondContact CA-O 3.5Å
212	P	88.4	Confident	87.6	Confident	71 Å²	71	78 Å²	78	46%	0.461	41%	0.41	S	S	.	.			trans	-66.8	-10.3	-172.1	-20.6	33.5	0	0	0	114.6	E210	E210-P212 WeakPolarHBondContact O-CD 3.26Å
213	Y	91.3	Very high	87.7	Confident	76 Å²	76	76.9 Å²	76.9	30%	0.298	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	95.1	-173.3	-53.5	-75.6	0	0	0	109.8	K211 A221 F222 S225	K211-Y213 PolarHBondContact O-N 3.37Å; Y213-A221 CarbonylContact O-C 3.52Å; Y213-A221 WeakPolarHBondContact O-CA 3.02Å; Y213-F222 WeakPolarHBondContact CB-O 3.49Å; Y213-F222 WeakPolarHBondContact CD2-O 3.35Å; Y213-F222 PolarHBondContact N-O 3.41Å; Y213-F222 VanDerWaalsContact N-O 3.11Å; Y213-F222 PolarHBondContact O-N 3.24Å; Y213-S225 VanDerWaalsContact CD2-N 3.28Å; Y213-S225 VanDerWaalsContact CE2-N 3.31Å
214	T	89.9	Confident	87.7	Confident	86 Å²	86	81 Å²	81	53%	0.528	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	142.6	178.4	45.4	0	0	0	0	111.5	A221 L228	T214-A221 HydrophobicContact CG2-CB 3.79Å; T214-L228 WeakPolarHBondContact O-CD2 3.44Å
215	C	92.9	Very high	87.9	Confident	1 Å²	1	80.3 Å²	80.3	1%	0.007	42%	0.424	C	S	.	.			trans	-87.2	119.3	167.7	-179.6	0	0	0	0	108.7	E217 C218 G219 K220 L228	C215-E217 VanDerWaalsContact C-N 3.27Å; C215-E217 PolarHBondContact O-N 3.35Å; C215-C218 VanDerWaalsContact SG-SG 3.7Å; C215-G219 WeakPolarHBondContact O-CA 3.43Å; C215-G219 PolarHBondContact O-N 2.95Å; C215-K220 WeakPolarHBondContact CB-O 3.47Å; C215-K220 PolarHBondContact N-O 2.94Å; C215-L228 HydrophobicContact CB-CD1 3.65Å
216	E	91.5	Very high	88	Confident	177 Å²	177	79.9 Å²	79.9	83%	0.827	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-29.6	-179.6	-67.3	171	173.9	0	0	112.4
217	E	89.1	Confident	88.3	Confident	123 Å²	123	77.8 Å²	77.8	58%	0.575	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-27.8	-175.9	-63.2	177	-138.3	0	0	114.2	C215 H235	C215-E217 VanDerWaalsContact C-N 3.27Å; C215-E217 PolarHBondContact O-N 3.35Å; E217-H235 WeakPolarHBondContact OE2-CB 3.25Å; E217-H235 IonicContact OE2-CD2 3.07Å; E217-H235 IonicContact OE2-CG 3.86Å; E217-H235 IonicContact OE2-ND1 2.93Å
218	C	90.5	Very high	88.7	Confident	53 Å²	53	75.6 Å²	75.6	36%	0.358	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135.4	7.5	-178.7	71	0	0	0	0	115	C215 K220 H231 H235	C215-C218 VanDerWaalsContact SG-SG 3.7Å; C218-K220 PolarHBondContact O-N 3.21Å; C218-H231 PolarHBondContact SG-NE2 3.42Å; C218-H235 PolarHBondContact SG-NE2 2.83Å; C218-H235 VanDerWaalsContact SG-NE2 3.4Å
219	G	88.6	Confident	89	Confident	57 Å²	57	74.4 Å²	74.4	59%	0.588	41%	0.408	S	S	*	.			trans	68.2	-3.1	-179.4	0	0	0	0	0	115.3	C215 A221	C215-G219 WeakPolarHBondContact O-CA 3.43Å; C215-G219 PolarHBondContact O-N 2.95Å; G219-A221 PolarHBondContact O-N 3.16Å
220	K	90.5	Very high	89.3	Confident	128 Å²	128	77.1 Å²	77.1	56%	0.557	41%	0.408	S	S	*	.			trans	-68.5	128.6	-176.9	-74.5	-177.1	-179	175.2	0	111.5	C215 C218 F222	C215-K220 WeakPolarHBondContact CB-O 3.47Å; C215-K220 PolarHBondContact N-O 2.94Å; C218-K220 PolarHBondContact O-N 3.21Å; K220-F222 HydrophobicContact CB-CE2 4.08Å; K220-F222 HydrophobicContact CB-CZ 4.24Å; K220-F222 WeakPolarHBondContact O-CE2 3.42Å
221	A	90.8	Very high	89.7	Confident	35 Å²	35	72.5 Å²	72.5	29%	0.289	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	145.2	-177.9	0	0	0	0	0	112.9	K211 Y213 T214 G219	K211-A221 HydrophobicContact CB-CB 3.45Å; K211-A221 VanDerWaalsContact CB-CB 3.45Å; K211-A221 HydrophobicContact CD-CB 3.96Å; K211-A221 WeakPolarHBondContact CD-O 3.35Å; K211-A221 HydrophobicContact CG-CB 4.31Å; Y213-A221 CarbonylContact O-C 3.52Å; Y213-A221 WeakPolarHBondContact O-CA 3.02Å; T214-A221 HydrophobicContact CG2-CB 3.79Å; G219-A221 PolarHBondContact O-N 3.16Å
222	F	89.1	Confident	89.8	Confident	41 Å²	41	70.8 Å²	70.8	18%	0.18	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	150.8	-178.3	-57.9	-89.9	0	0	0	111.6	K211 Y213 K220 H227 L228 H231	K211-F222 CarbonylContact C-O 3.54Å; K211-F222 VanDerWaalsContact C-O 3.24Å; K211-F222 VanDerWaalsContact CA-O 3.3Å; K211-F222 WeakPolarHBondContact CA-O 3.5Å; Y213-F222 WeakPolarHBondContact CB-O 3.49Å; Y213-F222 WeakPolarHBondContact CD2-O 3.35Å; Y213-F222 PolarHBondContact N-O 3.41Å; Y213-F222 VanDerWaalsContact N-O 3.11Å; Y213-F222 PolarHBondContact O-N 3.24Å; K220-F222 HydrophobicContact CB-CE2 4.08Å; K220-F222 HydrophobicContact CB-CZ 4.24Å; K220-F222 WeakPolarHBondContact O-CE2 3.42Å; F222-H227 HydrophobicContact CB-CB 4.21Å; F222-H227 HydrophobicContact CD1-CB 3.91Å; F222-H227 HydrophobicContact CG-CB 4.29Å; F222-L228 HydrophobicContact CB-CB 4.43Å; F222-L228 HydrophobicContact CD2-CB 3.92Å; F222-L228 HydrophobicContact CD2-CD1 3.83Å; F222-L228 HydrophobicContact CD2-CG 4.49Å; F222-L228 HydrophobicContact CE2-CD1 3.97Å; F222-L228 HydrophobicContact CG-CB 4.36Å; F222-H231 HydrophobicContact CE1-CB 4.04Å; F222-H231 HydrophobicContact CE2-CB 3.81Å; F222-H231 AromaticContact CE2-CD2 3.38Å; F222-H231 WeakPolarHBondContact CE2-CD2 3.33Å; F222-H231 AromaticContact CE2-CG 3.59Å; F222-H231 HydrophobicContact CZ-CB 3.42Å; F222-H231 VanDerWaalsContact CZ-CB 3.42Å; F222-H231 AromaticContact CZ-CD2 3.47Å; F222-H231 VanDerWaalsContact CZ-CD2 3.47Å; F222-H231 WeakPolarHBondContact CZ-CD2 3.49Å; F222-H231 AromaticContact CZ-CG 3.21Å; F222-H231 AromaticContact CZ-ND1 3.67Å; F222-H231 AromaticContact CZ-NE2 3.99Å
223	Y	87.4	Confident	89.9	Confident	80 Å²	80	70.2 Å²	70.2	31%	0.314	37%	0.367	S	S	.	.	S	Bend	trans	-83.6	-12.2	178.5	61.6	-86.3	0	0	0	113.7	R205 H227	R205-Y223 PolarHBondContact NH1-O 3.25Å; Y223-H227 AromaticContact CE1-ND1 3.65Å; Y223-H227 AromaticContact CE2-CE1 3.84Å; Y223-H227 AromaticContact CE2-ND1 3.92Å; Y223-H227 AromaticContact CZ-CE1 3.41Å; Y223-H227 VanDerWaalsContact CZ-CE1 3.41Å; Y223-H227 AromaticContact CZ-ND1 3.41Å; Y223-H227 PolarHBondContact OH-CE1 2.81Å
224	R	86	Confident	89.8	Confident	100 Å²	100	71.6 Å²	71.6	38%	0.377	38%	0.379	S	S	.	.	S	Bend	trans	-134.5	137.7	178.6	-74.3	173.5	-172.9	-179.1	4	111.2	S226 H227 L228	R224-S226 VanDerWaalsContact C-N 3.29Å; R224-S226 PolarHBondContact O-N 2.82Å; R224-H227 HydrophobicContact CB-CB 4.41Å; R224-H227 WeakPolarHBondContact O-CB 3.24Å; R224-H227 PolarHBondContact O-N 3.32Å; R224-H227 VanDerWaalsContact O-N 3.08Å; R224-L228 PolarHBondContact O-N 2.81Å
225	S	89	Confident	89.8	Confident	69 Å²	69	70.8 Å²	70.8	48%	0.483	37%	0.369	S	S	.	.	H	α-helix	trans	-60.1	-37.4	175.8	56.3	0	0	0	0	112.6	Y213 H227 L228 A229	Y213-S225 VanDerWaalsContact CD2-N 3.28Å; Y213-S225 VanDerWaalsContact CE2-N 3.31Å; S225-H227 PolarHBondContact O-N 3.5Å; S225-L228 WeakPolarHBondContact O-CB 3.34Å; S225-L228 PolarHBondContact O-N 3.47Å; S225-A229 PolarHBondContact O-N 3.32Å
226	S	88.6	Confident	89.5	Confident	59 Å²	59	75 Å²	75	41%	0.413	40%	0.395	S	S	.	.	H	α-helix	trans	-64.5	-26.4	177.1	62.7	0	0	0	0	113.3	R224 K230	R224-S226 VanDerWaalsContact C-N 3.29Å; R224-S226 PolarHBondContact O-N 2.82Å; S226-K230 WeakPolarHBondContact O-CG 3.39Å; S226-K230 PolarHBondContact O-N 2.88Å
227	H	90.1	Very high	89.3	Confident	48 Å²	48	68.8 Å²	68.8	22%	0.222	38%	0.378	C	S	.	.	H	α-helix	trans	-77.6	-40.6	174.8	-65.7	177.2	0	0	0	111	F222 Y223 R224 S225 A229 K230 H231	F222-H227 HydrophobicContact CB-CB 4.21Å; F222-H227 HydrophobicContact CD1-CB 3.91Å; F222-H227 HydrophobicContact CG-CB 4.29Å; Y223-H227 AromaticContact CE1-ND1 3.65Å; Y223-H227 AromaticContact CE2-CE1 3.84Å; Y223-H227 AromaticContact CE2-ND1 3.92Å; Y223-H227 AromaticContact CZ-CE1 3.41Å; Y223-H227 VanDerWaalsContact CZ-CE1 3.41Å; Y223-H227 AromaticContact CZ-ND1 3.41Å; Y223-H227 PolarHBondContact OH-CE1 2.81Å; R224-H227 HydrophobicContact CB-CB 4.41Å; R224-H227 WeakPolarHBondContact O-CB 3.24Å; R224-H227 PolarHBondContact O-N 3.32Å; R224-H227 VanDerWaalsContact O-N 3.08Å; S225-H227 PolarHBondContact O-N 3.5Å; H227-A229 VanDerWaalsContact C-N 3.35Å; H227-K230 PolarHBondContact O-N 3.09Å; H227-H231 WeakPolarHBondContact O-CB 3.2Å; H227-H231 PolarHBondContact O-N 3.39Å
228	L	91.9	Very high	89.3	Confident	23 Å²	23	67.7 Å²	67.7	12%	0.12	37%	0.373	C	S	.	.	H	α-helix	trans	-58.9	-45.9	170.9	175.4	61.8	0	0	0	111.2	T214 C215 F222 R224 S225 K230 H231 K232	T214-L228 WeakPolarHBondContact O-CD2 3.44Å; C215-L228 HydrophobicContact CB-CD1 3.65Å; F222-L228 HydrophobicContact CB-CB 4.43Å; F222-L228 HydrophobicContact CD2-CB 3.92Å; F222-L228 HydrophobicContact CD2-CD1 3.83Å; F222-L228 HydrophobicContact CD2-CG 4.49Å; F222-L228 HydrophobicContact CE2-CD1 3.97Å; F222-L228 HydrophobicContact CG-CB 4.36Å; R224-L228 PolarHBondContact O-N 2.81Å; S225-L228 WeakPolarHBondContact O-CB 3.34Å; S225-L228 PolarHBondContact O-N 3.47Å; L228-K230 PolarHBondContact O-N 2.87Å; L228-H231 CarbonylContact O-C 3.23Å; L228-H231 WeakPolarHBondContact O-CA 3.38Å; L228-H231 WeakPolarHBondContact O-CB 3.25Å; L228-H231 PolarHBondContact O-N 3.37Å; L228-K232 HydrophobicContact CD1-CG 4.26Å; L228-K232 WeakPolarHBondContact O-CG 3.38Å; L228-K232 PolarHBondContact O-N 3.07Å
229	A	88.9	Confident	89.3	Confident	57 Å²	57	71 Å²	71	47%	0.471	38%	0.381	S	S	.	.	H	α-helix	trans	-59.5	-43.7	178.2	0	0	0	0	0	112.4	S225 H227 H231 K232	S225-A229 PolarHBondContact O-N 3.32Å; H227-A229 VanDerWaalsContact C-N 3.35Å; A229-H231 VanDerWaalsContact C-N 3.3Å; A229-H231 PolarHBondContact O-N 3.42Å; A229-K232 PolarHBondContact O-N 2.89Å
230	K	89.8	Confident	89.4	Confident	99 Å²	99	70.9 Å²	70.9	43%	0.43	37%	0.37	S	S	.	.	H	α-helix	trans	-64.6	-35.4	173.9	-72.9	175.8	-176.8	-176.6	0	112.4	S226 H227 L228 R233	S226-K230 WeakPolarHBondContact O-CG 3.39Å; S226-K230 PolarHBondContact O-N 2.88Å; H227-K230 PolarHBondContact O-N 3.09Å; L228-K230 PolarHBondContact O-N 2.87Å; K230-R233 WeakPolarHBondContact O-CB 3.19Å
231	H	91.9	Very high	89.5	Confident	19 Å²	19	68.5 Å²	68.5	9%	0.088	36%	0.358	C	S	.	.	H	α-helix	trans	-69.7	-40.4	178.2	172.6	68	0	0	0	112.3	C218 F222 H227 L228 A229 R233 I234 H235	C218-H231 PolarHBondContact SG-NE2 3.42Å; F222-H231 HydrophobicContact CE1-CB 4.04Å; F222-H231 HydrophobicContact CE2-CB 3.81Å; F222-H231 AromaticContact CE2-CD2 3.38Å; F222-H231 WeakPolarHBondContact CE2-CD2 3.33Å; F222-H231 AromaticContact CE2-CG 3.59Å; F222-H231 HydrophobicContact CZ-CB 3.42Å; F222-H231 VanDerWaalsContact CZ-CB 3.42Å; F222-H231 AromaticContact CZ-CD2 3.47Å; F222-H231 VanDerWaalsContact CZ-CD2 3.47Å; F222-H231 WeakPolarHBondContact CZ-CD2 3.49Å; F222-H231 AromaticContact CZ-CG 3.21Å; F222-H231 AromaticContact CZ-ND1 3.67Å; F222-H231 AromaticContact CZ-NE2 3.99Å; H227-H231 WeakPolarHBondContact O-CB 3.2Å; H227-H231 PolarHBondContact O-N 3.39Å; L228-H231 CarbonylContact O-C 3.23Å; L228-H231 WeakPolarHBondContact O-CA 3.38Å; L228-H231 WeakPolarHBondContact O-CB 3.25Å; L228-H231 PolarHBondContact O-N 3.37Å; A229-H231 VanDerWaalsContact C-N 3.3Å; A229-H231 PolarHBondContact O-N 3.42Å; H231-R233 PolarHBondContact O-N 3.36Å; H231-R233 VanDerWaalsContact O-N 3.09Å; H231-I234 VanDerWaalsContact O-CB 3.26Å; H231-I234 WeakPolarHBondContact O-CB 3.4Å; H231-I234 WeakPolarHBondContact O-CG1 3.42Å; H231-I234 PolarHBondContact O-N 3.39Å; H231-H235 AromaticContact CE1-NE2 3.85Å; H231-H235 AromaticContact NE2-NE2 3.4Å; H231-H235 PolarHBondContact NE2-NE2 3.44Å
232	K	89.5	Confident	89.6	Confident	85 Å²	85	70.8 Å²	70.8	37%	0.37	37%	0.369	S	S	.	.	H	α-helix	trans	-54.8	-29.6	176.9	-75.4	-167.2	172.9	-160.7	0	113	L228 A229 I234 H235 T236	L228-K232 HydrophobicContact CD1-CG 4.26Å; L228-K232 WeakPolarHBondContact O-CG 3.38Å; L228-K232 PolarHBondContact O-N 3.07Å; A229-K232 PolarHBondContact O-N 2.89Å; K232-I234 PolarHBondContact O-N 3.47Å; K232-I234 VanDerWaalsContact O-N 3.14Å; K232-H235 PolarHBondContact O-N 2.94Å; K232-T236 PolarHBondContact O-N 3.27Å; K232-T236 VanDerWaalsContact O-N 3.16Å
233	R	91.3	Very high	89.8	Confident	59 Å²	59	68.8 Å²	68.8	22%	0.223	36%	0.36	C	S	.	.	H	α-helix	trans	-60.4	-20.9	173.7	-61.5	-178.3	179.9	171.4	-2.9	114.6	K230 H231 H235 T236 G237 E238 N251	K230-R233 WeakPolarHBondContact O-CB 3.19Å; H231-R233 PolarHBondContact O-N 3.36Å; H231-R233 VanDerWaalsContact O-N 3.09Å; R233-H235 VanDerWaalsContact C-N 3.32Å; R233-T236 WeakPolarHBondContact CA-OG1 3.42Å; R233-G237 PolarHBondContact O-N 3.42Å; R233-E238 HydrophobicContact CG-CB 4.49Å; R233-E238 PolarHBondContact O-N 3.13Å; R233-N251 HydrophobicContact CB-CB 4.31Å; R233-N251 PolarHBondContact NH1-O 2.87Å
234	I	88.8	Confident	90	Very high	105 Å²	105	73.3 Å²	73.3	54%	0.538	38%	0.384	S	S	.	.	H	α-helix	trans	-69.7	-36.5	175.3	-60.4	177.3	0	0	0	110	H231 K232	H231-I234 VanDerWaalsContact O-CB 3.26Å; H231-I234 WeakPolarHBondContact O-CB 3.4Å; H231-I234 WeakPolarHBondContact O-CG1 3.42Å; H231-I234 PolarHBondContact O-N 3.39Å; K232-I234 PolarHBondContact O-N 3.47Å; K232-I234 VanDerWaalsContact O-N 3.14Å
235	H	88.7	Confident	90.2	Very high	69 Å²	69	74.5 Å²	74.5	32%	0.319	39%	0.394	S	S	.	.	H	α-helix	trans	-80.9	-43.6	-179.1	-61.7	-68.6	0	0	0	112.6	E217 C218 H231 K232 R233 G237	E217-H235 WeakPolarHBondContact OE2-CB 3.25Å; E217-H235 IonicContact OE2-CD2 3.07Å; E217-H235 IonicContact OE2-CG 3.86Å; E217-H235 IonicContact OE2-ND1 2.93Å; C218-H235 PolarHBondContact SG-NE2 2.83Å; C218-H235 VanDerWaalsContact SG-NE2 3.4Å; H231-H235 AromaticContact CE1-NE2 3.85Å; H231-H235 AromaticContact NE2-NE2 3.4Å; H231-H235 PolarHBondContact NE2-NE2 3.44Å; K232-H235 PolarHBondContact O-N 2.94Å; R233-H235 VanDerWaalsContact C-N 3.32Å; H235-G237 PolarHBondContact O-N 3.43Å
236	T	87.5	Confident	90.3	Very high	89 Å²	89	73.7 Å²	73.7	55%	0.546	39%	0.387	S	S	.	.	H	α-helix	trans	-72.1	-13.9	178	62.7	0	0	0	0	113	K232 R233 E238	K232-T236 PolarHBondContact O-N 3.27Å; K232-T236 VanDerWaalsContact O-N 3.16Å; R233-T236 WeakPolarHBondContact CA-OG1 3.42Å; T236-E238 PolarHBondContact O-N 3.03Å; T236-E238 WeakPolarHBondContact OG1-CB 3.27Å; T236-E238 PolarHBondContact OG1-N 2.93Å
237	G	87.4	Confident	90.3	Very high	46 Å²	46	73.7 Å²	73.7	47%	0.474	40%	0.397	S	S	.	.			trans	68.6	6.4	-173.9	0	0	0	0	0	114	R233 H235 K239	R233-G237 PolarHBondContact O-N 3.42Å; H235-G237 PolarHBondContact O-N 3.43Å; G237-K239 PolarHBondContact O-N 3.42Å
238	E	88.8	Confident	90.4	Very high	100 Å²	100	77.4 Å²	77.4	47%	0.467	41%	0.412	S	S	.	.			trans	-61.2	122.7	-177.7	-165.8	-163.9	159	0	0	110.5	R233 T236 P240	R233-E238 HydrophobicContact CG-CB 4.49Å; R233-E238 PolarHBondContact O-N 3.13Å; T236-E238 PolarHBondContact O-N 3.03Å; T236-E238 WeakPolarHBondContact OG1-CB 3.27Å; T236-E238 PolarHBondContact OG1-N 2.93Å; E238-P240 HydrophobicContact CG-CG 3.97Å; E238-P240 WeakPolarHBondContact O-CD 3.42Å; E238-P240 WeakPolarHBondContact OE1-CG 3.43Å
239	K	91.1	Very high	90.4	Very high	123 Å²	123	78 Å²	78	54%	0.535	42%	0.42	S	S	.	.			trans	-124.8	76.4	-179.9	-72.3	167.7	177	-178.7	0	110.6	G237 Y241 A249 F250	G237-K239 PolarHBondContact O-N 3.42Å; K239-Y241 PolarHBondContact O-N 2.86Å; K239-Y241 VanDerWaalsContact O-N 3.09Å; K239-A249 HydrophobicContact CB-CB 3.58Å; K239-A249 HydrophobicContact CD-CB 4.08Å; K239-A249 WeakPolarHBondContact CD-O 3.47Å; K239-A249 HydrophobicContact CG-CB 4.43Å; K239-F250 CarbonylContact C-O 3.56Å; K239-F250 VanDerWaalsContact CA-O 3.25Å; K239-F250 WeakPolarHBondContact CA-O 3.25Å
240	P	90.5	Very high	90.5	Very high	55 Å²	55	77.3 Å²	77.3	36%	0.357	41%	0.407	S	S	.	.			trans	-66.8	-14.3	-172.7	-21.3	34.1	0	0	0	114.7	E238	E238-P240 HydrophobicContact CG-CG 3.97Å; E238-P240 WeakPolarHBondContact O-CD 3.42Å; E238-P240 WeakPolarHBondContact OE1-CG 3.43Å
241	Y	93.3	Very high	90.5	Very high	77 Å²	77	74.7 Å²	74.7	30%	0.302	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	97.8	-170.9	-54.5	-76	0	0	0	110.2	K239 A249 F250	K239-Y241 PolarHBondContact O-N 2.86Å; K239-Y241 VanDerWaalsContact O-N 3.09Å; Y241-A249 CarbonylContact O-C 3.59Å; Y241-A249 WeakPolarHBondContact O-CA 3.45Å; Y241-F250 WeakPolarHBondContact CD2-O 3.49Å; Y241-F250 PolarHBondContact N-O 3.22Å; Y241-F250 PolarHBondContact O-N 3.18Å
242	T	91.4	Very high	90.4	Very high	83 Å²	83	77 Å²	77	51%	0.509	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	142.2	179.4	47.9	0	0	0	0	111.6	A249 L256	T242-A249 HydrophobicContact CG2-CB 3.82Å; T242-L256 WeakPolarHBondContact O-CD2 3.45Å
243	C	93.8	Very high	90.4	Very high	0 Å²	0	75.7 Å²	75.7	0%	0	41%	0.41	C	S	.	.			trans	-89.1	116.6	169.5	-178.6	0	0	0	0	109	E245 C246 G247 K248 F250 L256 H263	C243-E245 VanDerWaalsContact C-N 3.28Å; C243-E245 PolarHBondContact O-N 3.16Å; C243-C246 VanDerWaalsContact SG-SG 3.64Å; C243-G247 WeakPolarHBondContact O-CA 3.24Å; C243-G247 PolarHBondContact O-N 3.13Å; C243-K248 WeakPolarHBondContact CB-O 3.41Å; C243-K248 PolarHBondContact N-O 2.92Å; C243-F250 HydrophobicContact CB-CE2 4.34Å; C243-L256 HydrophobicContact CB-CD1 3.61Å; C243-H263 PolarHBondContact SG-NE2 3.4Å; C243-H263 VanDerWaalsContact SG-NE2 3.42Å
244	E	92.5	Very high	90.3	Very high	175 Å²	175	76.1 Å²	76.1	82%	0.818	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-31.7	-179.9	-67.2	167.5	173.6	0	0	112.5
245	E	89.7	Confident	90.4	Very high	124 Å²	124	73.4 Å²	73.4	58%	0.579	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-26.2	-176.7	-66.8	168.5	-133.3	0	0	114	C243 H263	C243-E245 VanDerWaalsContact C-N 3.28Å; C243-E245 PolarHBondContact O-N 3.16Å; E245-H263 WeakPolarHBondContact OE2-CB 3.35Å; E245-H263 IonicContact OE2-CD2 3.12Å; E245-H263 PolarHBondContact OE2-CD2 2.95Å; E245-H263 IonicContact OE2-CG 3.33Å
246	C	91.3	Very high	90.6	Very high	52 Å²	52	71.1 Å²	71.1	35%	0.351	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.6	5.7	-176	74.9	0	0	0	0	114.7	C243 K248 H259 H263	C243-C246 VanDerWaalsContact SG-SG 3.64Å; C246-K248 PolarHBondContact O-N 3.45Å; C246-H259 PolarHBondContact SG-NE2 2.94Å; C246-H263 PolarHBondContact SG-NE2 3.28Å
247	G	89.3	Confident	90.7	Very high	59 Å²	59	71.6 Å²	71.6	61%	0.608	40%	0.399	S	S	*	.			trans	68.4	-3.9	-178.5	0	0	0	0	0	115.6	C243 A249	C243-G247 WeakPolarHBondContact O-CA 3.24Å; C243-G247 PolarHBondContact O-N 3.13Å; G247-A249 PolarHBondContact O-N 3.03Å
248	K	91.1	Very high	90.8	Very high	127 Å²	127	71.8 Å²	71.8	55%	0.552	39%	0.388	S	S	*	.			trans	-68.5	129.3	-176.6	-72.6	-178.1	179.6	176	0	111.7	C243 C246 F250	C243-K248 WeakPolarHBondContact CB-O 3.41Å; C243-K248 PolarHBondContact N-O 2.92Å; C246-K248 PolarHBondContact O-N 3.45Å; K248-F250 HydrophobicContact CB-CE2 3.99Å; K248-F250 HydrophobicContact CB-CZ 4.07Å; K248-F250 WeakPolarHBondContact O-CE2 3.46Å
249	A	92.1	Very high	90.9	Very high	35 Å²	35	67.9 Å²	67.9	29%	0.289	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	143.9	179.9	0	0	0	0	0	112.8	K239 Y241 T242 G247	K239-A249 HydrophobicContact CB-CB 3.58Å; K239-A249 HydrophobicContact CD-CB 4.08Å; K239-A249 WeakPolarHBondContact CD-O 3.47Å; K239-A249 HydrophobicContact CG-CB 4.43Å; Y241-A249 CarbonylContact O-C 3.59Å; Y241-A249 WeakPolarHBondContact O-CA 3.45Å; T242-A249 HydrophobicContact CG2-CB 3.82Å; G247-A249 PolarHBondContact O-N 3.03Å
250	F	91.1	Very high	90.8	Very high	43 Å²	43	65.7 Å²	65.7	19%	0.189	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	150.5	-177.5	-57.4	-88.4	0	0	0	111.5	K239 Y241 C243 K248 L256 H259	K239-F250 CarbonylContact C-O 3.56Å; K239-F250 VanDerWaalsContact CA-O 3.25Å; K239-F250 WeakPolarHBondContact CA-O 3.25Å; Y241-F250 WeakPolarHBondContact CD2-O 3.49Å; Y241-F250 PolarHBondContact N-O 3.22Å; Y241-F250 PolarHBondContact O-N 3.18Å; C243-F250 HydrophobicContact CB-CE2 4.34Å; K248-F250 HydrophobicContact CB-CE2 3.99Å; K248-F250 HydrophobicContact CB-CZ 4.07Å; K248-F250 WeakPolarHBondContact O-CE2 3.46Å; F250-L256 HydrophobicContact CB-CB 4.42Å; F250-L256 HydrophobicContact CD2-CB 3.94Å; F250-L256 HydrophobicContact CD2-CD1 3.78Å; F250-L256 HydrophobicContact CD2-CG 4.46Å; F250-L256 HydrophobicContact CE2-CD1 3.92Å; F250-L256 HydrophobicContact CG-CB 4.37Å; F250-H259 HydrophobicContact CE1-CB 4.07Å; F250-H259 HydrophobicContact CE2-CB 3.85Å; F250-H259 AromaticContact CE2-CD2 3.55Å; F250-H259 AromaticContact CE2-CG 3.66Å; F250-H259 HydrophobicContact CZ-CB 3.47Å; F250-H259 VanDerWaalsContact CZ-CB 3.47Å; F250-H259 AromaticContact CZ-CD2 3.56Å; F250-H259 AromaticContact CZ-CG 3.24Å; F250-H259 AromaticContact CZ-ND1 3.67Å
251	N	88.9	Confident	90.8	Very high	44 Å²	44	65.9 Å²	65.9	24%	0.235	35%	0.354	C	S	.	.	S	Bend	trans	-82.5	-12.1	179.3	61.3	10.8	0	0	0	113.9	R233	R233-N251 HydrophobicContact CB-CB 4.31Å; R233-N251 PolarHBondContact NH1-O 2.87Å
252	Q	89.4	Confident	90.5	Very high	66 Å²	66	67.8 Å²	67.8	31%	0.308	37%	0.369	S	S	.	.	S	Bend	trans	-135.8	144.4	-178.4	-66	179.3	18.3	0	0	110.9	T255 L256	Q252-T255 HydrophobicContact CB-CG2 4.37Å; Q252-T255 PolarHBondContact O-N 3.49Å; Q252-T255 PolarHBondContact O-OG1 3.08Å; Q252-L256 PolarHBondContact O-N 3.22Å
253	S	90.6	Very high	90.4	Very high	58 Å²	58	67.3 Å²	67.3	41%	0.406	36%	0.36	S	S	.	.	H	α-helix	trans	-68.1	-35.5	178.2	56.8	0	0	0	0	112.7	T255 L256 I257	S253-T255 VanDerWaalsContact C-N 3.3Å; S253-T255 PolarHBondContact O-N 3.44Å; S253-L256 PolarHBondContact O-N 3.06Å; S253-I257 WeakPolarHBondContact O-CG1 3.39Å; S253-I257 PolarHBondContact O-N 3.33Å
254	S	89.3	Confident	90.1	Very high	69 Å²	69	70.5 Å²	70.5	48%	0.483	38%	0.383	S	S	.	.	H	α-helix	trans	-62.4	-36.4	178.4	50	0	0	0	0	112.6	L258	S254-L258 WeakPolarHBondContact O-CB 3.34Å; S254-L258 PolarHBondContact O-N 2.98Å; S254-L258 VanDerWaalsContact O-N 3.07Å
255	T	90.6	Very high	89.8	Confident	47 Å²	47	64.5 Å²	64.5	29%	0.288	37%	0.368	S	S	.	.	H	α-helix	trans	-74	-35.9	177.5	53.4	0	0	0	0	111.5	Q252 S253 L258 H259	Q252-T255 HydrophobicContact CB-CG2 4.37Å; Q252-T255 PolarHBondContact O-N 3.49Å; Q252-T255 PolarHBondContact O-OG1 3.08Å; S253-T255 VanDerWaalsContact C-N 3.3Å; S253-T255 PolarHBondContact O-N 3.44Å; T255-L258 PolarHBondContact O-N 3.49Å; T255-H259 WeakPolarHBondContact O-CB 3.34Å; T255-H259 PolarHBondContact O-N 3.04Å
256	L	92.3	Very high	89.6	Confident	21 Å²	21	64.3 Å²	64.3	11%	0.11	37%	0.367	C	S	.	.	H	α-helix	trans	-61.1	-47.5	169.8	173.7	62.7	0	0	0	111.7	T242 C243 F250 Q252 S253 L258 H259 K260	T242-L256 WeakPolarHBondContact O-CD2 3.45Å; C243-L256 HydrophobicContact CB-CD1 3.61Å; F250-L256 HydrophobicContact CB-CB 4.42Å; F250-L256 HydrophobicContact CD2-CB 3.94Å; F250-L256 HydrophobicContact CD2-CD1 3.78Å; F250-L256 HydrophobicContact CD2-CG 4.46Å; F250-L256 HydrophobicContact CE2-CD1 3.92Å; F250-L256 HydrophobicContact CG-CB 4.37Å; Q252-L256 PolarHBondContact O-N 3.22Å; S253-L256 PolarHBondContact O-N 3.06Å; L256-L258 VanDerWaalsContact C-N 3.29Å; L256-L258 PolarHBondContact O-N 3.11Å; L256-H259 WeakPolarHBondContact O-CB 3.5Å; L256-H259 PolarHBondContact O-N 3.39Å; L256-H259 VanDerWaalsContact O-N 3.09Å; L256-K260 HydrophobicContact CD1-CG 4.26Å; L256-K260 WeakPolarHBondContact O-CG 3.47Å; L256-K260 PolarHBondContact O-N 3.06Å
257	I	89.4	Confident	89.6	Confident	99 Å²	99	67.2 Å²	67.2	51%	0.508	37%	0.373	S	S	.	.	H	α-helix	trans	-59.4	-43	178.4	-68.6	165.7	0	0	0	110.8	S253 H259 K260	S253-I257 WeakPolarHBondContact O-CG1 3.39Å; S253-I257 PolarHBondContact O-N 3.33Å; I257-H259 VanDerWaalsContact C-N 3.34Å; I257-K260 PolarHBondContact O-N 3.15Å
258	L	89.5	Confident	89.6	Confident	50 Å²	50	67.9 Å²	67.9	26%	0.262	37%	0.367	S	S	.	.	H	α-helix	trans	-64.2	-40.4	175.5	176.8	62.8	0	0	0	111.6	S254 T255 L256 R261 R280	S254-L258 WeakPolarHBondContact O-CB 3.34Å; S254-L258 PolarHBondContact O-N 2.98Å; S254-L258 VanDerWaalsContact O-N 3.07Å; T255-L258 PolarHBondContact O-N 3.49Å; L256-L258 VanDerWaalsContact C-N 3.29Å; L256-L258 PolarHBondContact O-N 3.11Å; L258-R261 WeakPolarHBondContact O-CB 3.41Å; L258-R261 PolarHBondContact O-N 3.45Å; L258-R280 HydrophobicContact CD1-CG 3.51Å; L258-R280 HydrophobicContact CD2-CG 4.11Å; L258-R280 HydrophobicContact CG-CG 4.46Å
259	H	91.1	Very high	89.6	Confident	19 Å²	19	65.7 Å²	65.7	9%	0.088	36%	0.356	C	S	.	.	H	α-helix	trans	-62.8	-42.3	177	174.6	69	0	0	0	112.2	C246 F250 T255 L256 I257 R261 I262 H263	C246-H259 PolarHBondContact SG-NE2 2.94Å; F250-H259 HydrophobicContact CE1-CB 4.07Å; F250-H259 HydrophobicContact CE2-CB 3.85Å; F250-H259 AromaticContact CE2-CD2 3.55Å; F250-H259 AromaticContact CE2-CG 3.66Å; F250-H259 HydrophobicContact CZ-CB 3.47Å; F250-H259 VanDerWaalsContact CZ-CB 3.47Å; F250-H259 AromaticContact CZ-CD2 3.56Å; F250-H259 AromaticContact CZ-CG 3.24Å; F250-H259 AromaticContact CZ-ND1 3.67Å; T255-H259 WeakPolarHBondContact O-CB 3.34Å; T255-H259 PolarHBondContact O-N 3.04Å; L256-H259 WeakPolarHBondContact O-CB 3.5Å; L256-H259 PolarHBondContact O-N 3.39Å; L256-H259 VanDerWaalsContact O-N 3.09Å; I257-H259 VanDerWaalsContact C-N 3.34Å; H259-R261 PolarHBondContact O-N 3.46Å; H259-R261 VanDerWaalsContact O-N 3.07Å; H259-I262 VanDerWaalsContact O-CB 3.25Å; H259-I262 WeakPolarHBondContact O-CB 3.38Å; H259-I262 WeakPolarHBondContact O-CG1 3.42Å; H259-I262 PolarHBondContact O-N 3.35Å; H259-H263 AromaticContact NE2-CE1 3.91Å; H259-H263 AromaticContact NE2-NE2 3.32Å; H259-H263 PolarHBondContact NE2-NE2 2.89Å
260	K	89	Confident	89.5	Confident	77 Å²	77	70.5 Å²	70.5	34%	0.335	37%	0.37	S	S	.	.	H	α-helix	trans	-57.3	-24.4	176.6	-73	-168	174.6	-160.5	0	113.2	L256 I257 I262 H263 S264	L256-K260 HydrophobicContact CD1-CG 4.26Å; L256-K260 WeakPolarHBondContact O-CG 3.47Å; L256-K260 PolarHBondContact O-N 3.06Å; I257-K260 PolarHBondContact O-N 3.15Å; K260-I262 PolarHBondContact O-N 2.75Å; K260-H263 PolarHBondContact O-N 3.09Å; K260-S264 PolarHBondContact O-N 2.91Å; K260-S264 VanDerWaalsContact O-N 3.16Å; K260-S264 PolarHBondContact O-OG 3.06Å
261	R	90.5	Very high	89.6	Confident	59 Å²	59	68.5 Å²	68.5	22%	0.223	36%	0.362	C	S	.	.	H	α-helix	trans	-66.7	-19.4	173.8	-61.6	-177.1	-177.2	170.9	-1.5	114	L258 H259 S264 G265 Q266 T279	L258-R261 WeakPolarHBondContact O-CB 3.41Å; L258-R261 PolarHBondContact O-N 3.45Å; H259-R261 PolarHBondContact O-N 3.46Å; H259-R261 VanDerWaalsContact O-N 3.07Å; R261-S264 WeakPolarHBondContact CA-OG 3.46Å; R261-G265 PolarHBondContact O-N 3.28Å; R261-G265 VanDerWaalsContact O-N 3.15Å; R261-Q266 PolarHBondContact O-N 3.08Å; R261-T279 HydrophobicContact CB-CG2 4.47Å; R261-T279 PolarHBondContact NH1-O 3.22Å
262	I	87.9	Confident	89.7	Confident	117 Å²	117	74.4 Å²	74.4	60%	0.6	39%	0.388	S	S	*	.	H	α-helix	trans	-69.2	-43.7	175.5	-60.5	176.2	0	0	0	109.5	H259 K260	H259-I262 VanDerWaalsContact O-CB 3.25Å; H259-I262 WeakPolarHBondContact O-CB 3.38Å; H259-I262 WeakPolarHBondContact O-CG1 3.42Å; H259-I262 PolarHBondContact O-N 3.35Å; K260-I262 PolarHBondContact O-N 2.75Å
263	H	88.2	Confident	89.6	Confident	73 Å²	73	77.3 Å²	77.3	34%	0.338	40%	0.401	S	S	.	.	H	α-helix	trans	-74.5	-42.7	-179.1	-54.8	-47.5	0	0	0	112.4	C243 E245 C246 H259 K260 G265	C243-H263 PolarHBondContact SG-NE2 3.4Å; C243-H263 VanDerWaalsContact SG-NE2 3.42Å; E245-H263 WeakPolarHBondContact OE2-CB 3.35Å; E245-H263 IonicContact OE2-CD2 3.12Å; E245-H263 PolarHBondContact OE2-CD2 2.95Å; E245-H263 IonicContact OE2-CG 3.33Å; C246-H263 PolarHBondContact SG-NE2 3.28Å; H259-H263 AromaticContact NE2-CE1 3.91Å; H259-H263 AromaticContact NE2-NE2 3.32Å; H259-H263 PolarHBondContact NE2-NE2 2.89Å; K260-H263 PolarHBondContact O-N 3.09Å; H263-G265 PolarHBondContact O-N 3.22Å
264	S	87.5	Confident	89.6	Confident	67 Å²	67	77.1 Å²	77.1	47%	0.469	40%	0.4	S	S	.	.	S	Bend	trans	-75.7	-7.6	178	66.8	0	0	0	0	114.2	K260 R261 Q266	K260-S264 PolarHBondContact O-N 2.91Å; K260-S264 VanDerWaalsContact O-N 3.16Å; K260-S264 PolarHBondContact O-OG 3.06Å; R261-S264 WeakPolarHBondContact CA-OG 3.46Å; S264-Q266 PolarHBondContact O-N 3.21Å; S264-Q266 WeakPolarHBondContact OG-CG 3.35Å
265	G	86.4	Confident	89.6	Confident	49 Å²	49	76.5 Å²	76.5	51%	0.505	40%	0.404	S	S	.	.			trans	64.1	6.3	-174.8	0	0	0	0	0	114.7	R261 H263 K267	R261-G265 PolarHBondContact O-N 3.28Å; R261-G265 VanDerWaalsContact O-N 3.15Å; H263-G265 PolarHBondContact O-N 3.22Å; G265-K267 PolarHBondContact O-N 3.27Å
266	Q	86.5	Confident	89.5	Confident	119 Å²	119	80.3 Å²	80.3	56%	0.556	42%	0.416	S	S	*	.			trans	-65.2	119.7	-175.3	-75.1	-174.8	-1.2	0	0	111.7	R261 S264 P268	R261-Q266 PolarHBondContact O-N 3.08Å; S264-Q266 PolarHBondContact O-N 3.21Å; S264-Q266 WeakPolarHBondContact OG-CG 3.35Å; Q266-P268 WeakPolarHBondContact O-CD 2.79Å
267	K	90	Very high	89.5	Confident	113 Å²	113	80.8 Å²	80.8	49%	0.491	42%	0.423	S	S	.	.			trans	-123.3	80.4	176	-70	170.8	176.6	-175	0	110	G265 Y269 A277 F278 T279	G265-K267 PolarHBondContact O-N 3.27Å; K267-Y269 PolarHBondContact O-N 3.35Å; K267-A277 HydrophobicContact CB-CB 3.56Å; K267-A277 HydrophobicContact CD-CB 4.11Å; K267-A277 WeakPolarHBondContact CD-O 3.35Å; K267-A277 HydrophobicContact CG-CB 4.46Å; K267-F278 CarbonylContact C-O 3.43Å; K267-F278 VanDerWaalsContact C-O 3.25Å; K267-F278 VanDerWaalsContact CA-O 3.27Å; K267-F278 WeakPolarHBondContact CA-O 3.42Å; K267-T279 HydrophobicContact CG-CG2 3.88Å
268	P	89.5	Confident	89.5	Confident	74 Å²	74	78.1 Å²	78.1	48%	0.481	41%	0.408	S	S	.	.			trans	-66.8	-19.3	-171.5	-20.9	33.5	0	0	0	114.2	Q266	Q266-P268 WeakPolarHBondContact O-CD 2.79Å
269	Y	91.8	Very high	89.4	Confident	81 Å²	81	77.7 Å²	77.7	32%	0.318	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	98.9	-171	-56.4	-77.4	0	0	0	109.7	K267 A277 F278 S281	K267-Y269 PolarHBondContact O-N 3.35Å; Y269-A277 CarbonylContact O-C 3.58Å; Y269-A277 WeakPolarHBondContact O-CA 3.48Å; Y269-F278 PolarHBondContact N-O 3.24Å; Y269-F278 PolarHBondContact O-N 3.5Å; Y269-S281 VanDerWaalsContact CD2-N 3.35Å
270	K	90.8	Very high	89.3	Confident	135 Å²	135	82.5 Å²	82.5	59%	0.587	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.4	143.4	178.3	-63.8	-174.8	-179.3	-179.9	0	111.2	A277 L284	K270-A277 HydrophobicContact CG-CB 3.92Å; K270-L284 WeakPolarHBondContact O-CD2 2.82Å
271	C	92.6	Very high	89.3	Confident	1 Å²	1	81.3 Å²	81.3	1%	0.007	43%	0.427	C	S	.	.			trans	-87.2	120.2	168.2	179.3	0	0	0	0	108.4	E273 G275 K276 F278 L284	C271-E273 VanDerWaalsContact C-N 3.26Å; C271-E273 PolarHBondContact O-N 3.2Å; C271-G275 WeakPolarHBondContact O-CA 3.46Å; C271-G275 PolarHBondContact O-N 3.31Å; C271-K276 WeakPolarHBondContact CB-O 3.42Å; C271-K276 PolarHBondContact N-O 3.26Å; C271-F278 HydrophobicContact CB-CE2 4.38Å; C271-L284 HydrophobicContact CB-CD1 3.64Å
272	E	90.9	Very high	89.2	Confident	169 Å²	169	81.4 Å²	81.4	79%	0.79	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-27	179.8	-58	-53.1	139.5	0	0	112.6
273	E	88.2	Confident	89.2	Confident	126 Å²	126	77.8 Å²	77.8	59%	0.589	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.9	-31.6	-174.9	-63.9	179.4	-136.9	0	0	113.9	C271 H291	C271-E273 VanDerWaalsContact C-N 3.26Å; C271-E273 PolarHBondContact O-N 3.2Å; E273-H291 WeakPolarHBondContact OE2-CB 3.38Å; E273-H291 IonicContact OE2-CD2 3.1Å; E273-H291 IonicContact OE2-CG 3.08Å; E273-H291 IonicContact OE2-ND1 2.92Å; E273-H291 PolarHBondContact OE2-ND1 2.85Å
274	C	90.1	Very high	89.3	Confident	55 Å²	55	75 Å²	75	37%	0.372	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.7	5.7	-179.7	70.8	0	0	0	0	114.7	K276 H287 H291	C274-K276 PolarHBondContact O-N 3.09Å; C274-H287 PolarHBondContact SG-NE2 3.27Å; C274-H291 PolarHBondContact SG-NE2 3.21Å; C274-H291 VanDerWaalsContact SG-NE2 3.43Å
275	G	88.3	Confident	89.3	Confident	55 Å²	55	76.4 Å²	76.4	57%	0.567	41%	0.407	S	S	*	.			trans	69.4	-2.6	-179.7	0	0	0	0	0	115.3	C271 A277	C271-G275 WeakPolarHBondContact O-CA 3.46Å; C271-G275 PolarHBondContact O-N 3.31Å; G275-A277 PolarHBondContact O-N 3.34Å
276	K	89.7	Confident	89.3	Confident	127 Å²	127	78.9 Å²	78.9	55%	0.552	41%	0.406	S	S	*	.			trans	-66.1	130.6	-178.3	-76.2	-177.5	179.6	175	0	111.4	C271 C274 F278	C271-K276 WeakPolarHBondContact CB-O 3.42Å; C271-K276 PolarHBondContact N-O 3.26Å; C274-K276 PolarHBondContact O-N 3.09Å; K276-F278 HydrophobicContact CB-CE2 3.9Å; K276-F278 HydrophobicContact CB-CZ 4.03Å; K276-F278 WeakPolarHBondContact O-CE2 3.47Å
277	A	91.3	Very high	89.4	Confident	31 Å²	31	74.2 Å²	74.2	26%	0.256	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	143.8	179.9	0	0	0	0	0	112.2	K267 Y269 K270 G275	K267-A277 HydrophobicContact CB-CB 3.56Å; K267-A277 HydrophobicContact CD-CB 4.11Å; K267-A277 WeakPolarHBondContact CD-O 3.35Å; K267-A277 HydrophobicContact CG-CB 4.46Å; Y269-A277 CarbonylContact O-C 3.58Å; Y269-A277 WeakPolarHBondContact O-CA 3.48Å; K270-A277 HydrophobicContact CG-CB 3.92Å; G275-A277 PolarHBondContact O-N 3.34Å
278	F	89.8	Confident	89.3	Confident	43 Å²	43	72.9 Å²	72.9	19%	0.189	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	153	-176.8	-58.4	-90.2	0	0	0	111.8	K267 Y269 C271 K276 L284 H287	K267-F278 CarbonylContact C-O 3.43Å; K267-F278 VanDerWaalsContact C-O 3.25Å; K267-F278 VanDerWaalsContact CA-O 3.27Å; K267-F278 WeakPolarHBondContact CA-O 3.42Å; Y269-F278 PolarHBondContact N-O 3.24Å; Y269-F278 PolarHBondContact O-N 3.5Å; C271-F278 HydrophobicContact CB-CE2 4.38Å; K276-F278 HydrophobicContact CB-CE2 3.9Å; K276-F278 HydrophobicContact CB-CZ 4.03Å; K276-F278 WeakPolarHBondContact O-CE2 3.47Å; F278-L284 HydrophobicContact CB-CB 4.41Å; F278-L284 HydrophobicContact CD2-CB 3.96Å; F278-L284 HydrophobicContact CD2-CD1 3.76Å; F278-L284 HydrophobicContact CD2-CG 4.46Å; F278-L284 HydrophobicContact CE2-CD1 3.88Å; F278-L284 HydrophobicContact CG-CB 4.34Å; F278-H287 HydrophobicContact CE1-CB 4.05Å; F278-H287 HydrophobicContact CE2-CB 4.01Å; F278-H287 AromaticContact CE2-CD2 3.38Å; F278-H287 WeakPolarHBondContact CE2-CD2 3.37Å; F278-H287 AromaticContact CE2-CG 3.74Å; F278-H287 HydrophobicContact CZ-CB 3.53Å; F278-H287 AromaticContact CZ-CD2 3.38Å; F278-H287 WeakPolarHBondContact CZ-CD2 3.43Å; F278-H287 AromaticContact CZ-CG 3.28Å; F278-H287 AromaticContact CZ-ND1 3.83Å; F278-H287 AromaticContact CZ-NE2 3.93Å
279	T	88	Confident	89.2	Confident	42 Å²	42	72.7 Å²	72.7	26%	0.258	37%	0.37	S	S	.	.	S	Bend	trans	-80.4	-18	178.4	56.8	0	0	0	0	113	R261 K267	R261-T279 HydrophobicContact CB-CG2 4.47Å; R261-T279 PolarHBondContact NH1-O 3.22Å; K267-T279 HydrophobicContact CG-CG2 3.88Å
280	R	88.3	Confident	88.9	Confident	119 Å²	119	72.8 Å²	72.8	45%	0.449	38%	0.375	S	S	.	.	S	Bend	trans	-131.3	147.3	-178.5	-58.7	170.4	65.9	171.8	-3.9	111.2	L258 T282 T283 L284	L258-R280 HydrophobicContact CD1-CG 3.51Å; L258-R280 HydrophobicContact CD2-CG 4.11Å; L258-R280 HydrophobicContact CG-CG 4.46Å; R280-T282 VanDerWaalsContact C-N 3.34Å; R280-T282 PolarHBondContact NE-OG1 3.4Å; R280-T283 HydrophobicContact CB-CG2 4.27Å; R280-T283 PolarHBondContact O-OG1 2.95Å; R280-L284 PolarHBondContact O-N 3.27Å
281	S	89.1	Confident	88.6	Confident	53 Å²	53	69.5 Å²	69.5	37%	0.371	36%	0.361	S	S	.	.	H	α-helix	trans	-66.7	-36.6	173	55.9	0	0	0	0	112.2	Y269 T283 L284 N285	Y269-S281 VanDerWaalsContact CD2-N 3.35Å; S281-T283 VanDerWaalsContact C-N 3.33Å; S281-T283 PolarHBondContact O-N 3.22Å; S281-L284 WeakPolarHBondContact O-CB 3.26Å; S281-L284 PolarHBondContact O-N 3.17Å; S281-N285 PolarHBondContact O-N 3.42Å
282	T	87.7	Confident	88.2	Confident	60 Å²	60	73.3 Å²	73.3	37%	0.368	38%	0.384	S	S	.	.	H	α-helix	trans	-61.1	-42.6	179.3	56.3	0	0	0	0	111.8	R280 L284 N285 E286	R280-T282 VanDerWaalsContact C-N 3.34Å; R280-T282 PolarHBondContact NE-OG1 3.4Å; T282-L284 VanDerWaalsContact C-N 3.34Å; T282-N285 PolarHBondContact O-N 3.43Å; T282-E286 WeakPolarHBondContact O-CG 3.37Å; T282-E286 PolarHBondContact O-N 3.33Å
283	T	88.8	Confident	87.6	Confident	41 Å²	41	67.3 Å²	67.3	25%	0.252	37%	0.368	S	S	.	.	H	α-helix	trans	-69.6	-33	177.8	51.2	0	0	0	0	112.1	R280 S281 H287	R280-T283 HydrophobicContact CB-CG2 4.27Å; R280-T283 PolarHBondContact O-OG1 2.95Å; S281-T283 VanDerWaalsContact C-N 3.33Å; S281-T283 PolarHBondContact O-N 3.22Å; T283-H287 VanDerWaalsContact O-CB 3.27Å; T283-H287 WeakPolarHBondContact O-CB 3.47Å; T283-H287 PolarHBondContact O-N 3.08Å
284	L	90.9	Very high	87.3	Confident	14 Å²	14	66.9 Å²	66.9	7%	0.073	37%	0.366	C	S	.	.	H	α-helix	trans	-64.9	-45.6	171.2	172.1	63.6	0	0	0	110.8	K270 C271 F278 R280 S281 T282 E286 H287 K288	K270-L284 WeakPolarHBondContact O-CD2 2.82Å; C271-L284 HydrophobicContact CB-CD1 3.64Å; F278-L284 HydrophobicContact CB-CB 4.41Å; F278-L284 HydrophobicContact CD2-CB 3.96Å; F278-L284 HydrophobicContact CD2-CD1 3.76Å; F278-L284 HydrophobicContact CD2-CG 4.46Å; F278-L284 HydrophobicContact CE2-CD1 3.88Å; F278-L284 HydrophobicContact CG-CB 4.34Å; R280-L284 PolarHBondContact O-N 3.27Å; S281-L284 WeakPolarHBondContact O-CB 3.26Å; S281-L284 PolarHBondContact O-N 3.17Å; T282-L284 VanDerWaalsContact C-N 3.34Å; L284-E286 VanDerWaalsContact C-N 3.34Å; L284-E286 PolarHBondContact O-N 3.06Å; L284-H287 WeakPolarHBondContact O-CB 3.38Å; L284-H287 PolarHBondContact O-N 3.11Å; L284-H287 VanDerWaalsContact O-N 3.16Å; L284-K288 HydrophobicContact CD1-CG 4.38Å; L284-K288 WeakPolarHBondContact O-CG 3.49Å; L284-K288 PolarHBondContact O-N 3.14Å
285	N	86.6	Confident	87.1	Confident	98 Å²	98	69.6 Å²	69.6	52%	0.524	37%	0.372	S	S	.	.	H	α-helix	trans	-63.4	-39.3	178.4	-75.9	-2	0	0	0	112.2	S281 T282 H287 K288	S281-N285 PolarHBondContact O-N 3.42Å; T282-N285 PolarHBondContact O-N 3.43Å; N285-H287 VanDerWaalsContact C-N 3.34Å; N285-K288 PolarHBondContact O-N 3.09Å
286	E	86.6	Confident	87	Confident	101 Å²	101	70.5 Å²	70.5	47%	0.472	37%	0.368	S	S	.	.	H	α-helix	trans	-63.7	-40.8	172.4	-74.2	170.8	174.4	0	0	111.9	T282 L284 K289	T282-E286 WeakPolarHBondContact O-CG 3.37Å; T282-E286 PolarHBondContact O-N 3.33Å; L284-E286 VanDerWaalsContact C-N 3.34Å; L284-E286 PolarHBondContact O-N 3.06Å; E286-K289 WeakPolarHBondContact O-CB 3.5Å; E286-K289 PolarHBondContact O-N 3.48Å
287	H	89.1	Confident	87	Confident	20 Å²	20	68.4 Å²	68.4	9%	0.093	36%	0.357	C	S	.	.	H	α-helix	trans	-64.4	-39.1	176.1	170.6	64.2	0	0	0	112.6	C274 F278 T283 L284 N285 K289 I290 H291	C274-H287 PolarHBondContact SG-NE2 3.27Å; F278-H287 HydrophobicContact CE1-CB 4.05Å; F278-H287 HydrophobicContact CE2-CB 4.01Å; F278-H287 AromaticContact CE2-CD2 3.38Å; F278-H287 WeakPolarHBondContact CE2-CD2 3.37Å; F278-H287 AromaticContact CE2-CG 3.74Å; F278-H287 HydrophobicContact CZ-CB 3.53Å; F278-H287 AromaticContact CZ-CD2 3.38Å; F278-H287 WeakPolarHBondContact CZ-CD2 3.43Å; F278-H287 AromaticContact CZ-CG 3.28Å; F278-H287 AromaticContact CZ-ND1 3.83Å; F278-H287 AromaticContact CZ-NE2 3.93Å; T283-H287 VanDerWaalsContact O-CB 3.27Å; T283-H287 WeakPolarHBondContact O-CB 3.47Å; T283-H287 PolarHBondContact O-N 3.08Å; L284-H287 WeakPolarHBondContact O-CB 3.38Å; L284-H287 PolarHBondContact O-N 3.11Å; L284-H287 VanDerWaalsContact O-N 3.16Å; N285-H287 VanDerWaalsContact C-N 3.34Å; H287-K289 PolarHBondContact O-N 3.22Å; H287-K289 VanDerWaalsContact O-N 3.13Å; H287-I290 VanDerWaalsContact O-CB 3.25Å; H287-I290 WeakPolarHBondContact O-CB 3.4Å; H287-I290 WeakPolarHBondContact O-CG1 3.41Å; H287-I290 PolarHBondContact O-N 2.88Å; H287-H291 AromaticContact CE1-NE2 3.59Å; H287-H291 AromaticContact NE2-CD2 3.9Å; H287-H291 AromaticContact NE2-NE2 3.26Å; H287-H291 PolarHBondContact NE2-NE2 3.15Å
288	K	87	Confident	87	Confident	85 Å²	85	73.4 Å²	73.4	37%	0.37	37%	0.372	S	S	.	.	H	α-helix	trans	-56.6	-28.5	176.6	-76.5	-175	174.8	-166.1	0	113.1	L284 N285 I290 H291 T292	L284-K288 HydrophobicContact CD1-CG 4.38Å; L284-K288 WeakPolarHBondContact O-CG 3.49Å; L284-K288 PolarHBondContact O-N 3.14Å; N285-K288 PolarHBondContact O-N 3.09Å; K288-I290 PolarHBondContact O-N 3.34Å; K288-H291 WeakPolarHBondContact O-CB 3.27Å; K288-H291 PolarHBondContact O-N 3.06Å; K288-T292 PolarHBondContact O-N 3.16Å
289	K	86.8	Confident	87	Confident	71 Å²	71	71.5 Å²	71.5	31%	0.309	36%	0.364	S	S	.	.	H	α-helix	trans	-61.7	-23.5	174.6	-60.2	-176.6	175.5	-173.9	0	113.7	E286 H287 H291 T292 G293 I307	E286-K289 WeakPolarHBondContact O-CB 3.5Å; E286-K289 PolarHBondContact O-N 3.48Å; H287-K289 PolarHBondContact O-N 3.22Å; H287-K289 VanDerWaalsContact O-N 3.13Å; K289-H291 VanDerWaalsContact C-N 3.32Å; K289-T292 PolarHBondContact O-OG1 3.01Å; K289-G293 PolarHBondContact O-N 3.17Å; K289-I307 HydrophobicContact CB-CG2 3.78Å; K289-I307 HydrophobicContact CD-CG2 4.48Å
290	I	85.9	Confident	87.2	Confident	82 Å²	82	77.8 Å²	77.8	42%	0.421	39%	0.391	S	S	.	.	H	α-helix	trans	-69.6	-36.4	176.1	-58.5	173.2	0	0	0	110.2	H287 K288 I307 W308	H287-I290 VanDerWaalsContact O-CB 3.25Å; H287-I290 WeakPolarHBondContact O-CB 3.4Å; H287-I290 WeakPolarHBondContact O-CG1 3.41Å; H287-I290 PolarHBondContact O-N 2.88Å; K288-I290 PolarHBondContact O-N 3.34Å; I290-I307 HydrophobicContact CG1-CD1 4.38Å; I290-W308 HydrophobicContact CD1-CH2 4.24Å; I290-W308 HydrophobicContact CD1-CZ2 4.19Å; I290-W308 HydrophobicContact CG1-CZ2 4.31Å
291	H	85.6	Confident	87.1	Confident	67 Å²	67	78.1 Å²	78.1	31%	0.31	40%	0.398	S	S	.	.	H	α-helix	trans	-75.8	-41	-179.5	-70.2	-65.7	0	0	0	112.9	E273 C274 H287 K288 K289 G293	E273-H291 WeakPolarHBondContact OE2-CB 3.38Å; E273-H291 IonicContact OE2-CD2 3.1Å; E273-H291 IonicContact OE2-CG 3.08Å; E273-H291 IonicContact OE2-ND1 2.92Å; E273-H291 PolarHBondContact OE2-ND1 2.85Å; C274-H291 PolarHBondContact SG-NE2 3.21Å; C274-H291 VanDerWaalsContact SG-NE2 3.43Å; H287-H291 AromaticContact CE1-NE2 3.59Å; H287-H291 AromaticContact NE2-CD2 3.9Å; H287-H291 AromaticContact NE2-NE2 3.26Å; H287-H291 PolarHBondContact NE2-NE2 3.15Å; K288-H291 WeakPolarHBondContact O-CB 3.27Å; K288-H291 PolarHBondContact O-N 3.06Å; K289-H291 VanDerWaalsContact C-N 3.32Å; H291-G293 PolarHBondContact O-N 2.96Å
292	T	82.8	Confident	87.1	Confident	80 Å²	80	78.3 Å²	78.3	49%	0.491	40%	0.398	S	S	.	.	H	α-helix	trans	-68.2	-17.1	176.7	62	0	0	0	0	112.5	K288 K289 E294	K288-T292 PolarHBondContact O-N 3.16Å; K289-T292 PolarHBondContact O-OG1 3.01Å; T292-E294 PolarHBondContact O-N 2.76Å
293	G	80.1	Confident	87	Confident	43 Å²	43	78.2 Å²	78.2	44%	0.443	41%	0.409	S	S	.	.			trans	65.9	5.8	-176.4	0	0	0	0	0	113.5	K289 H291 K295	K289-G293 PolarHBondContact O-N 3.17Å; H291-G293 PolarHBondContact O-N 2.96Å; G293-K295 PolarHBondContact O-N 2.8Å
294	E	80.5	Confident	87	Confident	118 Å²	118	82.4 Å²	82.4	55%	0.551	42%	0.424	S	S	*	.			trans	-61.8	123.1	178.9	-73.3	-179.1	173.4	0	0	109.4	T292 P296	T292-E294 PolarHBondContact O-N 2.76Å; E294-P296 WeakPolarHBondContact O-CD 3.47Å
295	K	86.3	Confident	87	Confident	112 Å²	112	83.2 Å²	83.2	49%	0.487	43%	0.433	S	S	.	.			trans	-119.2	78.5	177.2	-70.9	167.7	176.1	-174.8	0	109.2	G293 Y297 A305 F306 I307	G293-K295 PolarHBondContact O-N 2.8Å; K295-Y297 PolarHBondContact O-N 3.11Å; K295-A305 HydrophobicContact CB-CB 3.53Å; K295-A305 HydrophobicContact CD-CB 4.1Å; K295-A305 WeakPolarHBondContact CD-O 3.19Å; K295-A305 HydrophobicContact CG-CB 4.41Å; K295-F306 CarbonylContact C-O 3.23Å; K295-F306 VanDerWaalsContact C-O 3.3Å; K295-F306 VanDerWaalsContact CA-O 3.27Å; K295-F306 WeakPolarHBondContact CA-O 3.45Å; K295-I307 HydrophobicContact CG-CG1 3.82Å
296	P	87.1	Confident	87.1	Confident	74 Å²	74	80.6 Å²	80.6	48%	0.481	42%	0.417	S	S	.	.			trans	-65.9	-21	-173.2	-20	33.1	0	0	0	113.3	E294	E294-P296 WeakPolarHBondContact O-CD 3.47Å
297	Y	89.8	Confident	87.1	Confident	82 Å²	82	77.2 Å²	77.2	32%	0.322	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	95.9	-170.7	-56.4	-75.8	0	0	0	110.1	K295 A305 F306 I307 W308	K295-Y297 PolarHBondContact O-N 3.11Å; Y297-A305 CarbonylContact O-C 3.27Å; Y297-A305 WeakPolarHBondContact O-CA 3.48Å; Y297-F306 PolarHBondContact N-O 3.32Å; Y297-F306 PolarHBondContact O-N 3.48Å; Y297-I307 WeakPolarHBondContact CD2-O 3.34Å; Y297-I307 VanDerWaalsContact CE2-O 3.24Å; Y297-I307 WeakPolarHBondContact CE2-O 3.43Å; Y297-W308 VanDerWaalsContact CD2-C 3.4Å
298	K	89.4	Confident	87	Confident	136 Å²	136	81.6 Å²	81.6	59%	0.591	42%	0.417	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.3	142.7	177.9	-63.6	-177	-179	179.2	0	111.2	A305 L312	K298-A305 HydrophobicContact CG-CB 3.96Å; K298-L312 WeakPolarHBondContact O-CD2 3.48Å
299	C	91.7	Very high	87	Confident	3 Å²	3	80.8 Å²	80.8	2%	0.02	42%	0.422	C	S	.	.			trans	-88.8	118.3	169.8	177.8	0	0	0	0	108.8	E301 C302 G303 K304 F306 L312 H319	C299-E301 VanDerWaalsContact C-N 3.27Å; C299-E301 PolarHBondContact O-N 3.24Å; C299-C302 VanDerWaalsContact SG-SG 3.62Å; C299-G303 WeakPolarHBondContact O-CA 3.4Å; C299-G303 PolarHBondContact O-N 3.44Å; C299-K304 WeakPolarHBondContact CB-O 3.45Å; C299-K304 PolarHBondContact N-O 2.78Å; C299-F306 HydrophobicContact CB-CE2 4.45Å; C299-L312 HydrophobicContact CB-CD1 3.64Å; C299-H319 PolarHBondContact SG-NE2 3.03Å; C299-H319 VanDerWaalsContact SG-NE2 3.36Å
300	E	90.3	Very high	87	Confident	174 Å²	174	80.8 Å²	80.8	81%	0.813	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-31.5	-179.5	-58.4	-53.4	138.5	0	0	112.7
301	E	87.1	Confident	87.1	Confident	127 Å²	127	78.6 Å²	78.6	59%	0.593	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-27.2	-174.4	-65.5	172.5	-143.2	0	0	113.9	C299 H319	C299-E301 VanDerWaalsContact C-N 3.27Å; C299-E301 PolarHBondContact O-N 3.24Å; E301-H319 WeakPolarHBondContact OE2-CB 3.41Å; E301-H319 IonicContact OE2-CD2 3.43Å; E301-H319 PolarHBondContact OE2-CD2 3.38Å; E301-H319 IonicContact OE2-CG 2.99Å
302	C	89	Confident	87.3	Confident	56 Å²	56	76.4 Å²	76.4	38%	0.378	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.2	5.9	-177.4	74.1	0	0	0	0	114.8	C299 K304 H315	C299-C302 VanDerWaalsContact SG-SG 3.62Å; C302-K304 PolarHBondContact O-N 3.17Å; C302-H315 PolarHBondContact SG-NE2 3.09Å
303	G	86.8	Confident	87.6	Confident	58 Å²	58	77.6 Å²	77.6	60%	0.598	42%	0.421	S	S	*	.			trans	69	-3.9	179.6	0	0	0	0	0	115.7	C299 A305	C299-G303 WeakPolarHBondContact O-CA 3.4Å; C299-G303 PolarHBondContact O-N 3.44Å; G303-A305 PolarHBondContact O-N 3.19Å
304	K	88.7	Confident	87.9	Confident	130 Å²	130	78.6 Å²	78.6	57%	0.565	41%	0.414	S	S	*	.			trans	-65.9	131.3	-178.9	-74.4	-178.2	-179.6	174.1	0	111.3	C299 C302 F306	C299-K304 WeakPolarHBondContact CB-O 3.45Å; C299-K304 PolarHBondContact N-O 2.78Å; C302-K304 PolarHBondContact O-N 3.17Å; K304-F306 HydrophobicContact CB-CE2 3.96Å; K304-F306 HydrophobicContact CB-CZ 4.14Å; K304-F306 WeakPolarHBondContact O-CE2 3.3Å
305	A	89.9	Confident	88.3	Confident	31 Å²	31	73.9 Å²	73.9	26%	0.256	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	142.5	-179	0	0	0	0	0	112.2	K295 Y297 K298 G303	K295-A305 HydrophobicContact CB-CB 3.53Å; K295-A305 HydrophobicContact CD-CB 4.1Å; K295-A305 WeakPolarHBondContact CD-O 3.19Å; K295-A305 HydrophobicContact CG-CB 4.41Å; Y297-A305 CarbonylContact O-C 3.27Å; Y297-A305 WeakPolarHBondContact O-CA 3.48Å; K298-A305 HydrophobicContact CG-CB 3.96Å; G303-A305 PolarHBondContact O-N 3.19Å
306	F	88.3	Confident	88.4	Confident	43 Å²	43	72.7 Å²	72.7	19%	0.189	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	150.9	-177	-58.6	-91	0	0	0	111.2	K295 Y297 C299 K304 L312 H315	K295-F306 CarbonylContact C-O 3.23Å; K295-F306 VanDerWaalsContact C-O 3.3Å; K295-F306 VanDerWaalsContact CA-O 3.27Å; K295-F306 WeakPolarHBondContact CA-O 3.45Å; Y297-F306 PolarHBondContact N-O 3.32Å; Y297-F306 PolarHBondContact O-N 3.48Å; C299-F306 HydrophobicContact CB-CE2 4.45Å; K304-F306 HydrophobicContact CB-CE2 3.96Å; K304-F306 HydrophobicContact CB-CZ 4.14Å; K304-F306 WeakPolarHBondContact O-CE2 3.3Å; F306-L312 HydrophobicContact CB-CB 4.4Å; F306-L312 HydrophobicContact CD2-CB 3.97Å; F306-L312 HydrophobicContact CD2-CD1 3.82Å; F306-L312 HydrophobicContact CE2-CD1 3.98Å; F306-L312 HydrophobicContact CG-CB 4.35Å; F306-H315 HydrophobicContact CE1-CB 4.04Å; F306-H315 HydrophobicContact CE2-CB 3.87Å; F306-H315 AromaticContact CE2-CD2 3.47Å; F306-H315 VanDerWaalsContact CE2-CD2 3.47Å; F306-H315 WeakPolarHBondContact CE2-CD2 3.24Å; F306-H315 AromaticContact CE2-CG 3.65Å; F306-H315 HydrophobicContact CZ-CB 3.45Å; F306-H315 VanDerWaalsContact CZ-CB 3.45Å; F306-H315 AromaticContact CZ-CD2 3.55Å; F306-H315 AromaticContact CZ-CG 3.25Å; F306-H315 AromaticContact CZ-ND1 3.73Å
307	I	86.3	Confident	88.4	Confident	30 Å²	30	70 Å²	70	15%	0.154	37%	0.368	C	S	.	.	S	Bend	trans	-76.1	-31	177.8	-58.4	176.5	0	0	0	111	K289 I290 K295 Y297	K289-I307 HydrophobicContact CB-CG2 3.78Å; K289-I307 HydrophobicContact CD-CG2 4.48Å; I290-I307 HydrophobicContact CG1-CD1 4.38Å; K295-I307 HydrophobicContact CG-CG1 3.82Å; Y297-I307 WeakPolarHBondContact CD2-O 3.34Å; Y297-I307 VanDerWaalsContact CE2-O 3.24Å; Y297-I307 WeakPolarHBondContact CE2-O 3.43Å
308	W	87.4	Confident	88.2	Confident	112 Å²	112	70.7 Å²	70.7	42%	0.424	38%	0.377	S	S	.	.	S	Bend	trans	-122.7	144.4	-177.1	-56.1	-64.6	0	0	0	112.1	I290 Y297 A310 S311 L312	I290-W308 HydrophobicContact CD1-CH2 4.24Å; I290-W308 HydrophobicContact CD1-CZ2 4.19Å; I290-W308 HydrophobicContact CG1-CZ2 4.31Å; Y297-W308 VanDerWaalsContact CD2-C 3.4Å; W308-A310 VanDerWaalsContact C-N 3.35Å; W308-A310 PolarHBondContact O-N 3.14Å; W308-S311 PolarHBondContact O-N 2.81Å; W308-L312 PolarHBondContact O-N 2.91Å
309	S	88.1	Confident	88.1	Confident	68 Å²	68	67.5 Å²	67.5	48%	0.476	36%	0.364	S	S	.	.	H	α-helix	trans	-64.4	-36.8	177.7	57.6	0	0	0	0	113	S311 L312 N313	S309-S311 VanDerWaalsContact C-N 3.29Å; S309-S311 PolarHBondContact O-N 3.27Å; S309-L312 WeakPolarHBondContact O-CB 3.21Å; S309-L312 PolarHBondContact O-N 3.15Å; S309-N313 PolarHBondContact O-N 2.8Å
310	A	86.8	Confident	87.7	Confident	70 Å²	70	71 Å²	71	58%	0.579	39%	0.385	S	S	*	.	H	α-helix	trans	-60	-40.3	176.9	0	0	0	0	0	111.8	W308 N313 E314	W308-A310 VanDerWaalsContact C-N 3.35Å; W308-A310 PolarHBondContact O-N 3.14Å; A310-N313 PolarHBondContact O-N 3.43Å; A310-E314 WeakPolarHBondContact O-CB 3.44Å; A310-E314 PolarHBondContact O-N 3.31Å
311	S	88.1	Confident	87.4	Confident	36 Å²	36	65 Å²	65	25%	0.252	37%	0.37	S	S	.	.	H	α-helix	trans	-67.3	-37.4	176.2	-54.8	0	0	0	0	112.2	W308 S309 H315	W308-S311 PolarHBondContact O-N 2.81Å; S309-S311 VanDerWaalsContact C-N 3.29Å; S309-S311 PolarHBondContact O-N 3.27Å; S311-H315 VanDerWaalsContact O-CB 3.25Å; S311-H315 WeakPolarHBondContact O-CB 3.27Å; S311-H315 PolarHBondContact O-N 3.18Å
312	L	89.9	Confident	87.3	Confident	22 Å²	22	64.4 Å²	64.4	12%	0.115	37%	0.368	C	S	.	.	H	α-helix	trans	-63.7	-43.7	171.8	173.4	63.4	0	0	0	111	K298 C299 F306 W308 S309 H315 K316	K298-L312 WeakPolarHBondContact O-CD2 3.48Å; C299-L312 HydrophobicContact CB-CD1 3.64Å; F306-L312 HydrophobicContact CB-CB 4.4Å; F306-L312 HydrophobicContact CD2-CB 3.97Å; F306-L312 HydrophobicContact CD2-CD1 3.82Å; F306-L312 HydrophobicContact CE2-CD1 3.98Å; F306-L312 HydrophobicContact CG-CB 4.35Å; W308-L312 PolarHBondContact O-N 2.91Å; S309-L312 WeakPolarHBondContact O-CB 3.21Å; S309-L312 PolarHBondContact O-N 3.15Å; L312-H315 WeakPolarHBondContact O-CB 3.22Å; L312-H315 PolarHBondContact O-N 3.48Å; L312-K316 HydrophobicContact CD1-CG 4.49Å; L312-K316 WeakPolarHBondContact O-CG 3.36Å; L312-K316 PolarHBondContact O-N 3.26Å
313	N	87.6	Confident	87.2	Confident	104 Å²	104	67.4 Å²	67.4	56%	0.556	37%	0.374	S	S	*	.	H	α-helix	trans	-64.6	-43	-179.8	-160.8	69.4	0	0	0	111.9	S309 A310 H315 K316 N317	S309-N313 PolarHBondContact O-N 2.8Å; A310-N313 PolarHBondContact O-N 3.43Å; N313-H315 VanDerWaalsContact C-N 3.29Å; N313-H315 PolarHBondContact O-N 3.16Å; N313-K316 PolarHBondContact O-N 2.9Å; N313-N317 PolarHBondContact O-OD1 3.35Å
314	E	87.2	Confident	87.3	Confident	65 Å²	65	68.1 Å²	68.1	30%	0.304	37%	0.369	S	S	.	.	H	α-helix	trans	-62.9	-36.7	173	-176.1	176.2	-148.7	0	0	112.1	A310 N317 Q336	A310-E314 WeakPolarHBondContact O-CB 3.44Å; A310-E314 PolarHBondContact O-N 3.31Å; E314-N317 WeakPolarHBondContact O-CB 3.4Å; E314-N317 PolarHBondContact O-N 2.86Å; E314-Q336 VanDerWaalsContact CD-NE2 3.3Å; E314-Q336 HydrophobicContact CG-CG 3.73Å; E314-Q336 VanDerWaalsContact OE1-CB 3.24Å; E314-Q336 WeakPolarHBondContact OE1-CB 3.48Å; E314-Q336 WeakPolarHBondContact OE1-CG 3.47Å; E314-Q336 PolarHBondContact OE1-NE2 3.27Å; E314-Q336 VanDerWaalsContact OE1-NE2 3.12Å; E314-Q336 PolarHBondContact OE1-OE1 3.17Å
315	H	88.7	Confident	87.3	Confident	18 Å²	18	66.4 Å²	66.4	8%	0.083	36%	0.359	C	S	.	.	H	α-helix	trans	-66.2	-38.7	175	172.8	66.1	0	0	0	112.6	C302 F306 S311 L312 N313 N317 I318 H319	C302-H315 PolarHBondContact SG-NE2 3.09Å; F306-H315 HydrophobicContact CE1-CB 4.04Å; F306-H315 HydrophobicContact CE2-CB 3.87Å; F306-H315 AromaticContact CE2-CD2 3.47Å; F306-H315 VanDerWaalsContact CE2-CD2 3.47Å; F306-H315 WeakPolarHBondContact CE2-CD2 3.24Å; F306-H315 AromaticContact CE2-CG 3.65Å; F306-H315 HydrophobicContact CZ-CB 3.45Å; F306-H315 VanDerWaalsContact CZ-CB 3.45Å; F306-H315 AromaticContact CZ-CD2 3.55Å; F306-H315 AromaticContact CZ-CG 3.25Å; F306-H315 AromaticContact CZ-ND1 3.73Å; S311-H315 VanDerWaalsContact O-CB 3.25Å; S311-H315 WeakPolarHBondContact O-CB 3.27Å; S311-H315 PolarHBondContact O-N 3.18Å; L312-H315 WeakPolarHBondContact O-CB 3.22Å; L312-H315 PolarHBondContact O-N 3.48Å; N313-H315 VanDerWaalsContact C-N 3.29Å; N313-H315 PolarHBondContact O-N 3.16Å; H315-N317 PolarHBondContact O-N 3.47Å; H315-I318 VanDerWaalsContact O-CB 3.26Å; H315-I318 WeakPolarHBondContact O-CB 2.88Å; H315-I318 WeakPolarHBondContact O-CG1 3.47Å; H315-I318 PolarHBondContact O-N 3.4Å; H315-H319 AromaticContact CD2-NE2 3.85Å; H315-H319 AromaticContact CE1-NE2 3.64Å; H315-H319 AromaticContact NE2-CE1 3.82Å; H315-H319 AromaticContact NE2-NE2 3.09Å; H315-H319 PolarHBondContact NE2-NE2 2.92Å
316	K	87.5	Confident	87.2	Confident	88 Å²	88	71.9 Å²	71.9	38%	0.383	38%	0.377	S	S	.	.	H	α-helix	trans	-57.8	-31.6	177.9	-76.2	-177.9	174	-166.9	0	112.9	L312 N313 I318 H319 T320	L312-K316 HydrophobicContact CD1-CG 4.49Å; L312-K316 WeakPolarHBondContact O-CG 3.36Å; L312-K316 PolarHBondContact O-N 3.26Å; N313-K316 PolarHBondContact O-N 2.9Å; K316-I318 PolarHBondContact O-N 3.18Å; K316-H319 PolarHBondContact O-N 3.47Å; K316-T320 PolarHBondContact O-N 3.26Å; K316-T320 VanDerWaalsContact O-N 3.15Å; K316-T320 PolarHBondContact O-OG1 3.23Å
317	N	88.1	Confident	87.2	Confident	16 Å²	16	70 Å²	70	9%	0.086	37%	0.369	C	S	.	.	H	α-helix	trans	-58.3	-21.7	174.9	-62.1	-12.1	0	0	0	113.4	N313 E314 H315 T320 G321 E322 N335	N313-N317 PolarHBondContact O-OD1 3.35Å; E314-N317 WeakPolarHBondContact O-CB 3.4Å; E314-N317 PolarHBondContact O-N 2.86Å; H315-N317 PolarHBondContact O-N 3.47Å; N317-T320 WeakPolarHBondContact CA-OG1 3.41Å; N317-G321 CarbonylContact O-C 3.21Å; N317-G321 WeakPolarHBondContact O-CA 3.29Å; N317-G321 PolarHBondContact O-N 2.89Å; N317-E322 PolarHBondContact O-N 3.4Å; N317-N335 HydrophobicContact CB-CB 4.04Å; N317-N335 PolarHBondContact ND2-O 2.92Å
318	I	85.8	Confident	87.3	Confident	98 Å²	98	77.9 Å²	77.9	50%	0.503	40%	0.403	S	S	.	.	H	α-helix	trans	-71	-39	176.6	-60.3	174.7	0	0	0	110.6	H315 K316	H315-I318 VanDerWaalsContact O-CB 3.26Å; H315-I318 WeakPolarHBondContact O-CB 2.88Å; H315-I318 WeakPolarHBondContact O-CG1 3.47Å; H315-I318 PolarHBondContact O-N 3.4Å; K316-I318 PolarHBondContact O-N 3.18Å
319	H	86.2	Confident	87.1	Confident	68 Å²	68	78.9 Å²	78.9	32%	0.315	41%	0.412	S	S	.	.	H	α-helix	trans	-82.2	-40.8	-177.2	-53.9	-54.2	0	0	0	112.3	C299 E301 H315 K316 G321	C299-H319 PolarHBondContact SG-NE2 3.03Å; C299-H319 VanDerWaalsContact SG-NE2 3.36Å; E301-H319 WeakPolarHBondContact OE2-CB 3.41Å; E301-H319 IonicContact OE2-CD2 3.43Å; E301-H319 PolarHBondContact OE2-CD2 3.38Å; E301-H319 IonicContact OE2-CG 2.99Å; H315-H319 AromaticContact CD2-NE2 3.85Å; H315-H319 AromaticContact CE1-NE2 3.64Å; H315-H319 AromaticContact NE2-CE1 3.82Å; H315-H319 AromaticContact NE2-NE2 3.09Å; H315-H319 PolarHBondContact NE2-NE2 2.92Å; K316-H319 PolarHBondContact O-N 3.47Å; H319-G321 PolarHBondContact O-N 2.83Å
320	T	84.9	Confident	87	Confident	76 Å²	76	78.3 Å²	78.3	47%	0.466	41%	0.407	S	S	.	.	H	α-helix	trans	-72.4	-14.7	176	61.7	0	0	0	0	112.6	K316 N317 E322	K316-T320 PolarHBondContact O-N 3.26Å; K316-T320 VanDerWaalsContact O-N 3.15Å; K316-T320 PolarHBondContact O-OG1 3.23Å; N317-T320 WeakPolarHBondContact CA-OG1 3.41Å; T320-E322 PolarHBondContact O-N 2.63Å; T320-E322 VanDerWaalsContact O-N 3.15Å; T320-E322 WeakPolarHBondContact OG1-CB 3.44Å; T320-E322 WeakPolarHBondContact OG1-CG 3.37Å; T320-E322 PolarHBondContact OG1-N 3.1Å
321	G	84.1	Confident	87	Confident	49 Å²	49	77.6 Å²	77.6	51%	0.505	41%	0.407	S	S	.	.			trans	66.9	6.6	-172.3	0	0	0	0	0	113.5	N317 H319 K323	N317-G321 CarbonylContact O-C 3.21Å; N317-G321 WeakPolarHBondContact O-CA 3.29Å; N317-G321 PolarHBondContact O-N 2.89Å; H319-G321 PolarHBondContact O-N 2.83Å; G321-K323 PolarHBondContact O-N 3.3Å
322	E	84.4	Confident	86.9	Confident	115 Å²	115	82.1 Å²	82.1	54%	0.537	42%	0.422	S	S	.	.			trans	-62.6	132	-179.5	-75.2	-174.6	168.5	0	0	110.8	N317 T320 P324	N317-E322 PolarHBondContact O-N 3.4Å; T320-E322 PolarHBondContact O-N 2.63Å; T320-E322 VanDerWaalsContact O-N 3.15Å; T320-E322 WeakPolarHBondContact OG1-CB 3.44Å; T320-E322 WeakPolarHBondContact OG1-CG 3.37Å; T320-E322 PolarHBondContact OG1-N 3.1Å; E322-P324 WeakPolarHBondContact O-CD 3.32Å
323	K	87.4	Confident	86.8	Confident	118 Å²	118	82.5 Å²	82.5	51%	0.513	43%	0.428	S	S	.	.			trans	-123.8	77.3	176.1	-66.2	177.5	-175.7	178.9	0	109.5	G321 Y325 A333 F334 N335	G321-K323 PolarHBondContact O-N 3.3Å; K323-Y325 PolarHBondContact O-N 3.26Å; K323-Y325 VanDerWaalsContact O-N 3.17Å; K323-A333 HydrophobicContact CB-CB 3.45Å; K323-A333 VanDerWaalsContact CB-CB 3.45Å; K323-A333 HydrophobicContact CD-CB 4.1Å; K323-A333 WeakPolarHBondContact CD-O 2.99Å; K323-A333 HydrophobicContact CG-CB 4.41Å; K323-F334 CarbonylContact C-O 3.56Å; K323-F334 VanDerWaalsContact C-O 3.23Å; K323-F334 VanDerWaalsContact CA-O 3.25Å; K323-F334 WeakPolarHBondContact CA-O 3.25Å; K323-N335 HydrophobicContact CG-CB 4.49Å
324	P	87	Confident	86.7	Confident	74 Å²	74	79.7 Å²	79.7	48%	0.481	41%	0.411	S	S	.	.			trans	-63.6	-24.2	-172.9	-22.1	34	0	0	0	113.2	E322 K326	E322-P324 WeakPolarHBondContact O-CD 3.32Å; P324-K326 PolarHBondContact O-N 2.81Å
325	Y	88.9	Confident	86.6	Confident	93 Å²	93	79.1 Å²	79.1	37%	0.365	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	92.5	-171.1	-56.1	-75.5	0	0	0	110.8	K323 A333 F334	K323-Y325 PolarHBondContact O-N 3.26Å; K323-Y325 VanDerWaalsContact O-N 3.17Å; Y325-A333 CarbonylContact O-C 3.37Å; Y325-A333 WeakPolarHBondContact O-CA 3.44Å; Y325-F334 WeakPolarHBondContact CB-O 3.17Å; Y325-F334 PolarHBondContact N-O 3.37Å; Y325-F334 VanDerWaalsContact N-O 3.11Å; Y325-F334 PolarHBondContact O-N 3.06Å
326	K	88.5	Confident	86.4	Confident	146 Å²	146	81.5 Å²	81.5	64%	0.635	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.9	134.7	179.2	-62.5	-177.2	-179.2	179.3	0	112.3	P324 A333	P324-K326 PolarHBondContact O-N 2.81Å; K326-A333 HydrophobicContact CG-CB 3.91Å
327	C	89.2	Confident	86.3	Confident	4 Å²	4	79.9 Å²	79.9	3%	0.027	42%	0.421	C	S	.	.			trans	-74.9	125.5	168.6	-176.7	0	0	0	0	109.5	E329 C330 G331 K332 L340 H347	C327-E329 VanDerWaalsContact C-N 3.32Å; C327-C330 VanDerWaalsContact SG-SG 3.66Å; C327-G331 WeakPolarHBondContact O-CA 3.35Å; C327-G331 PolarHBondContact O-N 3.38Å; C327-K332 VanDerWaalsContact CB-O 3.29Å; C327-K332 WeakPolarHBondContact CB-O 3.41Å; C327-K332 PolarHBondContact N-O 2.83Å; C327-L340 HydrophobicContact CB-CD1 3.74Å; C327-H347 PolarHBondContact SG-NE2 3.32Å; C327-H347 VanDerWaalsContact SG-NE2 3.4Å
328	K	86.6	Confident	86.2	Confident	196 Å²	196	81.6 Å²	81.6	85%	0.852	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-27.7	179.2	-66.2	-171.6	176.5	-172.8	0	112.7
329	E	84.9	Confident	86.1	Confident	132 Å²	132	77.8 Å²	77.8	62%	0.617	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-36.6	-174.3	-69	158.3	176.2	0	0	112.8	C327 H347	C327-E329 VanDerWaalsContact C-N 3.32Å; E329-H347 WeakPolarHBondContact OE2-CB 3.44Å; E329-H347 IonicContact OE2-CD2 3.92Å; E329-H347 PolarHBondContact OE2-CD2 2.9Å; E329-H347 IonicContact OE2-CG 3.15Å; E329-H347 IonicContact OE2-NE2 3.42Å
330	C	86.3	Confident	86	Confident	56 Å²	56	75.3 Å²	75.3	38%	0.378	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.5	5.6	-176.2	74	0	0	0	0	114.7	C327 K332 H343 H347	C327-C330 VanDerWaalsContact SG-SG 3.66Å; C330-K332 PolarHBondContact O-N 3.02Å; C330-H343 PolarHBondContact SG-NE2 2.81Å; C330-H347 PolarHBondContact SG-NE2 3.45Å
331	G	84.8	Confident	85.9	Confident	55 Å²	55	77.4 Å²	77.4	57%	0.567	42%	0.416	S	S	*	.			trans	70.8	-8.2	179.5	0	0	0	0	0	115.8	C327 A333	C327-G331 WeakPolarHBondContact O-CA 3.35Å; C327-G331 PolarHBondContact O-N 3.38Å; G331-A333 PolarHBondContact O-N 2.97Å
332	K	86.3	Confident	85.7	Confident	131 Å²	131	78.5 Å²	78.5	57%	0.57	41%	0.409	S	S	*	.			trans	-61.3	131	-179.8	-75.6	-178	178.3	175.8	0	111.3	C327 C330 F334	C327-K332 VanDerWaalsContact CB-O 3.29Å; C327-K332 WeakPolarHBondContact CB-O 3.41Å; C327-K332 PolarHBondContact N-O 2.83Å; C330-K332 PolarHBondContact O-N 3.02Å; K332-F334 HydrophobicContact CB-CE2 4.04Å; K332-F334 HydrophobicContact CB-CZ 4.17Å; K332-F334 WeakPolarHBondContact O-CE2 3.49Å
333	A	88.3	Confident	85.6	Confident	31 Å²	31	73.8 Å²	73.8	26%	0.256	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	146.5	-178.5	0	0	0	0	0	111.6	K323 Y325 K326 G331	K323-A333 HydrophobicContact CB-CB 3.45Å; K323-A333 VanDerWaalsContact CB-CB 3.45Å; K323-A333 HydrophobicContact CD-CB 4.1Å; K323-A333 WeakPolarHBondContact CD-O 2.99Å; K323-A333 HydrophobicContact CG-CB 4.41Å; Y325-A333 CarbonylContact O-C 3.37Å; Y325-A333 WeakPolarHBondContact O-CA 3.44Å; K326-A333 HydrophobicContact CG-CB 3.91Å; G331-A333 PolarHBondContact O-N 2.97Å
334	F	86.6	Confident	85.3	Confident	44 Å²	44	73.6 Å²	73.6	19%	0.193	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	147.4	179.8	-58.3	-90.3	0	0	0	110.3	K323 Y325 K332 Q336 L340 H343	K323-F334 CarbonylContact C-O 3.56Å; K323-F334 VanDerWaalsContact C-O 3.23Å; K323-F334 VanDerWaalsContact CA-O 3.25Å; K323-F334 WeakPolarHBondContact CA-O 3.25Å; Y325-F334 WeakPolarHBondContact CB-O 3.17Å; Y325-F334 PolarHBondContact N-O 3.37Å; Y325-F334 VanDerWaalsContact N-O 3.11Å; Y325-F334 PolarHBondContact O-N 3.06Å; K332-F334 HydrophobicContact CB-CE2 4.04Å; K332-F334 HydrophobicContact CB-CZ 4.17Å; K332-F334 WeakPolarHBondContact O-CE2 3.49Å; F334-Q336 VanDerWaalsContact C-N 3.32Å; F334-L340 HydrophobicContact CB-CB 4.45Å; F334-L340 HydrophobicContact CD2-CB 3.94Å; F334-L340 HydrophobicContact CD2-CD1 3.93Å; F334-L340 HydrophobicContact CE2-CD1 4.11Å; F334-L340 HydrophobicContact CG-CB 4.38Å; F334-H343 HydrophobicContact CD2-CB 4.5Å; F334-H343 HydrophobicContact CE1-CB 3.91Å; F334-H343 HydrophobicContact CE2-CB 3.61Å; F334-H343 AromaticContact CE2-CD2 3.45Å; F334-H343 VanDerWaalsContact CE2-CD2 3.45Å; F334-H343 WeakPolarHBondContact CE2-CD2 3.4Å; F334-H343 AromaticContact CE2-CG 3.52Å; F334-H343 HydrophobicContact CZ-CB 3.27Å; F334-H343 AromaticContact CZ-CD2 3.54Å; F334-H343 AromaticContact CZ-CG 3.16Å; F334-H343 AromaticContact CZ-ND1 3.65Å
335	N	84.6	Confident	84.9	Confident	54 Å²	54	71 Å²	71	29%	0.289	37%	0.367	S	S	.	.	S	Bend	trans	-79.7	-15.6	175.4	57.8	-6.2	0	0	0	113	N317 K323	N317-N335 HydrophobicContact CB-CB 4.04Å; N317-N335 PolarHBondContact ND2-O 2.92Å; K323-N335 HydrophobicContact CG-CB 4.49Å
336	Q	84.9	Confident	84.3	Confident	67 Å²	67	71 Å²	71	31%	0.313	37%	0.372	S	S	.	.	S	Bend	trans	-129.2	143.7	-180	-54.6	-169	-24.8	0	0	111.1	E314 F334 S338 G339 L340	E314-Q336 VanDerWaalsContact CD-NE2 3.3Å; E314-Q336 HydrophobicContact CG-CG 3.73Å; E314-Q336 VanDerWaalsContact OE1-CB 3.24Å; E314-Q336 WeakPolarHBondContact OE1-CB 3.48Å; E314-Q336 WeakPolarHBondContact OE1-CG 3.47Å; E314-Q336 PolarHBondContact OE1-NE2 3.27Å; E314-Q336 VanDerWaalsContact OE1-NE2 3.12Å; E314-Q336 PolarHBondContact OE1-OE1 3.17Å; F334-Q336 VanDerWaalsContact C-N 3.32Å; Q336-S338 VanDerWaalsContact C-N 3.35Å; Q336-S338 PolarHBondContact O-N 2.93Å; Q336-G339 PolarHBondContact O-N 3.39Å; Q336-L340 PolarHBondContact O-N 3.3Å
337	S	85.6	Confident	83.7	Confident	55 Å²	55	67.3 Å²	67.3	39%	0.385	36%	0.357	S	S	.	.	H	α-helix	trans	-66.6	-36.8	179.4	62.8	0	0	0	0	112.4	G339 L340 I341	S337-G339 VanDerWaalsContact C-N 3.28Å; S337-G339 PolarHBondContact O-N 3.15Å; S337-L340 PolarHBondContact O-N 2.93Å; S337-L340 VanDerWaalsContact O-N 3.16Å; S337-I341 WeakPolarHBondContact O-CG1 3.34Å; S337-I341 PolarHBondContact O-N 3.28Å
338	S	84.6	Confident	82.7	Confident	51 Å²	51	69.6 Å²	69.6	36%	0.357	37%	0.373	S	S	.	.	H	α-helix	trans	-57.6	-41.7	173.8	57.4	0	0	0	0	111.4	Q336 L340 I341 I342	Q336-S338 VanDerWaalsContact C-N 3.35Å; Q336-S338 PolarHBondContact O-N 2.93Å; S338-L340 VanDerWaalsContact C-N 3.35Å; S338-L340 PolarHBondContact O-N 3.18Å; S338-I341 PolarHBondContact O-N 3.27Å; S338-I342 WeakPolarHBondContact O-CB 3.49Å; S338-I342 VanDerWaalsContact O-CG1 3.25Å; S338-I342 WeakPolarHBondContact O-CG1 3.19Å; S338-I342 PolarHBondContact O-N 2.94Å
339	G	84.3	Confident	81.4	Confident	19 Å²	19	69.2 Å²	69.2	20%	0.196	37%	0.374	C	S	.	.	H	α-helix	trans	-60.1	-42.2	175.3	0	0	0	0	0	112.5	Q336 S337 H343	Q336-G339 PolarHBondContact O-N 3.39Å; S337-G339 VanDerWaalsContact C-N 3.28Å; S337-G339 PolarHBondContact O-N 3.15Å; G339-H343 VanDerWaalsContact O-CB 3.26Å; G339-H343 WeakPolarHBondContact O-CB 3.39Å; G339-H343 PolarHBondContact O-N 2.89Å
340	L	84.9	Confident	80.4	Confident	16 Å²	16	68.9 Å²	68.9	8%	0.084	37%	0.373	C	S	.	.	H	α-helix	trans	-66.6	-42.8	175.2	175.7	62.2	0	0	0	112.1	C327 F334 Q336 S337 S338 H343 R344	C327-L340 HydrophobicContact CB-CD1 3.74Å; F334-L340 HydrophobicContact CB-CB 4.45Å; F334-L340 HydrophobicContact CD2-CB 3.94Å; F334-L340 HydrophobicContact CD2-CD1 3.93Å; F334-L340 HydrophobicContact CE2-CD1 4.11Å; F334-L340 HydrophobicContact CG-CB 4.38Å; Q336-L340 PolarHBondContact O-N 3.3Å; S337-L340 PolarHBondContact O-N 2.93Å; S337-L340 VanDerWaalsContact O-N 3.16Å; S338-L340 VanDerWaalsContact C-N 3.35Å; S338-L340 PolarHBondContact O-N 3.18Å; L340-H343 PolarHBondContact O-N 3.42Å; L340-R344 HydrophobicContact CD1-CG 4.33Å; L340-R344 WeakPolarHBondContact O-CG 3.48Å; L340-R344 PolarHBondContact O-N 3.03Å
341	I	82.9	Confident	79.4	Confident	119 Å²	119	72 Å²	72	61%	0.61	38%	0.38	S	S	*	.	H	α-helix	trans	-60.9	-47	177.5	-67.4	168.3	0	0	0	110.3	S337 S338 H343 R344 S345	S337-I341 WeakPolarHBondContact O-CG1 3.34Å; S337-I341 PolarHBondContact O-N 3.28Å; S338-I341 PolarHBondContact O-N 3.27Å; I341-H343 VanDerWaalsContact C-N 3.26Å; I341-H343 PolarHBondContact O-N 3.47Å; I341-R344 PolarHBondContact O-N 3.02Å; I341-S345 PolarHBondContact O-N 3.07Å
342	I	78.9	Confident	78.6	Confident	72 Å²	72	74.8 Å²	74.8	37%	0.369	38%	0.381	S	S	.	.	H	α-helix	trans	-64.2	-33.6	176.4	-67.9	167.2	0	0	0	111.2	S338 S345 R364	S338-I342 WeakPolarHBondContact O-CB 3.49Å; S338-I342 VanDerWaalsContact O-CG1 3.25Å; S338-I342 WeakPolarHBondContact O-CG1 3.19Å; S338-I342 PolarHBondContact O-N 2.94Å; I342-S345 PolarHBondContact O-OG 3.41Å; I342-R364 HydrophobicContact CG2-CG 4.35Å
343	H	83.1	Confident	78.1	Confident	16 Å²	16	72.9 Å²	72.9	7%	0.074	37%	0.371	C	S	.	.	H	α-helix	trans	-71.7	-37.6	177.1	177.3	64.1	0	0	0	112.5	C330 F334 G339 L340 I341 S345 I346 H347	C330-H343 PolarHBondContact SG-NE2 2.81Å; F334-H343 HydrophobicContact CD2-CB 4.5Å; F334-H343 HydrophobicContact CE1-CB 3.91Å; F334-H343 HydrophobicContact CE2-CB 3.61Å; F334-H343 AromaticContact CE2-CD2 3.45Å; F334-H343 VanDerWaalsContact CE2-CD2 3.45Å; F334-H343 WeakPolarHBondContact CE2-CD2 3.4Å; F334-H343 AromaticContact CE2-CG 3.52Å; F334-H343 HydrophobicContact CZ-CB 3.27Å; F334-H343 AromaticContact CZ-CD2 3.54Å; F334-H343 AromaticContact CZ-CG 3.16Å; F334-H343 AromaticContact CZ-ND1 3.65Å; G339-H343 VanDerWaalsContact O-CB 3.26Å; G339-H343 WeakPolarHBondContact O-CB 3.39Å; G339-H343 PolarHBondContact O-N 2.89Å; L340-H343 PolarHBondContact O-N 3.42Å; I341-H343 VanDerWaalsContact C-N 3.26Å; I341-H343 PolarHBondContact O-N 3.47Å; H343-S345 PolarHBondContact O-N 3.08Å; H343-I346 VanDerWaalsContact O-CB 3.27Å; H343-I346 WeakPolarHBondContact O-CB 3.46Å; H343-I346 WeakPolarHBondContact O-CG1 3.25Å; H343-I346 PolarHBondContact O-N 2.78Å; H343-H347 AromaticContact CD2-NE2 3.73Å; H343-H347 AromaticContact CE1-NE2 3.69Å; H343-H347 AromaticContact NE2-CD2 3.93Å; H343-H347 AromaticContact NE2-CE1 3.85Å; H343-H347 AromaticContact NE2-NE2 3.04Å; H343-H347 PolarHBondContact NE2-NE2 3.38Å
344	R	80.6	Confident	77.7	Confident	114 Å²	114	78 Å²	78	43%	0.43	39%	0.387	S	S	.	.	H	α-helix	trans	-61.1	-24.8	175.8	-75.8	-179.2	-179	-175	1	113	L340 I341 I346 H347 S348	L340-R344 HydrophobicContact CD1-CG 4.33Å; L340-R344 WeakPolarHBondContact O-CG 3.48Å; L340-R344 PolarHBondContact O-N 3.03Å; I341-R344 PolarHBondContact O-N 3.02Å; R344-I346 PolarHBondContact O-N 3.29Å; R344-H347 PolarHBondContact O-N 3.38Å; R344-S348 PolarHBondContact O-N 2.92Å; R344-S348 VanDerWaalsContact O-N 3.14Å; R344-S348 PolarHBondContact O-OG 3.46Å
345	S	77.3	Confident	77.6	Confident	19 Å²	19	75.9 Å²	75.9	13%	0.133	38%	0.379	C	S	.	.	H	α-helix	trans	-70	-3.5	172.9	78.8	0	0	0	0	114.4	I341 I342 H343 S348 T363	I341-S345 PolarHBondContact O-N 3.07Å; I342-S345 PolarHBondContact O-OG 3.41Å; H343-S345 PolarHBondContact O-N 3.08Å; S345-S348 WeakPolarHBondContact CA-OG 3.44Å; S345-S348 VanDerWaalsContact O-O 3.08Å; S345-T363 PolarHBondContact OG-O 2.89Å
346	I	76.7	Confident	77.6	Confident	93 Å²	93	81.4 Å²	81.4	48%	0.477	40%	0.402	S	S	.	.	H	α-helix	trans	-87.8	-35.6	171.9	-56.4	177	0	0	0	110.7	H343 R344	H343-I346 VanDerWaalsContact O-CB 3.27Å; H343-I346 WeakPolarHBondContact O-CB 3.46Å; H343-I346 WeakPolarHBondContact O-CG1 3.25Å; H343-I346 PolarHBondContact O-N 2.78Å; R344-I346 PolarHBondContact O-N 3.29Å
347	H	76.1	Confident	77.5	Confident	69 Å²	69	84.6 Å²	84.6	32%	0.319	42%	0.417	S	S	.	.	H	α-helix	trans	-81.2	-28.9	179.4	-59.3	-53.2	0	0	0	112.6	C327 E329 C330 H343 R344 E349	C327-H347 PolarHBondContact SG-NE2 3.32Å; C327-H347 VanDerWaalsContact SG-NE2 3.4Å; E329-H347 WeakPolarHBondContact OE2-CB 3.44Å; E329-H347 IonicContact OE2-CD2 3.92Å; E329-H347 PolarHBondContact OE2-CD2 2.9Å; E329-H347 IonicContact OE2-CG 3.15Å; E329-H347 IonicContact OE2-NE2 3.42Å; C330-H347 PolarHBondContact SG-NE2 3.45Å; H343-H347 AromaticContact CD2-NE2 3.73Å; H343-H347 AromaticContact CE1-NE2 3.69Å; H343-H347 AromaticContact NE2-CD2 3.93Å; H343-H347 AromaticContact NE2-CE1 3.85Å; H343-H347 AromaticContact NE2-NE2 3.04Å; H343-H347 PolarHBondContact NE2-NE2 3.38Å; R344-H347 PolarHBondContact O-N 3.38Å; H347-E349 PolarHBondContact O-N 3.27Å
348	S	68.6	Low	77.4	Confident	53 Å²	53	84.4 Å²	84.4	37%	0.371	42%	0.415	S	S	.	.	S	Bend	trans	-81.8	110.2	165.1	37.5	0	0	0	0	107.6	R344 S345 Q350	R344-S348 PolarHBondContact O-N 2.92Å; R344-S348 VanDerWaalsContact O-N 3.14Å; R344-S348 PolarHBondContact O-OG 3.46Å; S345-S348 WeakPolarHBondContact CA-OG 3.44Å; S345-S348 VanDerWaalsContact O-O 3.08Å; S348-Q350 PolarHBondContact O-N 3.16Å
349	E	59.7	Low	77.2	Confident	187 Å²	187	84.8 Å²	84.8	87%	0.874	43%	0.427	S	S	*	.			trans	-58.9	4.7	174.8	-64.1	-173.5	156.6	0	0	114.1	H347 K351	H347-E349 PolarHBondContact O-N 3.27Å; E349-K351 PolarHBondContact O-N 2.99Å
350	Q	63.1	Low	77.1	Confident	126 Å²	126	89.9 Å²	89.9	59%	0.589	44%	0.444	S	S	*	.			trans	-70.2	88.9	175.5	-62.4	-161.5	-11	0	0	111	S348 L352	S348-Q350 PolarHBondContact O-N 3.16Å; Q350-L352 HydrophobicContact CB-CD2 4.1Å; Q350-L352 HydrophobicContact CB-CG 4.13Å; Q350-L352 PolarHBondContact O-N 3.41Å
351	K	65.4	Low	76.9	Confident	122 Å²	122	90.5 Å²	90.5	53%	0.53	45%	0.452	S	S	.	.			trans	-69.8	81.1	160.5	-64.3	173.8	177.9	178.2	0	109	E349 Y353 A361 F362 T363	E349-K351 PolarHBondContact O-N 2.99Å; K351-Y353 PolarHBondContact O-N 3.41Å; K351-A361 HydrophobicContact CB-CB 3.42Å; K351-A361 VanDerWaalsContact CB-CB 3.42Å; K351-A361 HydrophobicContact CD-CB 3.79Å; K351-A361 WeakPolarHBondContact CD-O 3.43Å; K351-A361 HydrophobicContact CG-CB 4.22Å; K351-F362 CarbonylContact C-O 3.25Å; K351-F362 WeakPolarHBondContact CA-O 3.34Å; K351-T363 HydrophobicContact CG-CG2 4.13Å
352	L	67.5	Low	76.8	Confident	112 Å²	112	86.9 Å²	86.9	59%	0.586	43%	0.432	S	S	*	.			trans	-65.4	-23.5	-173.7	-68.4	168.6	0	0	0	113.8	Q350 F362	Q350-L352 HydrophobicContact CB-CD2 4.1Å; Q350-L352 HydrophobicContact CB-CG 4.13Å; Q350-L352 PolarHBondContact O-N 3.41Å; L352-F362 PolarHBondContact N-O 2.91Å
353	Y	75.9	Confident	76.6	Confident	91 Å²	91	85.9 Å²	85.9	36%	0.357	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	94.7	-171.4	-59.2	-80	0	0	0	110.3	K351 A361 F362 R364	K351-Y353 PolarHBondContact O-N 3.41Å; Y353-A361 CarbonylContact O-C 3.58Å; Y353-A361 WeakPolarHBondContact O-CA 3.36Å; Y353-F362 PolarHBondContact N-O 3.48Å; Y353-F362 VanDerWaalsContact N-O 3.08Å; Y353-F362 PolarHBondContact O-N 3.14Å; Y353-R364 VanDerWaalsContact CD2-C 3.46Å
354	K	79.8	Confident	76.4	Confident	138 Å²	138	90.5 Å²	90.5	60%	0.6	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.4	141.1	177.9	-66.3	-178.7	-179.5	179.9	0	111.3	A361 L368	K354-A361 HydrophobicContact CG-CB 3.91Å; K354-L368 WeakPolarHBondContact O-CD2 3.39Å
355	C	85.8	Confident	76.4	Confident	1 Å²	1	87.6 Å²	87.6	1%	0.007	44%	0.443	C	S	.	.			trans	-87.6	114.9	168.8	-178.8	0	0	0	0	108.6	E357 C358 G359 K360 F362 L368 H375	C355-E357 PolarHBondContact O-N 3.34Å; C355-C358 PolarHBondContact O-N 3.24Å; C355-G359 WeakPolarHBondContact O-CA 3.42Å; C355-G359 PolarHBondContact O-N 3.49Å; C355-K360 WeakPolarHBondContact CB-O 3.24Å; C355-K360 PolarHBondContact N-O 3.25Å; C355-F362 HydrophobicContact CB-CE2 4.37Å; C355-L368 HydrophobicContact CB-CD1 3.6Å; C355-H375 PolarHBondContact SG-NE2 3.14Å
356	E	83.9	Confident	76.6	Confident	169 Å²	169	90.7 Å²	90.7	79%	0.79	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-29.6	179.5	-58	-54.8	139.9	0	0	112.7
357	E	81.9	Confident	76.9	Confident	134 Å²	134	87.8 Å²	87.8	63%	0.626	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-25.4	-175.7	-68.8	166	-160.3	0	0	114	C355 H375	C355-E357 PolarHBondContact O-N 3.34Å; E357-H375 WeakPolarHBondContact OE2-CB 3.26Å; E357-H375 IonicContact OE2-CD2 3.95Å; E357-H375 PolarHBondContact OE2-CD2 3.09Å; E357-H375 IonicContact OE2-CG 2.92Å; E357-H375 IonicContact OE2-NE2 3.13Å
358	C	85.2	Confident	77.3	Confident	51 Å²	51	85.2 Å²	85.2	35%	0.345	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.4	5.1	-176.4	75.5	0	0	0	0	114.7	C355 K360 H371 H375	C355-C358 PolarHBondContact O-N 3.24Å; C358-K360 PolarHBondContact O-N 2.96Å; C358-K360 VanDerWaalsContact SG-CB 3.58Å; C358-H371 PolarHBondContact SG-NE2 2.94Å; C358-H375 PolarHBondContact SG-NE2 3.09Å; C358-H375 VanDerWaalsContact SG-NE2 3.43Å
359	G	79.9	Confident	78	Confident	59 Å²	59	87.2 Å²	87.2	61%	0.608	45%	0.446	S	S	*	.			trans	68.3	-4.4	-179.1	0	0	0	0	0	115.6	C355 A361	C355-G359 WeakPolarHBondContact O-CA 3.42Å; C355-G359 PolarHBondContact O-N 3.49Å; G359-A361 PolarHBondContact O-N 3.19Å
360	K	81.9	Confident	79.2	Confident	126 Å²	126	82.9 Å²	82.9	55%	0.548	43%	0.426	S	S	.	.			trans	-65.5	130.2	-178.6	-72.2	179.6	-179	174.4	0	110.8	C355 C358 F362	C355-K360 WeakPolarHBondContact CB-O 3.24Å; C355-K360 PolarHBondContact N-O 3.25Å; C358-K360 PolarHBondContact O-N 2.96Å; C358-K360 VanDerWaalsContact SG-CB 3.58Å; K360-F362 HydrophobicContact CB-CE2 3.85Å; K360-F362 HydrophobicContact CB-CZ 4.06Å; K360-F362 WeakPolarHBondContact O-CE2 2.93Å
361	A	80.4	Confident	80.2	Confident	29 Å²	29	77.7 Å²	77.7	24%	0.24	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	140.1	-178.1	0	0	0	0	0	111.5	K351 Y353 K354 G359	K351-A361 HydrophobicContact CB-CB 3.42Å; K351-A361 VanDerWaalsContact CB-CB 3.42Å; K351-A361 HydrophobicContact CD-CB 3.79Å; K351-A361 WeakPolarHBondContact CD-O 3.43Å; K351-A361 HydrophobicContact CG-CB 4.22Å; Y353-A361 CarbonylContact O-C 3.58Å; Y353-A361 WeakPolarHBondContact O-CA 3.36Å; K354-A361 HydrophobicContact CG-CB 3.91Å; G359-A361 PolarHBondContact O-N 3.19Å
362	F	80.3	Confident	81	Confident	44 Å²	44	76 Å²	76	19%	0.193	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	150.2	-175.7	-59.6	-92.3	0	0	0	110.5	K351 L352 Y353 C355 K360 R364 A367 L368 H371	K351-F362 CarbonylContact C-O 3.25Å; K351-F362 WeakPolarHBondContact CA-O 3.34Å; L352-F362 PolarHBondContact N-O 2.91Å; Y353-F362 PolarHBondContact N-O 3.48Å; Y353-F362 VanDerWaalsContact N-O 3.08Å; Y353-F362 PolarHBondContact O-N 3.14Å; C355-F362 HydrophobicContact CB-CE2 4.37Å; K360-F362 HydrophobicContact CB-CE2 3.85Å; K360-F362 HydrophobicContact CB-CZ 4.06Å; K360-F362 WeakPolarHBondContact O-CE2 2.93Å; F362-R364 VanDerWaalsContact C-N 3.34Å; F362-A367 HydrophobicContact CB-CB 4.33Å; F362-A367 HydrophobicContact CD1-CB 3.93Å; F362-A367 HydrophobicContact CG-CB 4.41Å; F362-L368 HydrophobicContact CB-CB 4.35Å; F362-L368 HydrophobicContact CD2-CB 3.99Å; F362-L368 HydrophobicContact CD2-CD1 3.77Å; F362-L368 HydrophobicContact CD2-CG 4.49Å; F362-L368 HydrophobicContact CE2-CD1 3.95Å; F362-L368 HydrophobicContact CG-CB 4.3Å; F362-H371 HydrophobicContact CE1-CB 3.96Å; F362-H371 HydrophobicContact CE2-CB 3.89Å; F362-H371 AromaticContact CE2-CD2 3.51Å; F362-H371 AromaticContact CE2-CG 3.7Å; F362-H371 HydrophobicContact CZ-CB 3.42Å; F362-H371 VanDerWaalsContact CZ-CB 3.42Å; F362-H371 AromaticContact CZ-CD2 3.51Å; F362-H371 AromaticContact CZ-CG 3.24Å; F362-H371 AromaticContact CZ-ND1 3.76Å
363	T	76.3	Confident	81.8	Confident	50 Å²	50	73.2 Å²	73.2	31%	0.307	38%	0.377	S	S	.	.	S	Bend	trans	-84.4	-9.1	176.9	54.6	0	0	0	0	113.1	S345 K351	S345-T363 PolarHBondContact OG-O 2.89Å; K351-T363 HydrophobicContact CG-CG2 4.13Å
364	R	77.2	Confident	82.1	Confident	113 Å²	113	73.7 Å²	73.7	43%	0.426	39%	0.385	S	S	.	.	S	Bend	trans	-137.3	139.9	-177.7	-59.2	-179.8	-173.9	179.2	-1.3	110.8	I342 Y353 F362 T366 A367 L368	I342-R364 HydrophobicContact CG2-CG 4.35Å; Y353-R364 VanDerWaalsContact CD2-C 3.46Å; F362-R364 VanDerWaalsContact C-N 3.34Å; R364-T366 VanDerWaalsContact C-N 3.33Å; R364-T366 PolarHBondContact O-N 3.45Å; R364-A367 HydrophobicContact CB-CB 4.24Å; R364-A367 PolarHBondContact O-N 3.4Å; R364-L368 PolarHBondContact O-N 3.48Å
365	S	80.5	Confident	82.2	Confident	53 Å²	53	70.6 Å²	70.6	37%	0.371	37%	0.372	S	S	.	.	H	α-helix	trans	-64.7	-35.8	177.1	62.2	0	0	0	0	112.9	A367 L368 N369	S365-A367 VanDerWaalsContact C-N 3.34Å; S365-A367 PolarHBondContact O-N 3.03Å; S365-L368 PolarHBondContact O-N 3.12Å; S365-N369 PolarHBondContact O-N 3.09Å
366	T	83.1	Confident	81.9	Confident	85 Å²	85	73.7 Å²	73.7	52%	0.521	39%	0.394	S	S	.	.	H	α-helix	trans	-62.6	-41.5	176.8	51.7	0	0	0	0	111.7	R364 N369 E370	R364-T366 VanDerWaalsContact C-N 3.33Å; R364-T366 PolarHBondContact O-N 3.45Å; T366-N369 PolarHBondContact O-N 3.35Å; T366-E370 WeakPolarHBondContact O-CG 3.29Å; T366-E370 PolarHBondContact O-N 3.17Å
367	A	83.3	Confident	81.6	Confident	32 Å²	32	68 Å²	68	26%	0.264	38%	0.38	S	S	.	.	H	α-helix	trans	-65.3	-38.5	176.4	0	0	0	0	0	111.9	F362 R364 S365 H371	F362-A367 HydrophobicContact CB-CB 4.33Å; F362-A367 HydrophobicContact CD1-CB 3.93Å; F362-A367 HydrophobicContact CG-CB 4.41Å; R364-A367 HydrophobicContact CB-CB 4.24Å; R364-A367 PolarHBondContact O-N 3.4Å; S365-A367 VanDerWaalsContact C-N 3.34Å; S365-A367 PolarHBondContact O-N 3.03Å; A367-H371 VanDerWaalsContact O-CB 3.29Å; A367-H371 WeakPolarHBondContact O-CB 3.41Å; A367-H371 PolarHBondContact O-N 3.04Å
368	L	84.1	Confident	81.5	Confident	14 Å²	14	66.8 Å²	66.8	7%	0.073	38%	0.375	C	S	.	.	H	α-helix	trans	-63.4	-45.6	172	174.4	63.3	0	0	0	111.5	K354 C355 F362 R364 S365 E370 H371 K372	K354-L368 WeakPolarHBondContact O-CD2 3.39Å; C355-L368 HydrophobicContact CB-CD1 3.6Å; F362-L368 HydrophobicContact CB-CB 4.35Å; F362-L368 HydrophobicContact CD2-CB 3.99Å; F362-L368 HydrophobicContact CD2-CD1 3.77Å; F362-L368 HydrophobicContact CD2-CG 4.49Å; F362-L368 HydrophobicContact CE2-CD1 3.95Å; F362-L368 HydrophobicContact CG-CB 4.3Å; R364-L368 PolarHBondContact O-N 3.48Å; S365-L368 PolarHBondContact O-N 3.12Å; L368-E370 PolarHBondContact O-N 3.03Å; L368-H371 WeakPolarHBondContact O-CB 3.41Å; L368-H371 PolarHBondContact O-N 3.41Å; L368-H371 VanDerWaalsContact O-N 3.16Å; L368-K372 HydrophobicContact CD1-CG 4.34Å; L368-K372 WeakPolarHBondContact O-CG 3.43Å; L368-K372 PolarHBondContact O-N 2.92Å
369	N	83.6	Confident	81.4	Confident	95 Å²	95	70.3 Å²	70.3	51%	0.508	38%	0.384	S	S	.	.	H	α-helix	trans	-64.3	-38.8	179	-75.5	-10.7	0	0	0	112.4	S365 T366 H371 K372	S365-N369 PolarHBondContact O-N 3.09Å; T366-N369 PolarHBondContact O-N 3.35Å; N369-H371 VanDerWaalsContact C-N 3.34Å; N369-K372 PolarHBondContact O-N 3.28Å
370	E	83.5	Confident	81.5	Confident	96 Å²	96	71 Å²	71	45%	0.449	38%	0.379	S	S	.	.	H	α-helix	trans	-64.8	-39.5	171.9	-74.8	-178.6	174.2	0	0	111.8	T366 L368 K373 L392	T366-E370 WeakPolarHBondContact O-CG 3.29Å; T366-E370 PolarHBondContact O-N 3.17Å; L368-E370 PolarHBondContact O-N 3.03Å; E370-K373 WeakPolarHBondContact O-CB 3.46Å; E370-K373 PolarHBondContact O-N 3.46Å; E370-L392 HydrophobicContact CB-CD2 4.06Å; E370-L392 HydrophobicContact CG-CD2 3.7Å
371	H	84.5	Confident	81.7	Confident	18 Å²	18	69 Å²	69	8%	0.083	37%	0.368	C	S	.	.	H	α-helix	trans	-64.6	-41.2	175.8	176.3	64.7	0	0	0	112.6	C358 F362 A367 L368 N369 K373 I374 H375	C358-H371 PolarHBondContact SG-NE2 2.94Å; F362-H371 HydrophobicContact CE1-CB 3.96Å; F362-H371 HydrophobicContact CE2-CB 3.89Å; F362-H371 AromaticContact CE2-CD2 3.51Å; F362-H371 AromaticContact CE2-CG 3.7Å; F362-H371 HydrophobicContact CZ-CB 3.42Å; F362-H371 VanDerWaalsContact CZ-CB 3.42Å; F362-H371 AromaticContact CZ-CD2 3.51Å; F362-H371 AromaticContact CZ-CG 3.24Å; F362-H371 AromaticContact CZ-ND1 3.76Å; A367-H371 VanDerWaalsContact O-CB 3.29Å; A367-H371 WeakPolarHBondContact O-CB 3.41Å; A367-H371 PolarHBondContact O-N 3.04Å; L368-H371 WeakPolarHBondContact O-CB 3.41Å; L368-H371 PolarHBondContact O-N 3.41Å; L368-H371 VanDerWaalsContact O-N 3.16Å; N369-H371 VanDerWaalsContact C-N 3.34Å; H371-K373 PolarHBondContact O-N 3.46Å; H371-K373 VanDerWaalsContact O-N 3.15Å; H371-I374 VanDerWaalsContact O-CB 3.22Å; H371-I374 WeakPolarHBondContact O-CB 3.36Å; H371-I374 WeakPolarHBondContact O-CG1 3.42Å; H371-I374 PolarHBondContact O-N 3.43Å; H371-H375 AromaticContact CD2-NE2 3.83Å; H371-H375 AromaticContact CE1-NE2 3.83Å; H371-H375 AromaticContact NE2-CD2 4Å; H371-H375 AromaticContact NE2-CE1 3.78Å; H371-H375 AromaticContact NE2-NE2 3.14Å; H371-H375 PolarHBondContact NE2-NE2 3.36Å; H371-H375 VanDerWaalsContact NE2-NE2 3.14Å
372	K	83.4	Confident	82	Confident	86 Å²	86	74.8 Å²	74.8	37%	0.374	39%	0.388	S	S	.	.	H	α-helix	trans	-57.6	-28.1	177.4	-75.9	-176.3	175.3	-167.7	0	113.1	L368 N369 I374 H375 S376	L368-K372 HydrophobicContact CD1-CG 4.34Å; L368-K372 WeakPolarHBondContact O-CG 3.43Å; L368-K372 PolarHBondContact O-N 2.92Å; N369-K372 PolarHBondContact O-N 3.28Å; K372-I374 PolarHBondContact O-N 3.2Å; K372-H375 PolarHBondContact O-N 3.45Å; K372-H375 VanDerWaalsContact O-N 3.11Å; K372-S376 PolarHBondContact O-N 2.82Å; K372-S376 VanDerWaalsContact O-N 3.08Å
373	K	83.4	Confident	82.4	Confident	53 Å²	53	72.9 Å²	72.9	23%	0.23	38%	0.38	C	S	.	.	H	α-helix	trans	-64.4	-19.9	174.4	-63.4	178	179.1	-179.6	0	113.8	E370 H371 S376 G377 E378 N391	E370-K373 WeakPolarHBondContact O-CB 3.46Å; E370-K373 PolarHBondContact O-N 3.46Å; H371-K373 PolarHBondContact O-N 3.46Å; H371-K373 VanDerWaalsContact O-N 3.15Å; K373-S376 WeakPolarHBondContact CA-OG 3.49Å; K373-G377 PolarHBondContact O-N 2.77Å; K373-E378 PolarHBondContact O-N 3.17Å; K373-N391 HydrophobicContact CB-CB 4.42Å
374	I	81.9	Confident	82.9	Confident	101 Å²	101	80.4 Å²	80.4	52%	0.518	41%	0.408	S	S	.	.	H	α-helix	trans	-70.6	-42.1	174.6	-59.1	175.8	0	0	0	109.6	H371 K372 G377	H371-I374 VanDerWaalsContact O-CB 3.22Å; H371-I374 WeakPolarHBondContact O-CB 3.36Å; H371-I374 WeakPolarHBondContact O-CG1 3.42Å; H371-I374 PolarHBondContact O-N 3.43Å; K372-I374 PolarHBondContact O-N 3.2Å; I374-G377 PolarHBondContact O-N 2.83Å
375	H	81.4	Confident	83.3	Confident	73 Å²	73	81 Å²	81	34%	0.338	42%	0.416	S	S	.	.	H	α-helix	trans	-75.4	-39.7	-179	-57.3	-49.5	0	0	0	112.5	C355 E357 C358 H371 K372 G377	C355-H375 PolarHBondContact SG-NE2 3.14Å; E357-H375 WeakPolarHBondContact OE2-CB 3.26Å; E357-H375 IonicContact OE2-CD2 3.95Å; E357-H375 PolarHBondContact OE2-CD2 3.09Å; E357-H375 IonicContact OE2-CG 2.92Å; E357-H375 IonicContact OE2-NE2 3.13Å; C358-H375 PolarHBondContact SG-NE2 3.09Å; C358-H375 VanDerWaalsContact SG-NE2 3.43Å; H371-H375 AromaticContact CD2-NE2 3.83Å; H371-H375 AromaticContact CE1-NE2 3.83Å; H371-H375 AromaticContact NE2-CD2 4Å; H371-H375 AromaticContact NE2-CE1 3.78Å; H371-H375 AromaticContact NE2-NE2 3.14Å; H371-H375 PolarHBondContact NE2-NE2 3.36Å; H371-H375 VanDerWaalsContact NE2-NE2 3.14Å; K372-H375 PolarHBondContact O-N 3.45Å; K372-H375 VanDerWaalsContact O-N 3.11Å; H375-G377 PolarHBondContact O-N 2.96Å
376	S	79.9	Confident	83.6	Confident	66 Å²	66	81 Å²	81	46%	0.462	42%	0.415	S	S	.	.	S	Bend	trans	-71	-9.4	174.8	67	0	0	0	0	113.6	K372 K373 E378	K372-S376 PolarHBondContact O-N 2.82Å; K372-S376 VanDerWaalsContact O-N 3.08Å; K373-S376 WeakPolarHBondContact CA-OG 3.49Å; S376-E378 PolarHBondContact O-N 3.38Å; S376-E378 WeakPolarHBondContact OG-CB 3.45Å; S376-E378 WeakPolarHBondContact OG-CG 3.43Å; S376-E378 PolarHBondContact OG-N 2.91Å
377	G	77.8	Confident	83.6	Confident	49 Å²	49	79.5 Å²	79.5	51%	0.505	42%	0.417	S	S	.	.			trans	64.4	7	-174.9	0	0	0	0	0	114.1	K373 I374 H375 K379	K373-G377 PolarHBondContact O-N 2.77Å; I374-G377 PolarHBondContact O-N 2.83Å; H375-G377 PolarHBondContact O-N 2.96Å; G377-K379 PolarHBondContact O-N 2.87Å
378	E	79.4	Confident	83.8	Confident	110 Å²	110	84 Å²	84	51%	0.514	43%	0.43	S	S	.	.			trans	-62.2	118.9	-178.3	-78.4	-179.5	-169.4	0	0	110.5	K373 S376 P380	K373-E378 PolarHBondContact O-N 3.17Å; S376-E378 PolarHBondContact O-N 3.38Å; S376-E378 WeakPolarHBondContact OG-CB 3.45Å; S376-E378 WeakPolarHBondContact OG-CG 3.43Å; S376-E378 PolarHBondContact OG-N 2.91Å; E378-P380 VanDerWaalsContact C-CD 3.47Å; E378-P380 WeakPolarHBondContact O-CD 3.43Å
379	K	83.1	Confident	83.9	Confident	124 Å²	124	84.8 Å²	84.8	54%	0.539	44%	0.439	S	S	.	.			trans	-120.1	73.9	173.7	-68.1	171.9	178.1	-179.6	0	110.2	G377 Y381 A389 Y390	G377-K379 PolarHBondContact O-N 2.87Å; K379-Y381 PolarHBondContact O-N 3.44Å; K379-A389 HydrophobicContact CB-CB 3.57Å; K379-A389 HydrophobicContact CD-CB 4.11Å; K379-A389 WeakPolarHBondContact CD-O 3.46Å; K379-A389 HydrophobicContact CG-CB 4.43Å; K379-Y390 CarbonylContact C-O 3.54Å; K379-Y390 VanDerWaalsContact C-O 3.29Å; K379-Y390 VanDerWaalsContact CA-O 3.27Å; K379-Y390 WeakPolarHBondContact CA-O 3.26Å
380	P	83	Confident	84	Confident	75 Å²	75	82.7 Å²	82.7	49%	0.487	42%	0.424	S	S	.	.			trans	-66.3	-22	-174	-18.8	32.4	0	0	0	113.2	E378	E378-P380 VanDerWaalsContact C-CD 3.47Å; E378-P380 WeakPolarHBondContact O-CD 3.43Å
381	Y	85.9	Confident	83.9	Confident	83 Å²	83	80.2 Å²	80.2	33%	0.325	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	95.2	-170.7	-56.3	-75.8	0	0	0	110.5	K379 A389 Y390 N391 L392 S393	K379-Y381 PolarHBondContact O-N 3.44Å; Y381-A389 CarbonylContact O-C 3.56Å; Y381-A389 WeakPolarHBondContact O-CA 2.94Å; Y381-Y390 PolarHBondContact N-O 3.21Å; Y381-Y390 VanDerWaalsContact N-O 3.15Å; Y381-Y390 PolarHBondContact O-N 3.43Å; Y381-N391 WeakPolarHBondContact CE2-O 3.49Å; Y381-L392 VanDerWaalsContact CD2-C 3.44Å; Y381-S393 VanDerWaalsContact CD2-N 3.33Å; Y381-S393 VanDerWaalsContact CE2-N 3.34Å
382	K	86.4	Confident	83.8	Confident	151 Å²	151	81.2 Å²	81.2	66%	0.657	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93	133.8	178.9	-62.6	-174.2	179.6	179.9	0	112	A389	K382-A389 HydrophobicContact CG-CB 3.84Å
383	C	89.5	Confident	83.8	Confident	3 Å²	3	79.9 Å²	79.9	2%	0.02	42%	0.421	C	S	.	.			trans	-74.1	125.1	168.5	-177.1	0	0	0	0	109.2	E385 C386 G387 K388 L396	C383-E385 VanDerWaalsContact C-N 3.33Å; C383-C386 VanDerWaalsContact SG-SG 3.6Å; C383-G387 WeakPolarHBondContact O-CA 2.82Å; C383-G387 PolarHBondContact O-N 2.89Å; C383-K388 WeakPolarHBondContact CB-O 3.43Å; C383-K388 PolarHBondContact N-O 3.2Å; C383-L396 HydrophobicContact CB-CD1 3.64Å
384	K	86.4	Confident	83.9	Confident	209 Å²	209	80.5 Å²	80.5	91%	0.909	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-27.3	178.9	-64.9	-172.1	177.3	-173.6	0	112.8
385	E	84.8	Confident	84	Confident	125 Å²	125	77.8 Å²	77.8	58%	0.584	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-36	-174.8	-68.5	161.5	170.6	0	0	112.8	C383 H403	C383-E385 VanDerWaalsContact C-N 3.33Å; E385-H403 WeakPolarHBondContact OE2-CB 3.44Å; E385-H403 IonicContact OE2-CD2 2.99Å; E385-H403 PolarHBondContact OE2-CD2 3.29Å; E385-H403 IonicContact OE2-CG 3.19Å; E385-H403 IonicContact OE2-NE2 3.13Å
386	C	87.1	Confident	84.2	Confident	52 Å²	52	75.1 Å²	75.1	35%	0.351	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.4	6.6	-176.7	73.8	0	0	0	0	114.6	C383 K388 H399 H403	C383-C386 VanDerWaalsContact SG-SG 3.6Å; C386-K388 PolarHBondContact O-N 2.9Å; C386-H399 PolarHBondContact SG-NE2 3.4Å; C386-H403 PolarHBondContact SG-NE2 3.18Å; C386-H403 VanDerWaalsContact SG-NE2 3.37Å
387	G	83.9	Confident	84.4	Confident	54 Å²	54	75.5 Å²	75.5	56%	0.557	41%	0.408	S	S	*	.			trans	70.8	-9.9	178.4	0	0	0	0	0	115.9	C383 A389	C383-G387 WeakPolarHBondContact O-CA 2.82Å; C383-G387 PolarHBondContact O-N 2.89Å; G387-A389 PolarHBondContact O-N 3.36Å
388	K	86.5	Confident	84.7	Confident	128 Å²	128	79.1 Å²	79.1	56%	0.557	41%	0.41	S	S	*	.			trans	-61.3	131	-178.2	-70	-177.1	-179.9	180	0	111.5	C383 C386 Y390	C383-K388 WeakPolarHBondContact CB-O 3.43Å; C383-K388 PolarHBondContact N-O 3.2Å; C386-K388 PolarHBondContact O-N 2.9Å; K388-Y390 HydrophobicContact CB-CE2 3.9Å; K388-Y390 WeakPolarHBondContact O-CE2 3.27Å
389	A	86.5	Confident	85	Confident	30 Å²	30	74.8 Å²	74.8	25%	0.248	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	143.2	-177.2	0	0	0	0	0	111.8	K379 Y381 K382 G387	K379-A389 HydrophobicContact CB-CB 3.57Å; K379-A389 HydrophobicContact CD-CB 4.11Å; K379-A389 WeakPolarHBondContact CD-O 3.46Å; K379-A389 HydrophobicContact CG-CB 4.43Å; Y381-A389 CarbonylContact O-C 3.56Å; Y381-A389 WeakPolarHBondContact O-CA 2.94Å; K382-A389 HydrophobicContact CG-CB 3.84Å; G387-A389 PolarHBondContact O-N 3.36Å
390	Y	85.1	Confident	85.1	Confident	50 Å²	50	73.5 Å²	73.5	20%	0.196	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	152	-176.1	-57.5	-88	0	0	0	111.7	K379 Y381 K388 T395 L396 H399	K379-Y390 CarbonylContact C-O 3.54Å; K379-Y390 VanDerWaalsContact C-O 3.29Å; K379-Y390 VanDerWaalsContact CA-O 3.27Å; K379-Y390 WeakPolarHBondContact CA-O 3.26Å; Y381-Y390 PolarHBondContact N-O 3.21Å; Y381-Y390 VanDerWaalsContact N-O 3.15Å; Y381-Y390 PolarHBondContact O-N 3.43Å; K388-Y390 HydrophobicContact CB-CE2 3.9Å; K388-Y390 WeakPolarHBondContact O-CE2 3.27Å; Y390-T395 WeakPolarHBondContact CB-OG1 3.45Å; Y390-L396 HydrophobicContact CD2-CB 3.91Å; Y390-L396 HydrophobicContact CD2-CD1 3.77Å; Y390-L396 HydrophobicContact CD2-CG 4.44Å; Y390-L396 HydrophobicContact CE2-CD1 3.91Å; Y390-L396 HydrophobicContact CG-CB 4.39Å; Y390-H399 HydrophobicContact CE1-CB 4.29Å; Y390-H399 HydrophobicContact CE2-CB 3.95Å; Y390-H399 AromaticContact CE2-CD2 3.52Å; Y390-H399 AromaticContact CE2-CG 3.75Å; Y390-H399 AromaticContact CZ-CD2 3.68Å; Y390-H399 AromaticContact CZ-CG 3.48Å; Y390-H399 VanDerWaalsContact CZ-CG 3.48Å; Y390-H399 AromaticContact CZ-ND1 3.95Å; Y390-H399 PolarHBondContact OH-CD2 3.4Å; Y390-H399 PolarHBondContact OH-CE1 3.06Å; Y390-H399 VanDerWaalsContact OH-CE1 3.24Å; Y390-H399 PolarHBondContact OH-ND1 2.92Å; Y390-H399 PolarHBondContact OH-NE2 2.78Å
391	N	82.1	Confident	85.2	Confident	44 Å²	44	72.9 Å²	72.9	24%	0.235	37%	0.372	C	S	.	.	S	Bend	trans	-79.8	-22.4	178.3	59.3	1.1	0	0	0	113.3	K373 Y381	K373-N391 HydrophobicContact CB-CB 4.42Å; Y381-N391 WeakPolarHBondContact CE2-O 3.49Å
392	L	81.9	Confident	85	Confident	39 Å²	39	73.9 Å²	73.9	20%	0.204	38%	0.382	C	S	.	.	S	Bend	trans	-125.7	135.7	-178.2	-65.7	171.8	0	0	0	111.8	E370 Y381 S394 T395 L396	E370-L392 HydrophobicContact CB-CD2 4.06Å; E370-L392 HydrophobicContact CG-CD2 3.7Å; Y381-L392 VanDerWaalsContact CD2-C 3.44Å; L392-S394 VanDerWaalsContact C-N 3.27Å; L392-S394 PolarHBondContact O-N 3.02Å; L392-T395 HydrophobicContact CB-CG2 4.05Å; L392-T395 HydrophobicContact CD1-CG2 4.4Å; L392-T395 PolarHBondContact O-N 3.47Å; L392-T395 VanDerWaalsContact O-N 3.1Å; L392-T395 PolarHBondContact O-OG1 3.13Å; L392-L396 PolarHBondContact O-N 3.06Å
393	S	84	Confident	84.8	Confident	58 Å²	58	70.4 Å²	70.4	41%	0.406	37%	0.368	S	S	.	.	H	α-helix	trans	-57.2	-40.6	175.9	177.8	0	0	0	0	112.2	Y381 T395 L396 T397	Y381-S393 VanDerWaalsContact CD2-N 3.33Å; Y381-S393 VanDerWaalsContact CE2-N 3.34Å; S393-T395 VanDerWaalsContact C-N 3.26Å; S393-T395 PolarHBondContact O-N 2.97Å; S393-L396 PolarHBondContact O-N 3.35Å; S393-L396 VanDerWaalsContact O-N 3.15Å; S393-T397 PolarHBondContact O-N 3.19Å; S393-T397 PolarHBondContact O-OG1 3.21Å
394	S	84.3	Confident	84.4	Confident	67 Å²	67	74.2 Å²	74.2	47%	0.469	39%	0.392	S	S	.	.	H	α-helix	trans	-60.2	-34.7	178.2	59.9	0	0	0	0	113	L392 K398	L392-S394 VanDerWaalsContact C-N 3.27Å; L392-S394 PolarHBondContact O-N 3.02Å; S394-K398 WeakPolarHBondContact O-CG 3.48Å; S394-K398 PolarHBondContact O-N 3.12Å
395	T	84.6	Confident	84.1	Confident	44 Å²	44	66.6 Å²	66.6	27%	0.27	37%	0.372	S	S	.	.	H	α-helix	trans	-73.1	-38.1	176.9	59	0	0	0	0	111.9	Y390 L392 S393 K398 H399	Y390-T395 WeakPolarHBondContact CB-OG1 3.45Å; L392-T395 HydrophobicContact CB-CG2 4.05Å; L392-T395 HydrophobicContact CD1-CG2 4.4Å; L392-T395 PolarHBondContact O-N 3.47Å; L392-T395 VanDerWaalsContact O-N 3.1Å; L392-T395 PolarHBondContact O-OG1 3.13Å; S393-T395 VanDerWaalsContact C-N 3.26Å; S393-T395 PolarHBondContact O-N 2.97Å; T395-K398 PolarHBondContact O-N 3.15Å; T395-H399 WeakPolarHBondContact O-CB 3.25Å; T395-H399 PolarHBondContact O-N 3.45Å
396	L	86.1	Confident	83.9	Confident	16 Å²	16	65.6 Å²	65.6	8%	0.084	37%	0.368	C	S	.	.	H	α-helix	trans	-62.6	-44.7	171.1	174.5	62.6	0	0	0	111.2	C383 Y390 L392 S393 K398 H399 K400	C383-L396 HydrophobicContact CB-CD1 3.64Å; Y390-L396 HydrophobicContact CD2-CB 3.91Å; Y390-L396 HydrophobicContact CD2-CD1 3.77Å; Y390-L396 HydrophobicContact CD2-CG 4.44Å; Y390-L396 HydrophobicContact CE2-CD1 3.91Å; Y390-L396 HydrophobicContact CG-CB 4.39Å; L392-L396 PolarHBondContact O-N 3.06Å; S393-L396 PolarHBondContact O-N 3.35Å; S393-L396 VanDerWaalsContact O-N 3.15Å; L396-K398 VanDerWaalsContact C-N 3.35Å; L396-K398 PolarHBondContact O-N 3Å; L396-H399 WeakPolarHBondContact O-CB 3.4Å; L396-H399 PolarHBondContact O-N 3.14Å; L396-H399 VanDerWaalsContact O-N 3.14Å; L396-K400 HydrophobicContact CD1-CG 4.37Å; L396-K400 WeakPolarHBondContact O-CG 3.29Å; L396-K400 PolarHBondContact O-N 3.36Å
397	T	84.3	Confident	83.7	Confident	75 Å²	75	69.1 Å²	69.1	46%	0.46	38%	0.377	S	S	.	.	H	α-helix	trans	-60.7	-43.2	177.1	-57.9	0	0	0	0	111.7	S393 H399 K400	S393-T397 PolarHBondContact O-N 3.19Å; S393-T397 PolarHBondContact O-OG1 3.21Å; T397-H399 VanDerWaalsContact C-N 3.31Å; T397-H399 PolarHBondContact O-N 3.31Å; T397-K400 PolarHBondContact O-N 2.81Å
398	K	84.1	Confident	83.7	Confident	125 Å²	125	69.2 Å²	69.2	54%	0.543	37%	0.368	S	S	.	.	H	α-helix	trans	-62.9	-39.1	173.9	-74.2	175.8	-178	-179	0	112.1	S394 T395 L396 R401	S394-K398 WeakPolarHBondContact O-CG 3.48Å; S394-K398 PolarHBondContact O-N 3.12Å; T395-K398 PolarHBondContact O-N 3.15Å; L396-K398 VanDerWaalsContact C-N 3.35Å; L396-K398 PolarHBondContact O-N 3Å; K398-R401 WeakPolarHBondContact O-CB 3.46Å; K398-R401 PolarHBondContact O-N 3.33Å
399	H	85.4	Confident	83.6	Confident	18 Å²	18	66 Å²	66	8%	0.083	35%	0.354	C	S	.	.	H	α-helix	trans	-65.6	-40.8	177.7	169.9	65.1	0	0	0	112.6	C386 Y390 T395 L396 T397 R401 I402 H403	C386-H399 PolarHBondContact SG-NE2 3.4Å; Y390-H399 HydrophobicContact CE1-CB 4.29Å; Y390-H399 HydrophobicContact CE2-CB 3.95Å; Y390-H399 AromaticContact CE2-CD2 3.52Å; Y390-H399 AromaticContact CE2-CG 3.75Å; Y390-H399 AromaticContact CZ-CD2 3.68Å; Y390-H399 AromaticContact CZ-CG 3.48Å; Y390-H399 VanDerWaalsContact CZ-CG 3.48Å; Y390-H399 AromaticContact CZ-ND1 3.95Å; Y390-H399 PolarHBondContact OH-CD2 3.4Å; Y390-H399 PolarHBondContact OH-CE1 3.06Å; Y390-H399 VanDerWaalsContact OH-CE1 3.24Å; Y390-H399 PolarHBondContact OH-ND1 2.92Å; Y390-H399 PolarHBondContact OH-NE2 2.78Å; T395-H399 WeakPolarHBondContact O-CB 3.25Å; T395-H399 PolarHBondContact O-N 3.45Å; L396-H399 WeakPolarHBondContact O-CB 3.4Å; L396-H399 PolarHBondContact O-N 3.14Å; L396-H399 VanDerWaalsContact O-N 3.14Å; T397-H399 VanDerWaalsContact C-N 3.31Å; T397-H399 PolarHBondContact O-N 3.31Å; H399-R401 PolarHBondContact O-N 3.19Å; H399-R401 VanDerWaalsContact O-N 3.09Å; H399-I402 VanDerWaalsContact O-CB 3.29Å; H399-I402 WeakPolarHBondContact O-CB 3.45Å; H399-I402 WeakPolarHBondContact O-CG1 3.29Å; H399-I402 PolarHBondContact O-N 3.04Å; H399-H403 AromaticContact CD2-NE2 3.91Å; H399-H403 AromaticContact CE1-NE2 3.52Å; H399-H403 AromaticContact NE2-CD2 3.89Å; H399-H403 AromaticContact NE2-CE1 4Å; H399-H403 AromaticContact NE2-NE2 3.09Å; H399-H403 PolarHBondContact NE2-NE2 3.11Å
400	K	84.3	Confident	83.4	Confident	98 Å²	98	68.4 Å²	68.4	43%	0.426	37%	0.365	S	S	.	.	H	α-helix	trans	-56.1	-27.7	178.2	-75.9	-177.8	175.4	-169.8	0	113.5	L396 T397 I402 H403 T404	L396-K400 HydrophobicContact CD1-CG 4.37Å; L396-K400 WeakPolarHBondContact O-CG 3.29Å; L396-K400 PolarHBondContact O-N 3.36Å; T397-K400 PolarHBondContact O-N 2.81Å; K400-I402 PolarHBondContact O-N 3.17Å; K400-I402 VanDerWaalsContact O-N 3.17Å; K400-H403 PolarHBondContact O-N 3.31Å; K400-T404 PolarHBondContact O-N 3.39Å; K400-T404 PolarHBondContact O-OG1 3.41Å
401	R	85.4	Confident	83.4	Confident	61 Å²	61	66 Å²	66	23%	0.23	36%	0.356	C	S	.	.	H	α-helix	trans	-61.9	-20.9	175.2	-61.7	-178.3	-178.9	177.3	-2.1	114	K398 H399 T404 G405 E406	K398-R401 WeakPolarHBondContact O-CB 3.46Å; K398-R401 PolarHBondContact O-N 3.33Å; H399-R401 PolarHBondContact O-N 3.19Å; H399-R401 VanDerWaalsContact O-N 3.09Å; R401-T404 WeakPolarHBondContact CA-OG1 3.4Å; R401-G405 PolarHBondContact O-N 3.15Å; R401-G405 VanDerWaalsContact O-N 3.13Å; R401-E406 PolarHBondContact O-N 3.34Å
402	I	83.1	Confident	83.5	Confident	105 Å²	105	72.4 Å²	72.4	54%	0.538	39%	0.385	S	S	.	.	H	α-helix	trans	-70.9	-38.3	175.2	-58.7	175	0	0	0	110	H399 K400	H399-I402 VanDerWaalsContact O-CB 3.29Å; H399-I402 WeakPolarHBondContact O-CB 3.45Å; H399-I402 WeakPolarHBondContact O-CG1 3.29Å; H399-I402 PolarHBondContact O-N 3.04Å; K400-I402 PolarHBondContact O-N 3.17Å; K400-I402 VanDerWaalsContact O-N 3.17Å
403	H	82.5	Confident	83.4	Confident	77 Å²	77	76.7 Å²	76.7	36%	0.356	40%	0.404	S	S	.	.	H	α-helix	trans	-80	-40.3	-179.9	-57	-54	0	0	0	111.9	E385 C386 H399 K400 G405	E385-H403 WeakPolarHBondContact OE2-CB 3.44Å; E385-H403 IonicContact OE2-CD2 2.99Å; E385-H403 PolarHBondContact OE2-CD2 3.29Å; E385-H403 IonicContact OE2-CG 3.19Å; E385-H403 IonicContact OE2-NE2 3.13Å; C386-H403 PolarHBondContact SG-NE2 3.18Å; C386-H403 VanDerWaalsContact SG-NE2 3.37Å; H399-H403 AromaticContact CD2-NE2 3.91Å; H399-H403 AromaticContact CE1-NE2 3.52Å; H399-H403 AromaticContact NE2-CD2 3.89Å; H399-H403 AromaticContact NE2-CE1 4Å; H399-H403 AromaticContact NE2-NE2 3.09Å; H399-H403 PolarHBondContact NE2-NE2 3.11Å; K400-H403 PolarHBondContact O-N 3.31Å; H403-G405 VanDerWaalsContact C-N 3.28Å; H403-G405 PolarHBondContact O-N 3.16Å
404	T	81.1	Confident	83.4	Confident	84 Å²	84	76.4 Å²	76.4	52%	0.515	40%	0.401	S	S	.	.	H	α-helix	trans	-78.2	-11.8	179.3	62	0	0	0	0	113.5	K400 R401 E406	K400-T404 PolarHBondContact O-N 3.39Å; K400-T404 PolarHBondContact O-OG1 3.41Å; R401-T404 WeakPolarHBondContact CA-OG1 3.4Å; T404-E406 PolarHBondContact O-N 3.33Å; T404-E406 VanDerWaalsContact O-N 3.12Å; T404-E406 WeakPolarHBondContact OG1-CB 3.42Å
405	G	78.4	Confident	83.3	Confident	49 Å²	49	76 Å²	76	51%	0.505	41%	0.407	S	S	.	.			trans	64.9	10	-175.1	0	0	0	0	0	114.4	R401 H403 K407	R401-G405 PolarHBondContact O-N 3.15Å; R401-G405 VanDerWaalsContact O-N 3.13Å; H403-G405 VanDerWaalsContact C-N 3.28Å; H403-G405 PolarHBondContact O-N 3.16Å; G405-K407 PolarHBondContact O-N 2.99Å
406	E	81.2	Confident	83.2	Confident	104 Å²	104	80 Å²	80	49%	0.486	42%	0.421	S	S	.	.			trans	-63	125.1	-174.6	-163.2	-168	165.2	0	0	110.6	R401 T404 P408	R401-E406 PolarHBondContact O-N 3.34Å; T404-E406 PolarHBondContact O-N 3.33Å; T404-E406 VanDerWaalsContact O-N 3.12Å; T404-E406 WeakPolarHBondContact OG1-CB 3.42Å; E406-P408 HydrophobicContact CG-CG 4.04Å; E406-P408 WeakPolarHBondContact O-CD 3.39Å
407	K	83.6	Confident	83.2	Confident	126 Å²	126	81.1 Å²	81.1	55%	0.548	43%	0.432	S	S	.	.			trans	-119.9	77	178.8	-69.9	172.2	178.2	-179.2	0	110.4	G405 F409 A417 F418	G405-K407 PolarHBondContact O-N 2.99Å; K407-F409 PolarHBondContact O-N 2.98Å; K407-F409 VanDerWaalsContact O-N 3.16Å; K407-A417 HydrophobicContact CB-CB 3.64Å; K407-A417 HydrophobicContact CD-CB 4.07Å; K407-A417 HydrophobicContact CG-CB 4.48Å; K407-F418 CarbonylContact C-O 3.54Å; K407-F418 VanDerWaalsContact C-O 3.27Å; K407-F418 VanDerWaalsContact CA-O 3.29Å; K407-F418 WeakPolarHBondContact CA-O 3.43Å
408	P	82.9	Confident	83.1	Confident	56 Å²	56	79.7 Å²	79.7	36%	0.364	42%	0.42	S	S	.	.			trans	-71.1	-11.6	-171.1	-15.3	29.9	0	0	0	114.2	E406	E406-P408 HydrophobicContact CG-CG 4.04Å; E406-P408 WeakPolarHBondContact O-CD 3.39Å
409	F	85.1	Confident	82.9	Confident	59 Å²	59	76.1 Å²	76.1	26%	0.259	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	96.6	-171.8	-57.1	-74.3	0	0	0	109.8	K407 A417 F418 W420 S421 L424	K407-F409 PolarHBondContact O-N 2.98Å; K407-F409 VanDerWaalsContact O-N 3.16Å; F409-A417 CarbonylContact O-C 3.55Å; F409-A417 WeakPolarHBondContact O-CA 3.21Å; F409-F418 HydrophobicContact CB-CB 4.4Å; F409-F418 PolarHBondContact N-O 3.36Å; F409-F418 PolarHBondContact O-N 3.08Å; F409-W420 VanDerWaalsContact CD2-C 3.41Å; F409-S421 VanDerWaalsContact CD2-N 3.34Å; F409-S421 VanDerWaalsContact CE2-N 3.34Å; F409-L424 HydrophobicContact CB-CB 4.08Å; F409-L424 HydrophobicContact CB-CD2 3.85Å
410	T	81.1	Confident	82.7	Confident	81 Å²	81	81.2 Å²	81.2	50%	0.497	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	142	177.9	49.3	0	0	0	0	111.2	A417 L424	T410-A417 HydrophobicContact CG2-CB 3.91Å; T410-L424 WeakPolarHBondContact O-CD2 3.44Å
411	C	86.4	Confident	82.6	Confident	1 Å²	1	79.7 Å²	79.7	1%	0.007	43%	0.427	C	S	.	.			trans	-84.2	118.8	168.3	-179.1	0	0	0	0	108.6	E413 G415 K416 F418 L424 H431	C411-E413 VanDerWaalsContact C-N 3.27Å; C411-E413 PolarHBondContact O-N 3.36Å; C411-G415 WeakPolarHBondContact O-CA 3.35Å; C411-G415 PolarHBondContact O-N 3.21Å; C411-K416 WeakPolarHBondContact CB-O 3.5Å; C411-K416 PolarHBondContact N-O 3.04Å; C411-F418 HydrophobicContact CB-CE2 4.45Å; C411-L424 HydrophobicContact CB-CD1 3.65Å; C411-H431 PolarHBondContact SG-NE2 3.29Å
412	E	83.8	Confident	82.5	Confident	178 Å²	178	79.5 Å²	79.5	83%	0.832	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-28.5	179.7	-66.3	173.9	168.4	0	0	112.2
413	E	79.9	Confident	82.5	Confident	129 Å²	129	75.9 Å²	75.9	60%	0.603	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-28.6	-178	-65.7	170	165.6	0	0	113.4	C411 H431	C411-E413 VanDerWaalsContact C-N 3.27Å; C411-E413 PolarHBondContact O-N 3.36Å; E413-H431 WeakPolarHBondContact OE2-CB 3.45Å; E413-H431 IonicContact OE2-CD2 3.13Å; E413-H431 PolarHBondContact OE2-CD2 3.33Å; E413-H431 IonicContact OE2-CG 3.94Å; E413-H431 IonicContact OE2-NE2 3.33Å
414	C	83.8	Confident	82.5	Confident	52 Å²	52	73.1 Å²	73.1	35%	0.351	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138	6.3	-175.6	76.5	0	0	0	0	115	K416 H427 H431	C414-K416 PolarHBondContact O-N 3.13Å; C414-H427 PolarHBondContact SG-NE2 3.04Å; C414-H431 PolarHBondContact SG-NE2 2.97Å; C414-H431 VanDerWaalsContact SG-NE2 3.41Å
415	G	81.4	Confident	82.6	Confident	58 Å²	58	73.2 Å²	73.2	60%	0.598	41%	0.408	S	S	*	.			trans	69.8	-4.4	179.3	0	0	0	0	0	115.8	C411 A417	C411-G415 WeakPolarHBondContact O-CA 3.35Å; C411-G415 PolarHBondContact O-N 3.21Å; G415-A417 PolarHBondContact O-N 3.27Å
416	K	83.9	Confident	82.6	Confident	128 Å²	128	76.7 Å²	76.7	56%	0.557	41%	0.409	S	S	*	.			trans	-65.9	127.2	-176.4	-72.4	-178.7	-178.5	177.6	0	111.6	C411 C414 F418	C411-K416 WeakPolarHBondContact CB-O 3.5Å; C411-K416 PolarHBondContact N-O 3.04Å; C414-K416 PolarHBondContact O-N 3.13Å; K416-F418 HydrophobicContact CB-CE2 3.8Å; K416-F418 HydrophobicContact CB-CZ 3.97Å; K416-F418 WeakPolarHBondContact O-CD2 3.44Å; K416-F418 VanDerWaalsContact O-CE2 3.3Å; K416-F418 WeakPolarHBondContact O-CE2 3.47Å
417	A	85.3	Confident	82.6	Confident	39 Å²	39	72.7 Å²	72.7	32%	0.322	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	139.4	-179.9	0	0	0	0	0	112.2	K407 F409 T410 G415	K407-A417 HydrophobicContact CB-CB 3.64Å; K407-A417 HydrophobicContact CD-CB 4.07Å; K407-A417 HydrophobicContact CG-CB 4.48Å; F409-A417 CarbonylContact O-C 3.55Å; F409-A417 WeakPolarHBondContact O-CA 3.21Å; T410-A417 HydrophobicContact CG2-CB 3.91Å; G415-A417 PolarHBondContact O-N 3.27Å
418	F	83.1	Confident	82.4	Confident	45 Å²	45	70.9 Å²	70.9	20%	0.197	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	149.3	-177.9	-58.8	-89.8	0	0	0	111.2	K407 F409 C411 K416 L424 H427	K407-F418 CarbonylContact C-O 3.54Å; K407-F418 VanDerWaalsContact C-O 3.27Å; K407-F418 VanDerWaalsContact CA-O 3.29Å; K407-F418 WeakPolarHBondContact CA-O 3.43Å; F409-F418 HydrophobicContact CB-CB 4.4Å; F409-F418 PolarHBondContact N-O 3.36Å; F409-F418 PolarHBondContact O-N 3.08Å; C411-F418 HydrophobicContact CB-CE2 4.45Å; K416-F418 HydrophobicContact CB-CE2 3.8Å; K416-F418 HydrophobicContact CB-CZ 3.97Å; K416-F418 WeakPolarHBondContact O-CD2 3.44Å; K416-F418 VanDerWaalsContact O-CE2 3.3Å; K416-F418 WeakPolarHBondContact O-CE2 3.47Å; F418-L424 HydrophobicContact CB-CB 4.44Å; F418-L424 HydrophobicContact CD2-CB 4.01Å; F418-L424 HydrophobicContact CD2-CD1 3.84Å; F418-L424 HydrophobicContact CE2-CD1 3.97Å; F418-L424 HydrophobicContact CG-CB 4.4Å; F418-H427 HydrophobicContact CE1-CB 4.07Å; F418-H427 HydrophobicContact CE2-CB 3.87Å; F418-H427 AromaticContact CE2-CD2 3.44Å; F418-H427 VanDerWaalsContact CE2-CD2 3.44Å; F418-H427 WeakPolarHBondContact CE2-CD2 3.15Å; F418-H427 AromaticContact CE2-CG 3.65Å; F418-H427 HydrophobicContact CZ-CB 3.48Å; F418-H427 VanDerWaalsContact CZ-CB 3.48Å; F418-H427 AromaticContact CZ-CD2 3.52Å; F418-H427 AromaticContact CZ-CG 3.27Å; F418-H427 AromaticContact CZ-ND1 3.77Å
419	N	79.5	Confident	82.2	Confident	51 Å²	51	69.9 Å²	69.9	27%	0.273	37%	0.374	S	S	.	.	S	Bend	trans	-76	-25.9	176.6	56.9	0.1	0	0	0	113.1
420	W	81.9	Confident	81.8	Confident	124 Å²	124	71.1 Å²	71.1	47%	0.47	38%	0.382	S	S	.	.	S	Bend	trans	-128.2	139.9	-176.5	-52.7	-31.1	0	0	0	112.2	F409 S422 S423 L424	F409-W420 VanDerWaalsContact CD2-C 3.41Å; W420-S422 VanDerWaalsContact C-N 3.3Å; W420-S422 PolarHBondContact O-N 3.02Å; W420-S423 WeakPolarHBondContact O-CB 3.48Å; W420-S423 PolarHBondContact O-N 3.01Å; W420-L424 PolarHBondContact O-N 3.41Å
421	S	82.1	Confident	81.5	Confident	67 Å²	67	71 Å²	71	47%	0.469	38%	0.376	S	S	.	.	H	α-helix	trans	-60.6	-38.6	177.4	58.1	0	0	0	0	112.3	F409 S423 L424 T425	F409-S421 VanDerWaalsContact CD2-N 3.34Å; F409-S421 VanDerWaalsContact CE2-N 3.34Å; S421-S423 PolarHBondContact O-N 3.42Å; S421-L424 WeakPolarHBondContact O-CB 3.36Å; S421-L424 PolarHBondContact O-N 2.93Å; S421-L424 VanDerWaalsContact O-N 3.13Å; S421-T425 PolarHBondContact O-N 2.83Å; S421-T425 PolarHBondContact O-OG1 2.77Å
422	S	81.9	Confident	80.8	Confident	57 Å²	57	75 Å²	75	40%	0.399	40%	0.4	S	S	.	.	H	α-helix	trans	-60.4	-31.8	175.3	55.7	0	0	0	0	112.9	W420 K426	W420-S422 VanDerWaalsContact C-N 3.3Å; W420-S422 PolarHBondContact O-N 3.02Å; S422-K426 WeakPolarHBondContact O-CB 3.22Å; S422-K426 WeakPolarHBondContact O-CG 3.3Å; S422-K426 PolarHBondContact O-N 3.33Å; S422-K426 VanDerWaalsContact O-N 3.08Å
423	S	83.2	Confident	80	Confident	28 Å²	28	69 Å²	69	20%	0.196	39%	0.386	C	S	.	.	H	α-helix	trans	-72.8	-40.7	176.5	-56.9	0	0	0	0	110.6	W420 S421 K426 H427	W420-S423 WeakPolarHBondContact O-CB 3.48Å; W420-S423 PolarHBondContact O-N 3.01Å; S421-S423 PolarHBondContact O-N 3.42Å; S423-K426 PolarHBondContact O-N 3.23Å; S423-H427 WeakPolarHBondContact O-CB 3.33Å; S423-H427 PolarHBondContact O-N 3.35Å
424	L	83.5	Confident	79.5	Confident	20 Å²	20	68.2 Å²	68.2	11%	0.105	38%	0.382	C	S	.	.	H	α-helix	trans	-63.5	-45.3	172.2	176.5	62.3	0	0	0	111.6	F409 T410 C411 F418 W420 S421 K426 H427 K428	F409-L424 HydrophobicContact CB-CB 4.08Å; F409-L424 HydrophobicContact CB-CD2 3.85Å; T410-L424 WeakPolarHBondContact O-CD2 3.44Å; C411-L424 HydrophobicContact CB-CD1 3.65Å; F418-L424 HydrophobicContact CB-CB 4.44Å; F418-L424 HydrophobicContact CD2-CB 4.01Å; F418-L424 HydrophobicContact CD2-CD1 3.84Å; F418-L424 HydrophobicContact CE2-CD1 3.97Å; F418-L424 HydrophobicContact CG-CB 4.4Å; W420-L424 PolarHBondContact O-N 3.41Å; S421-L424 WeakPolarHBondContact O-CB 3.36Å; S421-L424 PolarHBondContact O-N 2.93Å; S421-L424 VanDerWaalsContact O-N 3.13Å; L424-K426 VanDerWaalsContact C-N 3.34Å; L424-K426 PolarHBondContact O-N 3.41Å; L424-H427 CarbonylContact O-C 3.19Å; L424-H427 WeakPolarHBondContact O-CA 3.48Å; L424-H427 WeakPolarHBondContact O-CB 3.46Å; L424-H427 PolarHBondContact O-N 3.28Å; L424-K428 HydrophobicContact CD1-CG 4.24Å; L424-K428 HydrophobicContact CG-CG 4.48Å; L424-K428 WeakPolarHBondContact O-CG 3.4Å; L424-K428 PolarHBondContact O-N 3.36Å
425	T	82.2	Confident	79	Confident	86 Å²	86	71.9 Å²	71.9	53%	0.528	39%	0.392	S	S	.	.	H	α-helix	trans	-57.6	-47	176.3	-51.2	0	0	0	0	111.1	S421 H427 K428 I429	S421-T425 PolarHBondContact O-N 2.83Å; S421-T425 PolarHBondContact O-OG1 2.77Å; T425-H427 VanDerWaalsContact C-N 3.25Å; T425-H427 PolarHBondContact O-N 2.84Å; T425-K428 PolarHBondContact O-N 3.06Å; T425-I429 WeakPolarHBondContact O-CG1 3.36Å; T425-I429 PolarHBondContact O-N 3.45Å
426	K	78.9	Confident	78.5	Confident	122 Å²	122	72.1 Å²	72.1	53%	0.53	39%	0.385	S	S	.	.	H	α-helix	trans	-63.5	-31.4	175.7	-72.7	172.7	-174.3	-177.8	0	113	S422 S423 L424	S422-K426 WeakPolarHBondContact O-CB 3.22Å; S422-K426 WeakPolarHBondContact O-CG 3.3Å; S422-K426 PolarHBondContact O-N 3.33Å; S422-K426 VanDerWaalsContact O-N 3.08Å; S423-K426 PolarHBondContact O-N 3.23Å; L424-K426 VanDerWaalsContact C-N 3.34Å; L424-K426 PolarHBondContact O-N 3.41Å
427	H	81.6	Confident	78	Confident	19 Å²	19	70.3 Å²	70.3	9%	0.088	38%	0.375	C	S	.	.	H	α-helix	trans	-72.9	-40.8	176.1	174.5	63.2	0	0	0	111.8	C414 F418 S423 L424 T425 I429 I430 H431	C414-H427 PolarHBondContact SG-NE2 3.04Å; F418-H427 HydrophobicContact CE1-CB 4.07Å; F418-H427 HydrophobicContact CE2-CB 3.87Å; F418-H427 AromaticContact CE2-CD2 3.44Å; F418-H427 VanDerWaalsContact CE2-CD2 3.44Å; F418-H427 WeakPolarHBondContact CE2-CD2 3.15Å; F418-H427 AromaticContact CE2-CG 3.65Å; F418-H427 HydrophobicContact CZ-CB 3.48Å; F418-H427 VanDerWaalsContact CZ-CB 3.48Å; F418-H427 AromaticContact CZ-CD2 3.52Å; F418-H427 AromaticContact CZ-CG 3.27Å; F418-H427 AromaticContact CZ-ND1 3.77Å; S423-H427 WeakPolarHBondContact O-CB 3.33Å; S423-H427 PolarHBondContact O-N 3.35Å; L424-H427 CarbonylContact O-C 3.19Å; L424-H427 WeakPolarHBondContact O-CA 3.48Å; L424-H427 WeakPolarHBondContact O-CB 3.46Å; L424-H427 PolarHBondContact O-N 3.28Å; T425-H427 VanDerWaalsContact C-N 3.25Å; T425-H427 PolarHBondContact O-N 2.84Å; H427-I429 PolarHBondContact O-N 2.82Å; H427-I430 WeakPolarHBondContact O-CB 3.3Å; H427-I430 WeakPolarHBondContact O-CG1 3.47Å; H427-I430 PolarHBondContact O-N 3.38Å; H427-H431 AromaticContact CD2-NE2 3.91Å; H427-H431 AromaticContact CE1-NE2 3.64Å; H427-H431 AromaticContact NE2-CD2 3.89Å; H427-H431 AromaticContact NE2-CE1 3.96Å; H427-H431 AromaticContact NE2-NE2 3.13Å; H427-H431 PolarHBondContact NE2-NE2 3.34Å; H427-H431 VanDerWaalsContact NE2-NE2 3.13Å
428	K	78.4	Confident	77.6	Confident	88 Å²	88	74.9 Å²	74.9	38%	0.383	39%	0.387	S	S	.	.	H	α-helix	trans	-59.3	-32.8	176.6	-73.2	-172.8	172.6	-161.9	0	113	L424 T425 I430 H431 T432	L424-K428 HydrophobicContact CD1-CG 4.24Å; L424-K428 HydrophobicContact CG-CG 4.48Å; L424-K428 WeakPolarHBondContact O-CG 3.4Å; L424-K428 PolarHBondContact O-N 3.36Å; T425-K428 PolarHBondContact O-N 3.06Å; K428-I430 PolarHBondContact O-N 3.21Å; K428-I430 VanDerWaalsContact O-N 3.15Å; K428-H431 PolarHBondContact O-N 2.78Å; K428-T432 PolarHBondContact O-N 3.43Å
429	I	79.8	Confident	77.5	Confident	36 Å²	36	72.8 Å²	72.8	19%	0.185	38%	0.378	C	S	.	.	H	α-helix	trans	-59.6	-24.8	174	-62.3	170.2	0	0	0	112.2	T425 H427 T432 G433 E434 N447	T425-I429 WeakPolarHBondContact O-CG1 3.36Å; T425-I429 PolarHBondContact O-N 3.45Å; H427-I429 PolarHBondContact O-N 2.82Å; I429-T432 WeakPolarHBondContact CA-OG1 3.32Å; I429-T432 PolarHBondContact O-OG1 3.1Å; I429-G433 PolarHBondContact O-N 3.47Å; I429-E434 VanDerWaalsContact CG2-O 3.28Å; I429-E434 WeakPolarHBondContact CG2-O 3.5Å; I429-N447 HydrophobicContact CG2-CB 4.09Å
430	I	76.4	Confident	77.5	Confident	85 Å²	85	78.1 Å²	78.1	44%	0.436	40%	0.402	S	S	.	.	H	α-helix	trans	-72	-38.2	177.3	-55.9	173.7	0	0	0	110.7	H427 K428	H427-I430 WeakPolarHBondContact O-CB 3.3Å; H427-I430 WeakPolarHBondContact O-CG1 3.47Å; H427-I430 PolarHBondContact O-N 3.38Å; K428-I430 PolarHBondContact O-N 3.21Å; K428-I430 VanDerWaalsContact O-N 3.15Å
431	H	75.6	Confident	77.3	Confident	78 Å²	78	78.3 Å²	78.3	36%	0.361	41%	0.408	S	S	.	.	H	α-helix	trans	-73.1	-37.1	178.6	-63.4	-54.9	0	0	0	112.1	C411 E413 C414 H427 K428 G433	C411-H431 PolarHBondContact SG-NE2 3.29Å; E413-H431 WeakPolarHBondContact OE2-CB 3.45Å; E413-H431 IonicContact OE2-CD2 3.13Å; E413-H431 PolarHBondContact OE2-CD2 3.33Å; E413-H431 IonicContact OE2-CG 3.94Å; E413-H431 IonicContact OE2-NE2 3.33Å; C414-H431 PolarHBondContact SG-NE2 2.97Å; C414-H431 VanDerWaalsContact SG-NE2 3.41Å; H427-H431 AromaticContact CD2-NE2 3.91Å; H427-H431 AromaticContact CE1-NE2 3.64Å; H427-H431 AromaticContact NE2-CD2 3.89Å; H427-H431 AromaticContact NE2-CE1 3.96Å; H427-H431 AromaticContact NE2-NE2 3.13Å; H427-H431 PolarHBondContact NE2-NE2 3.34Å; H427-H431 VanDerWaalsContact NE2-NE2 3.13Å; K428-H431 PolarHBondContact O-N 2.78Å; H431-G433 VanDerWaalsContact C-N 3.27Å; H431-G433 PolarHBondContact O-N 3.03Å
432	T	71.6	Confident	77.2	Confident	86 Å²	86	77.6 Å²	77.6	53%	0.528	40%	0.402	S	S	.	.	H	α-helix	trans	-77.4	-12.9	177.4	62.4	0	0	0	0	113.4	K428 I429 E434	K428-T432 PolarHBondContact O-N 3.43Å; I429-T432 WeakPolarHBondContact CA-OG1 3.32Å; I429-T432 PolarHBondContact O-OG1 3.1Å; T432-E434 PolarHBondContact O-N 3.21Å; T432-E434 VanDerWaalsContact O-N 3.07Å; T432-E434 WeakPolarHBondContact OG1-CB 3.28Å
433	G	65.4	Low	76.9	Confident	51 Å²	51	77.4 Å²	77.4	53%	0.526	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.8	11	-176	0	0	0	0	0	114.1	I429 H431 K435	I429-G433 PolarHBondContact O-N 3.47Å; H431-G433 VanDerWaalsContact C-N 3.27Å; H431-G433 PolarHBondContact O-N 3.03Å; G433-K435 PolarHBondContact O-N 3.04Å
434	E	70.5	Confident	76.7	Confident	112 Å²	112	82.1 Å²	82.1	52%	0.523	43%	0.426	S	S	.	.			trans	-70.7	113.6	-169.6	-158.6	-171.3	147.7	0	0	110.8	I429 T432 S436	I429-E434 VanDerWaalsContact CG2-O 3.28Å; I429-E434 WeakPolarHBondContact CG2-O 3.5Å; T432-E434 PolarHBondContact O-N 3.21Å; T432-E434 VanDerWaalsContact O-N 3.07Å; T432-E434 WeakPolarHBondContact OG1-CB 3.28Å; E434-S436 PolarHBondContact O-N 3.4Å; E434-S436 PolarHBondContact OE1-OG 3.42Å; E434-S436 VanDerWaalsContact OE1-OG 3.05Å
435	K	72	Confident	76.3	Confident	129 Å²	129	82.6 Å²	82.6	56%	0.561	43%	0.433	S	S	*	.			trans	-98.1	72.3	177.8	-68.3	172.8	173.4	-176.1	0	110.2	G433 Y437 A445 F446	G433-K435 PolarHBondContact O-N 3.04Å; K435-Y437 PolarHBondContact O-N 3.42Å; K435-A445 HydrophobicContact CB-CB 3.57Å; K435-A445 HydrophobicContact CD-CB 4.07Å; K435-A445 WeakPolarHBondContact CD-O 3.04Å; K435-A445 HydrophobicContact CG-CB 4.41Å; K435-F446 CarbonylContact C-O 3.54Å; K435-F446 WeakPolarHBondContact CA-O 3.48Å
436	S	72.4	Confident	76	Confident	63 Å²	63	80.3 Å²	80.3	44%	0.441	42%	0.416	S	S	.	.			trans	-73.5	-9.4	-173.7	-35.3	0	0	0	0	114.2	E434 F446	E434-S436 PolarHBondContact O-N 3.4Å; E434-S436 PolarHBondContact OE1-OG 3.42Å; E434-S436 VanDerWaalsContact OE1-OG 3.05Å; S436-F446 PolarHBondContact N-O 3.48Å
437	Y	73.3	Confident	75.6	Confident	91 Å²	91	77.4 Å²	77.4	36%	0.357	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	103.6	-175.8	-58.4	-77.4	0	0	0	111.2	K435 A445 F446 P449	K435-Y437 PolarHBondContact O-N 3.42Å; Y437-A445 CarbonylContact O-C 3.56Å; Y437-A445 WeakPolarHBondContact O-CA 3.03Å; Y437-F446 PolarHBondContact N-O 3.42Å; Y437-F446 VanDerWaalsContact N-O 3.12Å; Y437-F446 PolarHBondContact O-N 3.04Å; Y437-P449 HydrophobicContact CD1-CB 4.38Å; Y437-P449 HydrophobicContact CD1-CG 4.28Å; Y437-P449 HydrophobicContact CD2-CG 4.36Å; Y437-P449 HydrophobicContact CE1-CB 4.24Å; Y437-P449 HydrophobicContact CE1-CG 3.75Å; Y437-P449 HydrophobicContact CE2-CG 3.83Å; Y437-P449 VanDerWaalsContact CZ-CG 3.5Å
438	K	77.1	Confident	75	Confident	134 Å²	134	81.6 Å²	81.6	58%	0.583	42%	0.421	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.6	141.7	-180	-64.3	-176.8	-178.5	179.6	0	111.7	A445	K438-A445 HydrophobicContact CG-CB 3.97Å
439	C	80.6	Confident	74.8	Confident	1 Å²	1	80.5 Å²	80.5	1%	0.007	42%	0.423	C	S	.	.			trans	-83	116.4	167.7	-177.4	0	0	0	0	108.5	E441 G443 K444 F446 L452 H459	C439-E441 PolarHBondContact O-N 3.48Å; C439-G443 WeakPolarHBondContact O-CA 3.48Å; C439-G443 PolarHBondContact O-N 2.84Å; C439-K444 WeakPolarHBondContact CB-O 3.45Å; C439-K444 PolarHBondContact N-O 3.47Å; C439-F446 HydrophobicContact CB-CE2 4.28Å; C439-L452 HydrophobicContact CB-CD1 3.62Å; C439-H459 PolarHBondContact SG-NE2 3.05Å
440	E	79.6	Confident	74.7	Confident	164 Å²	164	82.3 Å²	82.3	77%	0.766	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-28	179.1	-58.7	-57.6	146	0	0	112.6
441	E	77.2	Confident	74.7	Confident	128 Å²	128	80.8 Å²	80.8	60%	0.598	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-27.9	-176.2	-68.9	168.1	166.8	0	0	113.6	C439 H459	C439-E441 PolarHBondContact O-N 3.48Å; E441-H459 WeakPolarHBondContact OE2-CB 3.49Å; E441-H459 IonicContact OE2-CD2 2.95Å; E441-H459 PolarHBondContact OE2-CD2 3.2Å; E441-H459 IonicContact OE2-CG 3.05Å
442	C	80.2	Confident	74.8	Confident	51 Å²	51	77.9 Å²	77.9	35%	0.345	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135.8	5.2	-176	74.2	0	0	0	0	114.5	K444 H455 H459	C442-K444 PolarHBondContact O-N 3.24Å; C442-H455 PolarHBondContact SG-NE2 3.34Å; C442-H459 PolarHBondContact SG-NE2 3.07Å; C442-H459 VanDerWaalsContact SG-NE2 3.45Å
443	G	74.9	Confident	75.2	Confident	54 Å²	54	77.5 Å²	77.5	56%	0.557	42%	0.418	S	S	*	.			trans	69.2	-4.8	179.8	0	0	0	0	0	115.8	C439 A445	C439-G443 WeakPolarHBondContact O-CA 3.48Å; C439-G443 PolarHBondContact O-N 2.84Å; G443-A445 PolarHBondContact O-N 2.86Å
444	K	78.9	Confident	75.8	Confident	126 Å²	126	79.1 Å²	79.1	55%	0.548	42%	0.418	S	S	.	.			trans	-65.5	130.2	-177	-71.7	-177.2	-179.1	178.6	0	111.3	C439 C442 F446	C439-K444 WeakPolarHBondContact CB-O 3.45Å; C439-K444 PolarHBondContact N-O 3.47Å; C442-K444 PolarHBondContact O-N 3.24Å; K444-F446 HydrophobicContact CB-CE2 3.7Å; K444-F446 HydrophobicContact CB-CZ 3.95Å; K444-F446 WeakPolarHBondContact O-CD2 3.21Å; K444-F446 VanDerWaalsContact O-CE2 3.3Å; K444-F446 WeakPolarHBondContact O-CE2 3.48Å
445	A	75.7	Confident	76.2	Confident	30 Å²	30	74.8 Å²	74.8	25%	0.248	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	137	-179.2	0	0	0	0	0	111.4	K435 Y437 K438 G443	K435-A445 HydrophobicContact CB-CB 3.57Å; K435-A445 HydrophobicContact CD-CB 4.07Å; K435-A445 WeakPolarHBondContact CD-O 3.04Å; K435-A445 HydrophobicContact CG-CB 4.41Å; Y437-A445 CarbonylContact O-C 3.56Å; Y437-A445 WeakPolarHBondContact O-CA 3.03Å; K438-A445 HydrophobicContact CG-CB 3.97Å; G443-A445 PolarHBondContact O-N 2.86Å
446	F	76.2	Confident	76.5	Confident	39 Å²	39	72.8 Å²	72.8	17%	0.171	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	150.3	-175.3	-61.1	-92.4	0	0	0	110.5	K435 S436 Y437 C439 K444 L452 H455	K435-F446 CarbonylContact C-O 3.54Å; K435-F446 WeakPolarHBondContact CA-O 3.48Å; S436-F446 PolarHBondContact N-O 3.48Å; Y437-F446 PolarHBondContact N-O 3.42Å; Y437-F446 VanDerWaalsContact N-O 3.12Å; Y437-F446 PolarHBondContact O-N 3.04Å; C439-F446 HydrophobicContact CB-CE2 4.28Å; K444-F446 HydrophobicContact CB-CE2 3.7Å; K444-F446 HydrophobicContact CB-CZ 3.95Å; K444-F446 WeakPolarHBondContact O-CD2 3.21Å; K444-F446 VanDerWaalsContact O-CE2 3.3Å; K444-F446 WeakPolarHBondContact O-CE2 3.48Å; F446-L452 HydrophobicContact CB-CB 4.32Å; F446-L452 HydrophobicContact CD2-CB 4.09Å; F446-L452 HydrophobicContact CD2-CD1 3.76Å; F446-L452 HydrophobicContact CE2-CD1 3.94Å; F446-L452 HydrophobicContact CG-CB 4.3Å; F446-H455 HydrophobicContact CE1-CB 3.97Å; F446-H455 HydrophobicContact CE2-CB 4.07Å; F446-H455 AromaticContact CE2-CD2 3.43Å; F446-H455 VanDerWaalsContact CE2-CD2 3.43Å; F446-H455 WeakPolarHBondContact CE2-CD2 3.43Å; F446-H455 AromaticContact CE2-CG 3.76Å; F446-H455 HydrophobicContact CZ-CB 3.54Å; F446-H455 AromaticContact CZ-CD2 3.36Å; F446-H455 WeakPolarHBondContact CZ-CD2 3.48Å; F446-H455 AromaticContact CZ-CG 3.22Å; F446-H455 AromaticContact CZ-ND1 3.74Å; F446-H455 AromaticContact CZ-NE2 3.91Å
447	N	70.5	Confident	76.8	Confident	61 Å²	61	76 Å²	76	33%	0.326	39%	0.392	S	S	.	.	S	Bend	trans	-87.4	-7.1	177.7	60.6	9	0	0	0	113.5	I429	I429-N447 HydrophobicContact CG2-CB 4.09Å
448	R	69.8	Low	77.1	Confident	107 Å²	107	77.7 Å²	77.7	40%	0.404	41%	0.405	S	S	.	.			trans	-136.9	141.5	179.7	-66.6	179.1	177	180	1.1	111.1	S450 T451 L452	R448-S450 VanDerWaalsContact C-N 3.31Å; R448-S450 PolarHBondContact O-N 2.87Å; R448-T451 HydrophobicContact CB-CG2 4.28Å; R448-T451 PolarHBondContact O-N 3.41Å; R448-T451 PolarHBondContact O-OG1 2.94Å; R448-L452 PolarHBondContact O-N 3.15Å
449	P	73.4	Confident	77	Confident	65 Å²	65	75 Å²	75	42%	0.422	40%	0.395	S	S	.	.	H	α-helix	trans	-63.1	-38	174.1	-11.9	19.9	0	0	0	112.3	Y437 T451 L452 T453	Y437-P449 HydrophobicContact CD1-CB 4.38Å; Y437-P449 HydrophobicContact CD1-CG 4.28Å; Y437-P449 HydrophobicContact CD2-CG 4.36Å; Y437-P449 HydrophobicContact CE1-CB 4.24Å; Y437-P449 HydrophobicContact CE1-CG 3.75Å; Y437-P449 HydrophobicContact CE2-CG 3.83Å; Y437-P449 VanDerWaalsContact CZ-CG 3.5Å; P449-T451 VanDerWaalsContact C-N 3.32Å; P449-T451 PolarHBondContact O-N 2.85Å; P449-L452 WeakPolarHBondContact O-CB 3.25Å; P449-L452 PolarHBondContact O-N 3.27Å; P449-T453 PolarHBondContact O-N 3.27Å; P449-T453 PolarHBondContact O-OG1 3.06Å
450	S	76.8	Confident	76.5	Confident	74 Å²	74	79.1 Å²	79.1	52%	0.517	42%	0.42	S	S	.	.	H	α-helix	trans	-64.6	-35.8	-178.3	56.5	0	0	0	0	112.5	R448 T453 V454	R448-S450 VanDerWaalsContact C-N 3.31Å; R448-S450 PolarHBondContact O-N 2.87Å; S450-T453 PolarHBondContact O-N 3.18Å; S450-V454 WeakPolarHBondContact O-CG2 3.25Å; S450-V454 PolarHBondContact O-N 3.13Å
451	T	77.1	Confident	75.5	Confident	52 Å²	52	74.5 Å²	74.5	32%	0.319	42%	0.416	S	S	.	.	H	α-helix	trans	-73.6	-35.3	176.2	51	0	0	0	0	111.3	R448 P449 V454 H455	R448-T451 HydrophobicContact CB-CG2 4.28Å; R448-T451 PolarHBondContact O-N 3.41Å; R448-T451 PolarHBondContact O-OG1 2.94Å; P449-T451 VanDerWaalsContact C-N 3.32Å; P449-T451 PolarHBondContact O-N 2.85Å; T451-V454 PolarHBondContact O-N 3.41Å; T451-H455 VanDerWaalsContact O-CB 3.25Å; T451-H455 WeakPolarHBondContact O-CB 3.36Å; T451-H455 PolarHBondContact O-N 2.93Å
452	L	78.2	Confident	74.4	Confident	18 Å²	18	76.6 Å²	76.6	9%	0.094	42%	0.423	C	S	.	.	H	α-helix	trans	-62.2	-43.5	168.8	176	61.6	0	0	0	111.6	C439 F446 R448 P449 V454 H455 K456	C439-L452 HydrophobicContact CB-CD1 3.62Å; F446-L452 HydrophobicContact CB-CB 4.32Å; F446-L452 HydrophobicContact CD2-CB 4.09Å; F446-L452 HydrophobicContact CD2-CD1 3.76Å; F446-L452 HydrophobicContact CE2-CD1 3.94Å; F446-L452 HydrophobicContact CG-CB 4.3Å; R448-L452 PolarHBondContact O-N 3.15Å; P449-L452 WeakPolarHBondContact O-CB 3.25Å; P449-L452 PolarHBondContact O-N 3.27Å; L452-V454 PolarHBondContact O-N 3.34Å; L452-H455 PolarHBondContact O-N 3.05Å; L452-K456 HydrophobicContact CD1-CD 4.4Å; L452-K456 HydrophobicContact CD1-CG 4.12Å; L452-K456 HydrophobicContact CG-CD 4.36Å; L452-K456 HydrophobicContact CG-CG 4.46Å; L452-K456 WeakPolarHBondContact O-CB 3.3Å; L452-K456 WeakPolarHBondContact O-CG 3.38Å; L452-K456 PolarHBondContact O-N 3.45Å
453	T	78.7	Confident	72.7	Confident	77 Å²	77	83.1 Å²	83.1	47%	0.472	45%	0.449	S	S	.	.	H	α-helix	trans	-61.8	-42.8	177.7	-55.3	0	0	0	0	111.9	P449 S450 K456 R457	P449-T453 PolarHBondContact O-N 3.27Å; P449-T453 PolarHBondContact O-OG1 3.06Å; S450-T453 PolarHBondContact O-N 3.18Å; T453-K456 PolarHBondContact O-N 3.49Å; T453-R457 PolarHBondContact O-N 3.06Å
454	V	79.2	Confident	71.4	Confident	85 Å²	85	88.8 Å²	88.8	52%	0.515	46%	0.46	S	S	.	.	H	α-helix	trans	-65.9	-42.1	174.4	172.9	0	0	0	0	110.7	S450 T451 L452 K456 R457	S450-V454 WeakPolarHBondContact O-CG2 3.25Å; S450-V454 PolarHBondContact O-N 3.13Å; T451-V454 PolarHBondContact O-N 3.41Å; L452-V454 PolarHBondContact O-N 3.34Å; V454-K456 VanDerWaalsContact C-N 3.34Å; V454-K456 PolarHBondContact O-N 2.99Å; V454-R457 VanDerWaalsContact O-CB 3.3Å; V454-R457 WeakPolarHBondContact O-CB 3.38Å; V454-R457 PolarHBondContact O-N 2.81Å
455	H	79.3	Confident	69.3	Low	22 Å²	22	92 Å²	92	10%	0.102	50%	0.498	C	S	.	.	H	α-helix	trans	-61.5	-40.5	176.7	177.4	64.6	0	0	0	112.7	C442 F446 T451 L452 R457 I458 H459	C442-H455 PolarHBondContact SG-NE2 3.34Å; F446-H455 HydrophobicContact CE1-CB 3.97Å; F446-H455 HydrophobicContact CE2-CB 4.07Å; F446-H455 AromaticContact CE2-CD2 3.43Å; F446-H455 VanDerWaalsContact CE2-CD2 3.43Å; F446-H455 WeakPolarHBondContact CE2-CD2 3.43Å; F446-H455 AromaticContact CE2-CG 3.76Å; F446-H455 HydrophobicContact CZ-CB 3.54Å; F446-H455 AromaticContact CZ-CD2 3.36Å; F446-H455 WeakPolarHBondContact CZ-CD2 3.48Å; F446-H455 AromaticContact CZ-CG 3.22Å; F446-H455 AromaticContact CZ-ND1 3.74Å; F446-H455 AromaticContact CZ-NE2 3.91Å; T451-H455 VanDerWaalsContact O-CB 3.25Å; T451-H455 WeakPolarHBondContact O-CB 3.36Å; T451-H455 PolarHBondContact O-N 2.93Å; L452-H455 PolarHBondContact O-N 3.05Å; H455-R457 PolarHBondContact O-N 3.12Å; H455-I458 VanDerWaalsContact O-CB 3.25Å; H455-I458 WeakPolarHBondContact O-CB 3.37Å; H455-I458 WeakPolarHBondContact O-CG1 3.46Å; H455-I458 PolarHBondContact O-N 3.28Å; H455-H459 AromaticContact CE1-NE2 3.93Å; H455-H459 AromaticContact NE2-NE2 3.34Å; H455-H459 PolarHBondContact NE2-NE2 3.18Å
456	K	77.1	Confident	68.9	Low	87 Å²	87	95.1 Å²	95.1	38%	0.378	51%	0.511	S	S	.	.	H	α-helix	trans	-62.9	-20.4	174.4	-74.6	-176.2	175.1	-165.3	0	113.3	L452 T453 V454 I458 H459 T460	L452-K456 HydrophobicContact CD1-CD 4.4Å; L452-K456 HydrophobicContact CD1-CG 4.12Å; L452-K456 HydrophobicContact CG-CD 4.36Å; L452-K456 HydrophobicContact CG-CG 4.46Å; L452-K456 WeakPolarHBondContact O-CB 3.3Å; L452-K456 WeakPolarHBondContact O-CG 3.38Å; L452-K456 PolarHBondContact O-N 3.45Å; T453-K456 PolarHBondContact O-N 3.49Å; V454-K456 VanDerWaalsContact C-N 3.34Å; V454-K456 PolarHBondContact O-N 2.99Å; K456-I458 VanDerWaalsContact C-N 3.26Å; K456-I458 PolarHBondContact O-N 3.43Å; K456-H459 PolarHBondContact O-N 3.35Å; K456-T460 PolarHBondContact O-N 3.44Å; K456-T460 PolarHBondContact O-OG1 3.03Å
457	R	80.2	Confident	68.6	Low	131 Å²	131	98 Å²	98	49%	0.494	53%	0.529	S	S	.	.	H	α-helix	trans	-68.9	-26.6	172.8	-65.8	179.2	-175.3	-179.2	-2	112.7	T453 V454 H455 H459 T460 G461	T453-R457 PolarHBondContact O-N 3.06Å; V454-R457 VanDerWaalsContact O-CB 3.3Å; V454-R457 WeakPolarHBondContact O-CB 3.38Å; V454-R457 PolarHBondContact O-N 2.81Å; H455-R457 PolarHBondContact O-N 3.12Å; R457-H459 VanDerWaalsContact C-N 3.34Å; R457-T460 WeakPolarHBondContact CA-OG1 3.18Å; R457-T460 PolarHBondContact O-N 3.45Å; R457-T460 PolarHBondContact O-OG1 2.75Å; R457-G461 PolarHBondContact O-N 2.8Å
458	I	77.9	Confident	68.4	Low	125 Å²	125	100.1 Å²	100.1	64%	0.641	54%	0.54	S	S	*	.	H	α-helix	trans	-67.4	-38.3	176.9	-55	174.8	0	0	0	110.2	H455 K456 T460	H455-I458 VanDerWaalsContact O-CB 3.25Å; H455-I458 WeakPolarHBondContact O-CB 3.37Å; H455-I458 WeakPolarHBondContact O-CG1 3.46Å; H455-I458 PolarHBondContact O-N 3.28Å; K456-I458 VanDerWaalsContact C-N 3.26Å; K456-I458 PolarHBondContact O-N 3.43Å; I458-T460 VanDerWaalsContact C-N 3.32Å
459	H	75.3	Confident	68.4	Low	79 Å²	79	99.6 Å²	99.6	37%	0.366	55%	0.548	S	S	.	.	H	α-helix	trans	-73.6	-23.9	176	-61.7	-51.4	0	0	0	113.4	C439 E441 C442 H455 K456 R457	C439-H459 PolarHBondContact SG-NE2 3.05Å; E441-H459 WeakPolarHBondContact OE2-CB 3.49Å; E441-H459 IonicContact OE2-CD2 2.95Å; E441-H459 PolarHBondContact OE2-CD2 3.2Å; E441-H459 IonicContact OE2-CG 3.05Å; C442-H459 PolarHBondContact SG-NE2 3.07Å; C442-H459 VanDerWaalsContact SG-NE2 3.45Å; H455-H459 AromaticContact CE1-NE2 3.93Å; H455-H459 AromaticContact NE2-NE2 3.34Å; H455-H459 PolarHBondContact NE2-NE2 3.18Å; K456-H459 PolarHBondContact O-N 3.35Å; R457-H459 VanDerWaalsContact C-N 3.34Å
460	T	69.8	Low	68	Low	87 Å²	87	101.8 Å²	101.8	53%	0.534	56%	0.556	S	S	.	*	T	Hydrogen-bonded Turn	trans	-99.1	6.7	-177.5	48.9	0	0	0	0	113.7	K456 R457 I458 K462	K456-T460 PolarHBondContact O-N 3.44Å; K456-T460 PolarHBondContact O-OG1 3.03Å; R457-T460 WeakPolarHBondContact CA-OG1 3.18Å; R457-T460 PolarHBondContact O-N 3.45Å; R457-T460 PolarHBondContact O-OG1 2.75Å; I458-T460 VanDerWaalsContact C-N 3.32Å; T460-K462 PolarHBondContact O-N 3.35Å; T460-K462 VanDerWaalsContact O-N 3.1Å
461	G	60.1	Low	67.5	Low	67 Å²	67	103.7 Å²	103.7	69%	0.691	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	61.8	18.9	170.2	0	0	0	0	0	115.9	R457 E463	R457-G461 PolarHBondContact O-N 2.8Å; G461-E463 PolarHBondContact O-N 3.39Å
462	K	53.2	Low	66.8	Low	172 Å²	172	107.4 Å²	107.4	75%	0.748	58%	0.576	S	S	*	*			trans	-93.7	88.4	176.1	-74.9	-170.5	176.7	-175.8	0	110.2	T460	T460-K462 PolarHBondContact O-N 3.35Å; T460-K462 VanDerWaalsContact O-N 3.1Å
463	E	45.2	Very low	65.9	Low	187 Å²	187	114.2 Å²	114.2	87%	0.874	61%	0.613	S	S	*	*			trans	-64.3	154	162.2	-70.7	-161.4	149.9	0	0	111.2	G461	G461-E463 PolarHBondContact O-N 3.39Å
464	H	46.4	Very low	64.8	Low	174 Å²	174	117.3 Å²	117.3	81%	0.806	62%	0.624	S	S	*	*			trans	-58.6	135.6	-170.4	-89.3	-96.3	0	0	0	114
465	S	34.4	Very low	63.5	Low	192 Å²	192	120.3 Å²	120.3	100%	1.343	63%	0.634	S	S	*	*			trans	-124.4	0	148.6	-44.1	0	0	0	0	107.9

Retrieved 465 of 465 residues in 356.5 ms (Link to these results)

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