X5DNQ7_HUMAN Loading...

Interleukin-1 receptor accessory protein-like 1

May regulate secretion and presynaptic differentiation through inhibition of the activity of N-type voltage-gated calcium channel. May activate the MAP kinase JNK. Plays a role in neurite outgrowth. During dendritic spine formation can bidirectionally induce pre- and post-synaptic differentiation of neurons by trans-synaptically binding to PTPRD.

AlphaFold DB (P60029), UniProt , Accession X5DNQ7, Species HUMAN (Homo sapiens, Human), Gene IL1RAPL1, Length 696 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	41.1	Very low	54.8	Low	248 Å²	248	134.5 Å²	134.5	100%	1.222	72%	0.717	S	S	*	*				0	137	0	-78	147.7	154	0	0	108.7
2	K	45.2	Very low	55.4	Low	219 Å²	219	136.9 Å²	136.9	95%	0.952	71%	0.71	S	S	*	*			trans	-95.2	109.2	178.4	-69.8	175.3	176.8	176.6	0	108.7
3	A	50.3	Low	55.9	Low	94 Å²	94	129.7 Å²	129.7	78%	0.777	68%	0.683	S	S	*	*			trans	-96.8	149.7	167.9	0	0	0	0	0	109.5
4	P	52.2	Low	56.2	Low	111 Å²	111	125.6 Å²	125.6	72%	0.721	67%	0.666	S	S	*	*			trans	-98.9	-178.2	-139.2	36.4	-35.3	0	0	0	115.5	P6	P4-P6 HydrophobicContact CG-CG 4.36Å; P4-P6 VanDerWaalsContact O-CD 3.32Å; P4-P6 WeakPolarHBondContact O-CD 3.39Å
5	I	62.8	Low	56.2	Low	128 Å²	128	126.4 Å²	126.4	66%	0.656	66%	0.662	S	S	*	*	S	Bend	trans	-84.4	-6	-168.3	-67.9	157.7	0	0	0	116.9	H7 L8 I9	I5-H7 PolarHBondContact O-N 3.31Å; I5-L8 PolarHBondContact O-N 2.65Å; I5-I9 HydrophobicContact CG2-CD1 4.15Å; I5-I9 HydrophobicContact CG2-CG1 4.34Å
6	P	57.6	Low	56.3	Low	79 Å²	79	122.7 Å²	122.7	51%	0.513	65%	0.646	S	S	.	*	H	α-helix	trans	-70.2	-26	-163.7	30.2	-35.3	0	0	0	114.7	P4 L8 I9 L10	P4-P6 HydrophobicContact CG-CG 4.36Å; P4-P6 VanDerWaalsContact O-CD 3.32Å; P4-P6 WeakPolarHBondContact O-CD 3.39Å; P6-L8 VanDerWaalsContact C-N 3.34Å; P6-L8 PolarHBondContact O-N 3.47Å; P6-I9 PolarHBondContact O-N 2.89Å; P6-L10 PolarHBondContact O-N 3.08Å; P6-L10 VanDerWaalsContact O-N 3.12Å
7	H	55.4	Low	56.1	Low	145 Å²	145	123.5 Å²	123.5	67%	0.671	65%	0.646	S	S	*	*	H	α-helix	trans	-67.4	-31.9	178.3	-76.6	-69.1	0	0	0	113.4	I5 L10 L11	I5-H7 PolarHBondContact O-N 3.31Å; H7-L10 PolarHBondContact O-N 2.73Å; H7-L11 WeakPolarHBondContact O-CB 3.46Å; H7-L11 PolarHBondContact O-N 3.37Å
8	L	56.6	Low	55.9	Low	118 Å²	118	120.1 Å²	120.1	62%	0.618	63%	0.634	S	S	*	*	H	α-helix	trans	-71	-34.8	178.8	-150.5	81	0	0	0	111.6	I5 P6 Y12	I5-L8 PolarHBondContact O-N 2.65Å; P6-L8 VanDerWaalsContact C-N 3.34Å; P6-L8 PolarHBondContact O-N 3.47Å; L8-Y12 PolarHBondContact O-N 3.3Å
9	I	62.5	Low	55.4	Low	113 Å²	113	119.1 Å²	119.1	58%	0.579	63%	0.628	S	S	*	*	H	α-helix	trans	-71	-39.9	176.5	-59.7	177	0	0	0	110.4	I5 P6 Y12 A13	I5-I9 HydrophobicContact CG2-CD1 4.15Å; I5-I9 HydrophobicContact CG2-CG1 4.34Å; P6-I9 PolarHBondContact O-N 2.89Å; I9-Y12 PolarHBondContact O-N 3.49Å; I9-A13 WeakPolarHBondContact O-CB 3.08Å; I9-A13 PolarHBondContact O-N 2.95Å
10	L	58.8	Low	54.7	Low	117 Å²	117	121.4 Å²	121.4	61%	0.613	63%	0.633	S	S	*	*	H	α-helix	trans	-65.3	-41	176.4	-154.2	79.1	0	0	0	111.7	P6 H7 A13 T14	P6-L10 PolarHBondContact O-N 3.08Å; P6-L10 VanDerWaalsContact O-N 3.12Å; H7-L10 PolarHBondContact O-N 2.73Å; L10-A13 PolarHBondContact O-N 3.21Å; L10-T14 PolarHBondContact O-N 3.25Å; L10-T14 PolarHBondContact O-OG1 2.8Å
11	L	60.9	Low	54	Low	107 Å²	107	121.1 Å²	121.1	56%	0.56	64%	0.636	S	S	*	*	H	α-helix	trans	-63	-42.2	172.4	-85.4	161.8	0	0	0	112.2	H7 A13 T14 F15	H7-L11 WeakPolarHBondContact O-CB 3.46Å; H7-L11 PolarHBondContact O-N 3.37Å; L11-A13 VanDerWaalsContact C-N 3.34Å; L11-A13 PolarHBondContact O-N 3.47Å; L11-T14 PolarHBondContact O-N 2.97Å; L11-T14 PolarHBondContact O-OG1 2.88Å; L11-T14 VanDerWaalsContact O-OG1 3.08Å; L11-F15 WeakPolarHBondContact O-CB 3.45Å; L11-F15 PolarHBondContact O-N 3.17Å
12	Y	61.8	Low	53.9	Low	164 Å²	164	114.3 Å²	114.3	64%	0.643	61%	0.608	S	S	*	*	H	α-helix	trans	-65.4	-34.9	173.9	-104.6	-88.4	0	0	0	112.9	L8 I9 T16	L8-Y12 PolarHBondContact O-N 3.3Å; I9-Y12 PolarHBondContact O-N 3.49Å; Y12-T16 WeakPolarHBondContact O-CB 3.38Å; Y12-T16 VanDerWaalsContact O-CG2 3.29Å; Y12-T16 WeakPolarHBondContact O-CG2 3.34Å; Y12-T16 PolarHBondContact O-N 2.74Å; Y12-T16 PolarHBondContact O-OG1 3.22Å
13	A	61.7	Low	53.4	Low	43 Å²	43	109.2 Å²	109.2	36%	0.355	60%	0.596	S	S	.	*	H	α-helix	trans	-67.1	-44.7	175.8	0	0	0	0	0	111.8	I9 L10 L11 T16 Q17	I9-A13 WeakPolarHBondContact O-CB 3.08Å; I9-A13 PolarHBondContact O-N 2.95Å; L10-A13 PolarHBondContact O-N 3.21Å; L11-A13 VanDerWaalsContact C-N 3.34Å; L11-A13 PolarHBondContact O-N 3.47Å; A13-T16 PolarHBondContact O-N 2.98Å; A13-T16 PolarHBondContact O-OG1 2.84Å; A13-Q17 WeakPolarHBondContact O-CB 3.31Å; A13-Q17 PolarHBondContact O-N 2.96Å
14	T	59.7	Low	52.7	Low	73 Å²	73	113 Å²	113	45%	0.448	60%	0.595	S	S	.	*	H	α-helix	trans	-68.9	-38.5	176.4	56.1	0	0	0	0	112	L10 L11 Q17 S18	L10-T14 PolarHBondContact O-N 3.25Å; L10-T14 PolarHBondContact O-OG1 2.8Å; L11-T14 PolarHBondContact O-N 2.97Å; L11-T14 PolarHBondContact O-OG1 2.88Å; L11-T14 VanDerWaalsContact O-OG1 3.08Å; T14-Q17 PolarHBondContact O-N 3.46Å; T14-S18 PolarHBondContact O-N 2.6Å; T14-S18 PolarHBondContact O-OG 2.98Å
15	F	57.1	Low	52	Low	137 Å²	137	119.2 Å²	119.2	60%	0.601	60%	0.604	S	S	*	*	H	α-helix	trans	-66.6	-37.7	174.5	-126.3	-99.6	0	0	0	112.8	L11 S18 L19	L11-F15 WeakPolarHBondContact O-CB 3.45Å; L11-F15 PolarHBondContact O-N 3.17Å; F15-S18 WeakPolarHBondContact CA-OG 3.29Å; F15-S18 PolarHBondContact O-OG 2.98Å; F15-S18 VanDerWaalsContact O-OG 3.11Å; F15-L19 HydrophobicContact CD1-CD1 3.95Å; F15-L19 VanDerWaalsContact O-CB 3.27Å; F15-L19 WeakPolarHBondContact O-CB 3.33Å; F15-L19 WeakPolarHBondContact O-CD1 3.44Å; F15-L19 WeakPolarHBondContact O-CG 3.41Å; F15-L19 PolarHBondContact O-N 3.11Å
16	T	56.7	Low	50.6	Low	67 Å²	67	116.3 Å²	116.3	41%	0.411	61%	0.605	S	S	.	*	H	α-helix	trans	-76.5	-27.4	177.1	52.5	0	0	0	0	113	Y12 A13 K20	Y12-T16 WeakPolarHBondContact O-CB 3.38Å; Y12-T16 VanDerWaalsContact O-CG2 3.29Å; Y12-T16 WeakPolarHBondContact O-CG2 3.34Å; Y12-T16 PolarHBondContact O-N 2.74Å; Y12-T16 PolarHBondContact O-OG1 3.22Å; A13-T16 PolarHBondContact O-N 2.98Å; A13-T16 PolarHBondContact O-OG1 2.84Å; T16-K20 WeakPolarHBondContact O-CB 3.44Å; T16-K20 WeakPolarHBondContact O-CG 3.24Å; T16-K20 PolarHBondContact O-N 2.81Å
17	Q	53.2	Low	49.4	Very low	137 Å²	137	115.7 Å²	115.7	64%	0.64	60%	0.603	S	S	*	*	H	α-helix	trans	-71.2	-43	167.9	-80.7	-178.9	-32.2	0	0	112	A13 T14 K20 V21	A13-Q17 WeakPolarHBondContact O-CB 3.31Å; A13-Q17 PolarHBondContact O-N 2.96Å; T14-Q17 PolarHBondContact O-N 3.46Å; Q17-K20 PolarHBondContact O-N 3.4Å; Q17-V21 WeakPolarHBondContact O-CG2 3.41Å; Q17-V21 PolarHBondContact O-N 2.85Å
18	S	52.1	Low	49.3	Very low	61 Å²	61	111.3 Å²	111.3	43%	0.427	59%	0.592	S	S	.	*	H	α-helix	trans	-68	-36.5	175.7	58.2	0	0	0	0	112.6	T14 F15 K20 V21 V22	T14-S18 PolarHBondContact O-N 2.6Å; T14-S18 PolarHBondContact O-OG 2.98Å; F15-S18 WeakPolarHBondContact CA-OG 3.29Å; F15-S18 PolarHBondContact O-OG 2.98Å; F15-S18 VanDerWaalsContact O-OG 3.11Å; S18-K20 PolarHBondContact O-N 3.23Å; S18-V21 PolarHBondContact O-N 3.02Å; S18-V22 WeakPolarHBondContact O-CG2 3.48Å; S18-V22 PolarHBondContact O-N 3.47Å
19	L	46.4	Very low	49.7	Very low	101 Å²	101	112.5 Å²	112.5	53%	0.529	60%	0.599	S	S	.	*	H	α-helix	trans	-61.8	-39.5	169.4	-87.7	156.5	0	0	0	112.8	F15 V21 V22 T23	F15-L19 HydrophobicContact CD1-CD1 3.95Å; F15-L19 VanDerWaalsContact O-CB 3.27Å; F15-L19 WeakPolarHBondContact O-CB 3.33Å; F15-L19 WeakPolarHBondContact O-CD1 3.44Å; F15-L19 WeakPolarHBondContact O-CG 3.41Å; F15-L19 PolarHBondContact O-N 3.11Å; L19-V21 VanDerWaalsContact C-N 3.29Å; L19-V21 PolarHBondContact O-N 2.93Å; L19-V22 PolarHBondContact O-N 2.83Å; L19-T23 PolarHBondContact O-N 2.92Å; L19-T23 PolarHBondContact O-OG1 3.47Å
20	K	41.4	Very low	50.6	Low	166 Å²	166	109.4 Å²	109.4	72%	0.722	60%	0.595	S	S	*	*	H	α-helix	trans	-70.2	-21.5	174.7	-81.6	179.6	174.3	178.7	0	114	T16 Q17 S18 T23	T16-K20 WeakPolarHBondContact O-CB 3.44Å; T16-K20 WeakPolarHBondContact O-CG 3.24Å; T16-K20 PolarHBondContact O-N 2.81Å; Q17-K20 PolarHBondContact O-N 3.4Å; S18-K20 PolarHBondContact O-N 3.23Å; K20-T23 PolarHBondContact O-OG1 3.42Å
21	V	39.6	Very low	52	Low	116 Å²	116	105.9 Å²	105.9	70%	0.703	58%	0.579	S	S	*	*	H	α-helix	trans	-79.6	-28.4	173.9	169.9	0	0	0	0	111.8	Q17 S18 L19	Q17-V21 WeakPolarHBondContact O-CG2 3.41Å; Q17-V21 PolarHBondContact O-N 2.85Å; S18-V21 PolarHBondContact O-N 3.02Å; L19-V21 VanDerWaalsContact C-N 3.29Å; L19-V21 PolarHBondContact O-N 2.93Å
22	V	40.2	Very low	53.5	Low	104 Å²	104	104.1 Å²	104.1	63%	0.63	57%	0.573	S	S	*	*	H	α-helix	trans	-77.7	-21.4	177.5	176.1	0	0	0	0	112.8	S18 L19 K24	S18-V22 WeakPolarHBondContact O-CG2 3.48Å; S18-V22 PolarHBondContact O-N 3.47Å; L19-V22 PolarHBondContact O-N 2.83Å; V22-K24 PolarHBondContact O-N 3.24Å
23	T	34.1	Very low	55	Low	113 Å²	113	100.3 Å²	100.3	69%	0.693	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	37.6	178.5	55.4	0	0	0	0	114.5	L19 K20	L19-T23 PolarHBondContact O-N 2.92Å; L19-T23 PolarHBondContact O-OG1 3.47Å; K20-T23 PolarHBondContact O-OG1 3.42Å
24	K	35.9	Very low	56.5	Low	173 Å²	173	103.8 Å²	103.8	75%	0.752	57%	0.568	S	S	*	*			trans	-115.2	26.4	174.5	-129.1	-170.9	-175	-167	0	114.6	V22 G26	V22-K24 PolarHBondContact O-N 3.24Å; K24-G26 PolarHBondContact O-N 2.93Å
25	R	37.5	Very low	58.1	Low	241 Å²	241	103.9 Å²	103.9	91%	0.909	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.1	55.4	176.2	-74.7	-176.2	169	169.6	-2.7	113.3
26	G	33.4	Very low	59.9	Low	67 Å²	67	100.2 Å²	100.2	69%	0.691	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-169.8	21.1	-176.5	0	0	0	0	0	116.9	K24	K24-G26 PolarHBondContact O-N 2.93Å
27	S	32.4	Very low	61.7	Low	66 Å²	66	98 Å²	98	46%	0.462	54%	0.543	S	S	.	.			trans	-82.7	128.1	167.4	-138.8	0	0	0	0	108.7	D29	S27-D29 PolarHBondContact O-N 3.18Å; S27-D29 VanDerWaalsContact O-N 3.09Å; S27-D29 PolarHBondContact OG-OD2 3.08Å
28	A	53.8	Low	63.7	Low	53 Å²	53	99 Å²	99	44%	0.438	55%	0.551	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.8	-11.9	-177.3	0	0	0	0	0	114.1	R121	A28-R121 PolarHBondContact O-NH2 3.48Å; A28-R121 VanDerWaalsContact O-NH2 3.07Å
29	D	65	Low	65.7	Low	144 Å²	144	100.3 Å²	100.3	77%	0.77	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-12.3	-170.8	-38.7	-68.1	0	0	0	113.9	S27	S27-D29 PolarHBondContact O-N 3.18Å; S27-D29 VanDerWaalsContact O-N 3.09Å; S27-D29 PolarHBondContact OG-OD2 3.08Å
30	G	80	Confident	68	Low	48 Å²	48	101.7 Å²	101.7	50%	0.495	55%	0.551	S	S	.	*			trans	-130.2	136.2	-176.7	0	0	0	0	0	113.1
31	C	89.3	Confident	70.6	Confident	42 Å²	42	95.2 Å²	95.2	28%	0.284	52%	0.522	S	S	.	.			trans	-88.3	141.3	168.3	-151.7	0	0	0	0	110	D33 C126 M127	C31-D33 PolarHBondContact O-N 3.26Å; C31-D33 VanDerWaalsContact O-N 3.08Å; C31-C126 HydrophobicContact CB-CB 3.86Å; C31-C126 WeakPolarHBondContact CB-SG 3.49Å; C31-C126 WeakPolarHBondContact SG-CB 3.29Å; C31-C126 CovalentContact SG-SG 2.05Å; C31-C126 PolarHBondContact SG-SG 2.97Å; C31-M127 PolarHBondContact SG-N 3.31Å
32	T	93	Very high	73.2	Confident	70 Å²	70	93.3 Å²	93.3	43%	0.429	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	100.2	173.7	-55.5	0	0	0	0	108.8	C126 M127 K128	T32-C126 PolarHBondContact N-O 3Å; T32-C126 PolarHBondContact OG1-O 3.45Å; T32-M127 HydrophobicContact CG2-CE 4.22Å; T32-M127 CarbonylContact O-C 3.57Å; T32-M127 WeakPolarHBondContact O-CA 3.36Å; T32-K128 PolarHBondContact O-N 3.08Å
33	D	92.7	Very high	75.9	Confident	85 Å²	85	88.6 Å²	88.6	46%	0.455	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	122.3	-178	-168.2	-6.1	0	0	0	111.2	C31 S35 K128	C31-D33 PolarHBondContact O-N 3.26Å; C31-D33 VanDerWaalsContact O-N 3.08Å; D33-S35 VanDerWaalsContact C-N 3.35Å; D33-S35 WeakPolarHBondContact OD1-CA 3.34Å; D33-S35 PolarHBondContact OD1-N 2.94Å; D33-K128 HydrophobicContact CB-CG 4.11Å; D33-K128 WeakPolarHBondContact OD1-CE 3.35Å; D33-K128 WeakPolarHBondContact OD2-CE 3.23Å; D33-K128 IonicContact OD2-NZ 3.22Å; D33-K128 PolarHBondContact OD2-NZ 3.07Å
34	W	94	Very high	78.9	Confident	115 Å²	115	84.1 Å²	84.1	44%	0.436	45%	0.449	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	5.9	175.1	-68.7	101.8	0	0	0	113.6	Y59 M127 K128 V129	W34-Y59 HydrophobicContact CB-CD1 4.16Å; W34-Y59 HydrophobicContact CB-CE1 3.72Å; W34-Y59 AromaticContact CD1-CD1 3.96Å; W34-Y59 AromaticContact CD2-CD1 3.44Å; W34-Y59 HydrophobicContact CD2-CD1 3.44Å; W34-Y59 VanDerWaalsContact CD2-CD1 3.44Å; W34-Y59 AromaticContact CD2-CE1 3.65Å; W34-Y59 HydrophobicContact CD2-CE1 3.65Å; W34-Y59 AromaticContact CE2-CD1 3.72Å; W34-Y59 AromaticContact CE3-CD1 3.78Å; W34-Y59 HydrophobicContact CE3-CD1 3.78Å; W34-Y59 AromaticContact CE3-CE1 3.73Å; W34-Y59 HydrophobicContact CE3-CE1 3.73Å; W34-Y59 AromaticContact CG-CD1 3.61Å; W34-Y59 HydrophobicContact CG-CD1 3.61Å; W34-Y59 AromaticContact CG-CE1 3.67Å; W34-Y59 HydrophobicContact CG-CE1 3.67Å; W34-Y59 HydrophobicContact CZ2-CD1 4.29Å; W34-Y59 HydrophobicContact CZ3-CD1 4.33Å; W34-Y59 AromaticContact NE1-CD1 4Å; W34-M127 HydrophobicContact CZ2-CE 4.17Å; W34-M127 PolarHBondContact NE1-SD 3.32Å; W34-K128 PolarHBondContact N-O 3.28Å; W34-V129 HydrophobicContact CB-CB 4.09Å; W34-V129 HydrophobicContact CB-CG2 3.92Å
35	S	93.2	Very high	81.8	Confident	75 Å²	75	78.4 Å²	78.4	52%	0.524	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	59.1	-140.9	-172.9	-164.2	0	0	0	0	111.2	D33 V129 S130	D33-S35 VanDerWaalsContact C-N 3.35Å; D33-S35 WeakPolarHBondContact OD1-CA 3.34Å; D33-S35 PolarHBondContact OD1-N 2.94Å; S35-V129 WeakPolarHBondContact O-CG2 3.4Å; S35-S130 PolarHBondContact O-N 2.91Å
36	I	93.5	Very high	84.5	Confident	60 Å²	60	68.6 Å²	68.6	31%	0.308	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	131.2	-174.3	-54.3	171.7	0	0	0	110.7	P82 L115 S130	I36-P82 HydrophobicContact CD1-CG 4.26Å; I36-L115 HydrophobicContact CD1-CD1 3.7Å; I36-L115 HydrophobicContact CD1-CD2 3.99Å; I36-L115 HydrophobicContact CG1-CD1 4.11Å; I36-L115 HydrophobicContact CG1-CD2 4.38Å; I36-L115 HydrophobicContact CG2-CD2 4.49Å; I36-S130 CarbonylContact C-O 3.56Å; I36-S130 VanDerWaalsContact CA-O 3.23Å; I36-S130 WeakPolarHBondContact CA-O 3.35Å
37	D	95.5	Very high	87.5	Confident	20 Å²	20	65.5 Å²	65.5	11%	0.107	37%	0.37	C	S	.	.			trans	-64.3	155.1	175.7	-179	49.4	0	0	0	112.8	K39 A54 Y59 V129 S130 I131	D37-K39 VanDerWaalsContact C-N 3.33Å; D37-K39 PolarHBondContact O-N 2.87Å; D37-K39 VanDerWaalsContact OD2-CB 3.3Å; D37-K39 WeakPolarHBondContact OD2-CB 3.44Å; D37-K39 PolarHBondContact OD2-N 2.9Å; D37-A54 HydrophobicContact CB-CB 3.88Å; D37-A54 VanDerWaalsContact CG-CB 3.46Å; D37-Y59 PolarHBondContact OD1-OH 3.14Å; D37-V129 HydrophobicContact CB-CG2 3.99Å; D37-S130 PolarHBondContact N-O 3.29Å; D37-I131 HydrophobicContact CB-CG1 4.33Å
38	I	94.5	Very high	90.5	Very high	159 Å²	159	62.5 Å²	62.5	82%	0.815	35%	0.348	S	S	*	.	S	Bend	trans	-67.8	-30.7	177.9	-165.3	169.4	0	0	0	112.5	K40	I38-K40 PolarHBondContact O-N 3.18Å
39	K	93.9	Very high	92.5	Very high	89 Å²	89	60.2 Å²	60.2	39%	0.387	33%	0.329	S	S	.	.			trans	-82.1	113	177.6	-171.7	166.7	-176.5	162.8	0	110.5	D37 Y41 D166	D37-K39 VanDerWaalsContact C-N 3.33Å; D37-K39 PolarHBondContact O-N 2.87Å; D37-K39 VanDerWaalsContact OD2-CB 3.3Å; D37-K39 WeakPolarHBondContact OD2-CB 3.44Å; D37-K39 PolarHBondContact OD2-N 2.9Å; K39-Y41 HydrophobicContact CD-CE2 4.28Å; K39-Y41 HydrophobicContact CG-CE2 4.11Å; K39-D166 VanDerWaalsContact CE-OD1 3.28Å; K39-D166 WeakPolarHBondContact CE-OD1 3.48Å; K39-D166 IonicContact NZ-OD1 2.81Å; K39-D166 PolarHBondContact NZ-OD1 3.4Å
40	K	94.6	Very high	94	Very high	130 Å²	130	55.4 Å²	55.4	57%	0.565	30%	0.3	S	S	*	.			trans	-100.9	132	174.4	-57.3	-177.5	-176.8	177.6	0	109.8	I38	I38-K40 PolarHBondContact O-N 3.18Å
41	Y	95.9	Very high	94.7	Very high	30 Å²	30	53.1 Å²	53.1	12%	0.118	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	117.1	176.3	-71.3	-99.6	0	0	0	108.9	K39 V49 R50 I51 I131 S132 L133 T134	K39-Y41 HydrophobicContact CD-CE2 4.28Å; K39-Y41 HydrophobicContact CG-CE2 4.11Å; Y41-V49 HydrophobicContact CD1-CG2 3.76Å; Y41-V49 HydrophobicContact CE1-CG2 4.46Å; Y41-R50 WeakPolarHBondContact CE1-O 3.43Å; Y41-I51 HydrophobicContact CD1-CG1 4.44Å; Y41-I51 HydrophobicContact CD2-CG1 4.47Å; Y41-I51 HydrophobicContact CD2-CG2 4.46Å; Y41-I51 HydrophobicContact CE2-CG2 4.25Å; Y41-I51 HydrophobicContact CG-CG1 4.29Å; Y41-I131 HydrophobicContact CD2-CG2 3.5Å; Y41-I131 HydrophobicContact CE2-CG2 3.61Å; Y41-S132 PolarHBondContact N-O 2.76Å; Y41-L133 CarbonylContact O-C 3.53Å; Y41-L133 WeakPolarHBondContact O-CA 3.23Å; Y41-T134 PolarHBondContact O-N 2.66Å
42	Q	95.5	Very high	95	Very high	75 Å²	75	53.1 Å²	53.1	35%	0.35	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	117.5	-179.8	-59.6	-178.3	33.7	0	0	108.4	T134 K147 M148	Q42-T134 WeakPolarHBondContact CA-O 3.48Å; Q42-K147 PolarHBondContact OE1-O 3.31Å; Q42-M148 HydrophobicContact CB-CB 4.24Å; Q42-M148 HydrophobicContact CB-CE 4.31Å; Q42-M148 HydrophobicContact CB-CG 4.04Å; Q42-M148 HydrophobicContact CB-SD 4.28Å
43	V	96.1	Very high	95.2	Very high	6 Å²	6	49.8 Å²	49.8	4%	0.036	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	157	-173.5	-64.6	0	0	0	0	111.1	V49 T108 L133 T134 V135 G136	V43-V49 HydrophobicContact CG1-CB 4.19Å; V43-V49 HydrophobicContact CG1-CG2 3.94Å; V43-V49 HydrophobicContact CG2-CB 4.43Å; V43-V49 HydrophobicContact CG2-CG1 4.46Å; V43-T108 HydrophobicContact CG2-CG2 4.01Å; V43-L133 HydrophobicContact CG2-CD1 4.22Å; V43-T134 PolarHBondContact N-O 2.94Å; V43-T134 VanDerWaalsContact N-O 3.12Å; V43-V135 HydrophobicContact CG2-CG2 4.27Å; V43-V135 WeakPolarHBondContact O-CA 3.24Å; V43-G136 PolarHBondContact O-N 2.92Å
44	L	96.5	Very high	95.3	Very high	18 Å²	18	46.1 Å²	46.1	9%	0.094	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	150.1	172.1	-63.6	174.7	0	0	0	110.6	E47 T108 G136 N138 N145 R226	L44-E47 HydrophobicContact CB-CG 3.99Å; L44-E47 WeakPolarHBondContact O-CB 3.36Å; L44-E47 WeakPolarHBondContact O-CG 3.39Å; L44-E47 PolarHBondContact O-N 3.04Å; L44-T108 PolarHBondContact O-OG1 3.02Å; L44-G136 CarbonylContact C-O 3.56Å; L44-G136 VanDerWaalsContact CA-O 3.29Å; L44-G136 WeakPolarHBondContact CA-O 3.41Å; L44-N138 HydrophobicContact CD2-CB 4.28Å; L44-N145 HydrophobicContact CD2-CB 4.2Å; L44-R226 HydrophobicContact CD1-CB 4.45Å
45	V	96.7	Very high	95.4	Very high	54 Å²	54	40.7 Å²	40.7	33%	0.327	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	140.4	171.3	64.7	0	0	0	0	110.8	E47 L110 V135 G136 E137	V45-E47 VanDerWaalsContact C-N 3.33Å; V45-L110 HydrophobicContact CB-CD2 3.88Å; V45-L110 HydrophobicContact CB-CG 4.24Å; V45-L110 HydrophobicContact CG1-CD2 4.37Å; V45-L110 HydrophobicContact CG2-CD2 4.21Å; V45-L110 HydrophobicContact CG2-CG 4Å; V45-V135 HydrophobicContact CB-CG1 3.98Å; V45-V135 HydrophobicContact CG2-CG1 4.44Å; V45-G136 PolarHBondContact N-O 2.76Å; V45-E137 HydrophobicContact CG1-CG 4.19Å
46	G	95	Very high	95.5	Very high	34 Å²	34	38.2 Å²	38.2	35%	0.351	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.9	-8.4	-176.2	0	0	0	0	0	115.4	P107 T108	G46-P107 VanDerWaalsContact O-CB 3.24Å; G46-P107 WeakPolarHBondContact O-CB 3.07Å; G46-T108 PolarHBondContact N-O 3.15Å
47	E	95.6	Very high	95.4	Very high	3 Å²	3	42.2 Å²	42.2	1%	0.014	20%	0.204	C	C	.	.			trans	-84.3	153	175	-55	-161.3	161	0	0	112.3	L44 V45 T108 V224 R226 R227	L44-E47 HydrophobicContact CB-CG 3.99Å; L44-E47 WeakPolarHBondContact O-CB 3.36Å; L44-E47 WeakPolarHBondContact O-CG 3.39Å; L44-E47 PolarHBondContact O-N 3.04Å; V45-E47 VanDerWaalsContact C-N 3.33Å; E47-T108 PolarHBondContact O-N 3.15Å; E47-T108 PolarHBondContact O-OG1 2.8Å; E47-V224 WeakPolarHBondContact CG-O 3.18Å; E47-R226 PolarHBondContact OE1-N 3.47Å; E47-R227 IonicContact OE2-CZ 3.96Å; E47-R227 IonicContact OE2-NH1 3.4Å; E47-R227 PolarHBondContact OE2-NH1 2.9Å; E47-R227 IonicContact OE2-NH2 3.91Å
48	P	96	Very high	95.2	Very high	2 Å²	2	44.4 Å²	44.4	1%	0.013	23%	0.232	C	C	.	.			trans	-77.9	145.1	166.6	31.4	-35	0	0	0	111.3	F105 F170 F223 V225	P48-F105 VanDerWaalsContact CA-O 3.23Å; P48-F105 WeakPolarHBondContact CA-O 3.49Å; P48-F170 HydrophobicContact CB-CE1 4.11Å; P48-F170 HydrophobicContact CG-CE1 3.87Å; P48-F170 HydrophobicContact CG-CZ 4.2Å; P48-F170 WeakPolarHBondContact O-CZ 3.43Å; P48-F223 HydrophobicContact CG-CB 4.14Å; P48-F223 HydrophobicContact CG-CD2 4.48Å; P48-V225 HydrophobicContact CG-CG2 3.69Å
49	V	96.2	Very high	95	Very high	6 Å²	6	40.3 Å²	40.3	4%	0.036	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	146.1	170.7	75.7	0	0	0	0	111.5	Y41 V43 F105 T108 L133	Y41-V49 HydrophobicContact CD1-CG2 3.76Å; Y41-V49 HydrophobicContact CE1-CG2 4.46Å; V43-V49 HydrophobicContact CG1-CB 4.19Å; V43-V49 HydrophobicContact CG1-CG2 3.94Å; V43-V49 HydrophobicContact CG2-CB 4.43Å; V43-V49 HydrophobicContact CG2-CG1 4.46Å; V49-F105 HydrophobicContact CG1-CB 4.07Å; V49-F105 HydrophobicContact CG1-CD2 3.75Å; V49-F105 HydrophobicContact CG1-CG 4.22Å; V49-F105 PolarHBondContact N-O 3.24Å; V49-F105 VanDerWaalsContact N-O 3.11Å; V49-F105 PolarHBondContact O-N 3.35Å; V49-T108 HydrophobicContact CB-CG2 4.3Å; V49-T108 HydrophobicContact CG1-CG2 3.48Å; V49-T108 VanDerWaalsContact CG1-CG2 3.48Å; V49-L133 HydrophobicContact CG1-CD1 4.14Å
50	R	95.8	Very high	94.9	Very high	42 Å²	42	37.3 Å²	37.3	16%	0.158	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	113.8	172.9	-175.3	-171.7	177.2	-174.9	1.9	109.9	Y41 K52 D101 S102 I103 W104 D169	Y41-R50 WeakPolarHBondContact CE1-O 3.43Å; R50-K52 HydrophobicContact CG-CG 4.42Å; R50-K52 VanDerWaalsContact NH1-CE 3.32Å; R50-D101 IonicContact NH2-OD1 3.54Å; R50-D101 PolarHBondContact NH2-OD1 2.84Å; R50-S102 PolarHBondContact NE-OG 2.81Å; R50-S102 PolarHBondContact NH2-OG 3.2Å; R50-I103 CarbonylContact C-O 3.49Å; R50-I103 WeakPolarHBondContact CA-O 3.23Å; R50-W104 HydrophobicContact CB-CD2 3.77Å; R50-W104 HydrophobicContact CB-CE3 3.86Å; R50-W104 HydrophobicContact CB-CG 4.43Å; R50-W104 HydrophobicContact CB-CH2 4.19Å; R50-W104 HydrophobicContact CB-CZ2 4.12Å; R50-W104 HydrophobicContact CB-CZ3 4.06Å; R50-W104 HydrophobicContact CG-CD2 3.87Å; R50-W104 HydrophobicContact CG-CE3 4.47Å; R50-W104 HydrophobicContact CG-CG 4.23Å; R50-W104 HydrophobicContact CG-CZ2 4.07Å; R50-D169 VanDerWaalsContact CD-OD1 3.29Å; R50-D169 WeakPolarHBondContact CD-OD1 3.27Å; R50-D169 IonicContact CZ-OD1 2.68Å; R50-D169 IonicContact NE-OD1 3.2Å; R50-D169 IonicContact NH1-OD1 2.66Å; R50-D169 PolarHBondContact NH1-OD1 3.28Å
51	I	96.1	Very high	94.7	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	116.5	174.1	-57.1	-175.2	0	0	0	108.4	Y41 W76 S102 I103 F105 Y116 I131 L133	Y41-I51 HydrophobicContact CD1-CG1 4.44Å; Y41-I51 HydrophobicContact CD2-CG1 4.47Å; Y41-I51 HydrophobicContact CD2-CG2 4.46Å; Y41-I51 HydrophobicContact CE2-CG2 4.25Å; Y41-I51 HydrophobicContact CG-CG1 4.29Å; I51-W76 HydrophobicContact CG2-CH2 4.18Å; I51-W76 HydrophobicContact CG2-CZ3 4.5Å; I51-S102 CarbonylContact O-C 3.52Å; I51-S102 WeakPolarHBondContact O-CA 3.42Å; I51-S102 WeakPolarHBondContact O-CB 3.3Å; I51-I103 PolarHBondContact N-O 2.98Å; I51-I103 PolarHBondContact O-N 2.88Å; I51-F105 HydrophobicContact CD1-CE2 3.8Å; I51-F105 HydrophobicContact CG1-CE2 4.19Å; I51-Y116 HydrophobicContact CD1-CD2 4.28Å; I51-Y116 HydrophobicContact CD1-CG 4.46Å; I51-I131 HydrophobicContact CG2-CB 3.99Å; I51-I131 HydrophobicContact CG2-CG1 4.49Å; I51-I131 HydrophobicContact CG2-CG2 3.72Å; I51-L133 HydrophobicContact CD1-CB 3.79Å; I51-L133 HydrophobicContact CD1-CD1 4.2Å; I51-L133 HydrophobicContact CD1-CD2 3.97Å; I51-L133 HydrophobicContact CD1-CG 4.17Å
52	K	95.3	Very high	94.4	Very high	43 Å²	43	45.1 Å²	45.1	19%	0.187	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	144.3	177.7	-69.4	164.7	177.1	152.9	0	109.7	R50 A54 Y57 D169	R50-K52 HydrophobicContact CG-CG 4.42Å; R50-K52 VanDerWaalsContact NH1-CE 3.32Å; K52-A54 PolarHBondContact O-N 2.94Å; K52-A54 VanDerWaalsContact O-N 3.08Å; K52-Y57 HydrophobicContact CB-CD2 4.24Å; K52-Y57 HydrophobicContact CB-CE2 3.73Å; K52-Y57 HydrophobicContact CD-CE2 4.3Å; K52-Y57 HydrophobicContact CG-CE2 4.31Å; K52-D169 WeakPolarHBondContact CE-OD1 3.27Å; K52-D169 IonicContact NZ-OD1 2.68Å; K52-D169 PolarHBondContact NZ-OD1 3.07Å; K52-D169 IonicContact NZ-OD2 2.88Å; K52-D169 PolarHBondContact NZ-OD2 3.36Å
53	C	96.3	Very high	94.2	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.231	C	C	.	.			trans	-68.1	108	175.4	172.7	0	0	0	0	110.8	L55 F56 Y57 W76 D101 C118	C53-L55 PolarHBondContact O-N 3.3Å; C53-F56 HydrophobicContact CB-CD2 3.86Å; C53-F56 HydrophobicContact CB-CE2 3.98Å; C53-F56 PolarHBondContact O-N 3.34Å; C53-Y57 WeakPolarHBondContact O-CD2 3.35Å; C53-W76 HydrophobicContact CB-CH2 3.99Å; C53-W76 HydrophobicContact CB-CZ2 3.71Å; C53-D101 VanDerWaalsContact CB-O 3.31Å; C53-D101 WeakPolarHBondContact CB-O 3.43Å; C53-D101 PolarHBondContact N-O 3.5Å; C53-C118 HydrophobicContact CB-CB 3.79Å; C53-C118 WeakPolarHBondContact CB-SG 3.34Å; C53-C118 WeakPolarHBondContact SG-CB 3.47Å; C53-C118 CovalentContact SG-SG 2.02Å; C53-C118 PolarHBondContact SG-SG 2.89Å
54	A	96	Very high	94	Very high	8 Å²	8	47.5 Å²	47.5	7%	0.066	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-24.3	-175	0	0	0	0	0	114.4	D37 K52 F56 Y57 G58 Y59 V129 I131	D37-A54 HydrophobicContact CB-CB 3.88Å; D37-A54 VanDerWaalsContact CG-CB 3.46Å; K52-A54 PolarHBondContact O-N 2.94Å; K52-A54 VanDerWaalsContact O-N 3.08Å; A54-F56 VanDerWaalsContact C-N 3.3Å; A54-F56 PolarHBondContact O-N 3Å; A54-Y57 PolarHBondContact O-N 3.13Å; A54-G58 PolarHBondContact O-N 3.16Å; A54-Y59 HydrophobicContact CB-CE2 4.19Å; A54-V129 HydrophobicContact CB-CG1 3.97Å; A54-I131 HydrophobicContact CB-CD1 4.26Å; A54-I131 HydrophobicContact CB-CG1 4.04Å
55	L	95.3	Very high	93.9	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.258	C	S	.	.	I	π-helix	trans	-50.9	-48.9	177.2	-62.5	178.7	0	0	0	111.9	C53 Y57 Y59 I60 I120 M127 V129	C53-L55 PolarHBondContact O-N 3.3Å; L55-Y57 PolarHBondContact O-N 3.18Å; L55-Y59 HydrophobicContact CD2-CD2 4.26Å; L55-Y59 HydrophobicContact CD2-CG 4.13Å; L55-Y59 PolarHBondContact O-N 3.2Å; L55-I60 HydrophobicContact CB-CD1 4.2Å; L55-I60 HydrophobicContact CB-CG1 4.09Å; L55-I60 WeakPolarHBondContact O-CG1 3.5Å; L55-I60 PolarHBondContact O-N 3.48Å; L55-I120 HydrophobicContact CD1-CB 4.41Å; L55-I120 HydrophobicContact CD1-CD1 3.81Å; L55-I120 HydrophobicContact CD1-CG1 3.73Å; L55-I120 HydrophobicContact CD1-CG2 4.05Å; L55-M127 HydrophobicContact CD1-CG 4.37Å; L55-M127 HydrophobicContact CD2-CG 3.98Å; L55-M127 HydrophobicContact CD2-SD 4.13Å; L55-V129 HydrophobicContact CD2-CB 3.8Å; L55-V129 HydrophobicContact CD2-CG1 3.59Å; L55-V129 HydrophobicContact CG-CB 4.35Å; L55-V129 HydrophobicContact CG-CG1 3.63Å
56	F	94.6	Very high	93.7	Very high	24 Å²	24	51.9 Å²	51.9	11%	0.105	27%	0.266	C	S	.	.	I	π-helix	trans	-71.8	-10.6	-177.3	-55.1	-60.5	0	0	0	114.4	C53 A54 I60 T62 Y64 A67 L74 D101 I120	C53-F56 HydrophobicContact CB-CD2 3.86Å; C53-F56 HydrophobicContact CB-CE2 3.98Å; C53-F56 PolarHBondContact O-N 3.34Å; A54-F56 VanDerWaalsContact C-N 3.3Å; A54-F56 PolarHBondContact O-N 3Å; F56-I60 HydrophobicContact CD1-CD1 3.5Å; F56-I60 HydrophobicContact CD1-CG1 4.17Å; F56-I60 HydrophobicContact CE1-CD1 3.61Å; F56-T62 WeakPolarHBondContact CD1-O 3.2Å; F56-Y64 HydrophobicContact CE2-CD2 4.02Å; F56-Y64 HydrophobicContact CZ-CD2 4Å; F56-A67 HydrophobicContact CE1-CB 3.87Å; F56-A67 HydrophobicContact CZ-CB 4.42Å; F56-L74 HydrophobicContact CE2-CD2 4.29Å; F56-D101 HydrophobicContact CD2-CB 4Å; F56-D101 HydrophobicContact CE2-CB 4.14Å; F56-I120 HydrophobicContact CE1-CG2 4.5Å; F56-I120 HydrophobicContact CZ-CG2 3.93Å
57	Y	92.6	Very high	93.5	Very high	143 Å²	143	50.5 Å²	50.5	56%	0.561	25%	0.251	S	S	*	.	I	π-helix	trans	-113.7	3	-174.8	-64.8	-83.1	0	0	0	113.9	K52 C53 A54 L55 D101	K52-Y57 HydrophobicContact CB-CD2 4.24Å; K52-Y57 HydrophobicContact CB-CE2 3.73Å; K52-Y57 HydrophobicContact CD-CE2 4.3Å; K52-Y57 HydrophobicContact CG-CE2 4.31Å; C53-Y57 WeakPolarHBondContact O-CD2 3.35Å; A54-Y57 PolarHBondContact O-N 3.13Å; L55-Y57 PolarHBondContact O-N 3.18Å; Y57-D101 WeakPolarHBondContact CE2-OD2 3.43Å; Y57-D101 PolarHBondContact OH-OD2 2.75Å
58	G	89.9	Confident	93.4	Very high	67 Å²	67	55.8 Å²	55.8	69%	0.691	28%	0.276	S	S	*	.	I	π-helix	trans	-166.1	-32.7	177.3	0	0	0	0	0	116.2	A54	A54-G58 PolarHBondContact O-N 3.16Å
59	Y	91.3	Very high	93.2	Very high	72 Å²	72	60.3 Å²	60.3	28%	0.282	31%	0.307	S	S	.	.	I	π-helix	trans	-94.7	-31.3	-171.3	-60.1	-96.9	0	0	0	113.9	W34 D37 A54 L55 V129	W34-Y59 HydrophobicContact CB-CD1 4.16Å; W34-Y59 HydrophobicContact CB-CE1 3.72Å; W34-Y59 AromaticContact CD1-CD1 3.96Å; W34-Y59 AromaticContact CD2-CD1 3.44Å; W34-Y59 HydrophobicContact CD2-CD1 3.44Å; W34-Y59 VanDerWaalsContact CD2-CD1 3.44Å; W34-Y59 AromaticContact CD2-CE1 3.65Å; W34-Y59 HydrophobicContact CD2-CE1 3.65Å; W34-Y59 AromaticContact CE2-CD1 3.72Å; W34-Y59 AromaticContact CE3-CD1 3.78Å; W34-Y59 HydrophobicContact CE3-CD1 3.78Å; W34-Y59 AromaticContact CE3-CE1 3.73Å; W34-Y59 HydrophobicContact CE3-CE1 3.73Å; W34-Y59 AromaticContact CG-CD1 3.61Å; W34-Y59 HydrophobicContact CG-CD1 3.61Å; W34-Y59 AromaticContact CG-CE1 3.67Å; W34-Y59 HydrophobicContact CG-CE1 3.67Å; W34-Y59 HydrophobicContact CZ2-CD1 4.29Å; W34-Y59 HydrophobicContact CZ3-CD1 4.33Å; W34-Y59 AromaticContact NE1-CD1 4Å; D37-Y59 PolarHBondContact OD1-OH 3.14Å; A54-Y59 HydrophobicContact CB-CE2 4.19Å; L55-Y59 HydrophobicContact CD2-CD2 4.26Å; L55-Y59 HydrophobicContact CD2-CG 4.13Å; L55-Y59 PolarHBondContact O-N 3.2Å; Y59-V129 HydrophobicContact CE2-CG2 4.04Å
60	I	90.9	Very high	93	Very high	27 Å²	27	63.2 Å²	63.2	14%	0.138	33%	0.332	C	S	.	.			trans	-128.3	148.9	178.2	53.2	166.1	0	0	0	111.4	L55 F56 I120 M127	L55-I60 HydrophobicContact CB-CD1 4.2Å; L55-I60 HydrophobicContact CB-CG1 4.09Å; L55-I60 WeakPolarHBondContact O-CG1 3.5Å; L55-I60 PolarHBondContact O-N 3.48Å; F56-I60 HydrophobicContact CD1-CD1 3.5Å; F56-I60 HydrophobicContact CD1-CG1 4.17Å; F56-I60 HydrophobicContact CE1-CD1 3.61Å; I60-I120 HydrophobicContact CD1-CD1 3.56Å; I60-M127 HydrophobicContact CG2-SD 3.85Å
61	R	90.9	Very high	92.8	Very high	261 Å²	261	63.8 Å²	63.8	99%	0.985	35%	0.351	S	S	*	.	S	Bend	trans	-84.3	-16	-178	-65.3	-176.7	-179	175.3	-0.3	114.4
62	T	89.2	Confident	92.6	Very high	63 Å²	63	65.4 Å²	65.4	39%	0.387	36%	0.359	S	S	.	.	S	Bend	trans	-80.7	141	177.8	47.8	0	0	0	0	109.9	F56	F56-T62 WeakPolarHBondContact CD1-O 3.2Å
63	N	91.7	Very high	92.5	Very high	79 Å²	79	66.2 Å²	66.2	42%	0.422	37%	0.37	S	S	.	.			trans	-79.3	173.8	167.3	70.6	4.6	0	0	0	111.2	S65 L66 A67	N63-S65 PolarHBondContact ND2-OG 3.37Å; N63-S65 PolarHBondContact O-N 3.14Å; N63-S65 PolarHBondContact OD1-OG 2.95Å; N63-L66 PolarHBondContact O-N 3.46Å; N63-L66 WeakPolarHBondContact OD1-CB 3.43Å; N63-L66 WeakPolarHBondContact OD1-CD1 3.46Å; N63-L66 WeakPolarHBondContact OD1-CG 3.32Å; N63-L66 PolarHBondContact OD1-N 2.99Å; N63-A67 PolarHBondContact O-N 3.23Å
64	Y	92.7	Very high	92.4	Very high	51 Å²	51	66.9 Å²	66.9	20%	0.2	37%	0.374	C	S	.	.	H	α-helix	trans	-57.3	-47.1	-179.7	169.6	-108.9	0	0	0	113.7	F56 L66 A67 Q68 L74 E100 D101	F56-Y64 HydrophobicContact CE2-CD2 4.02Å; F56-Y64 HydrophobicContact CZ-CD2 4Å; Y64-L66 PolarHBondContact O-N 3.39Å; Y64-A67 PolarHBondContact O-N 2.92Å; Y64-Q68 WeakPolarHBondContact O-CB 3.45Å; Y64-Q68 PolarHBondContact O-N 3.2Å; Y64-Q68 PolarHBondContact OH-OE1 2.67Å; Y64-L74 HydrophobicContact CD2-CB 4.49Å; Y64-L74 HydrophobicContact CD2-CD2 3.75Å; Y64-L74 HydrophobicContact CE2-CB 3.95Å; Y64-L74 HydrophobicContact CE2-CD2 3.54Å; Y64-L74 HydrophobicContact CE2-CG 4.39Å; Y64-E100 HydrophobicContact CD1-CB 4.05Å; Y64-E100 HydrophobicContact CE1-CB 4.02Å; Y64-D101 HydrophobicContact CD1-CB 4.43Å; Y64-D101 HydrophobicContact CD2-CB 4.17Å; Y64-D101 HydrophobicContact CG-CB 3.85Å
65	S	93	Very high	92.4	Very high	70 Å²	70	69.3 Å²	69.3	49%	0.49	39%	0.385	S	S	.	.	H	α-helix	trans	-67.2	-36.9	-177.9	52.7	0	0	0	0	112.9	N63 S69	N63-S65 PolarHBondContact ND2-OG 3.37Å; N63-S65 PolarHBondContact O-N 3.14Å; N63-S65 PolarHBondContact OD1-OG 2.95Å; S65-S69 WeakPolarHBondContact O-CB 3.4Å; S65-S69 PolarHBondContact O-N 3.36Å; S65-S69 PolarHBondContact O-OG 3.02Å
66	L	93	Very high	92.4	Very high	95 Å²	95	69.9 Å²	69.9	50%	0.497	39%	0.387	S	S	.	.	H	α-helix	trans	-63.8	-46.5	171.3	-75.6	165.6	0	0	0	111.2	N63 Y64 Q68 S69 A70	N63-L66 PolarHBondContact O-N 3.46Å; N63-L66 WeakPolarHBondContact OD1-CB 3.43Å; N63-L66 WeakPolarHBondContact OD1-CD1 3.46Å; N63-L66 WeakPolarHBondContact OD1-CG 3.32Å; N63-L66 PolarHBondContact OD1-N 2.99Å; Y64-L66 PolarHBondContact O-N 3.39Å; L66-Q68 VanDerWaalsContact C-N 3.34Å; L66-Q68 PolarHBondContact O-N 3.29Å; L66-S69 WeakPolarHBondContact CA-OG 3.32Å; L66-S69 PolarHBondContact O-N 3.08Å; L66-S69 PolarHBondContact O-OG 2.9Å; L66-A70 WeakPolarHBondContact O-CB 3.41Å; L66-A70 PolarHBondContact O-N 2.9Å
67	A	92	Very high	92.4	Very high	4 Å²	4	71.9 Å²	71.9	3%	0.033	39%	0.394	C	S	.	.	H	α-helix	trans	-60.5	-42.9	178	0	0	0	0	0	112.1	F56 N63 Y64 A70 G71 L72	F56-A67 HydrophobicContact CE1-CB 3.87Å; F56-A67 HydrophobicContact CZ-CB 4.42Å; N63-A67 PolarHBondContact O-N 3.23Å; Y64-A67 PolarHBondContact O-N 2.92Å; A67-A70 PolarHBondContact O-N 2.67Å; A67-G71 PolarHBondContact O-N 3.17Å; A67-L72 HydrophobicContact CB-CB 4.47Å; A67-L72 WeakPolarHBondContact O-CB 3.48Å; A67-L72 PolarHBondContact O-N 3.22Å
68	Q	91.9	Very high	92.6	Very high	115 Å²	115	67.5 Å²	67.5	54%	0.537	38%	0.378	S	S	.	.	H	α-helix	trans	-63.7	-43.2	175	-170	178.2	7.7	0	0	111.7	Y64 L66 A70 G71	Y64-Q68 WeakPolarHBondContact O-CB 3.45Å; Y64-Q68 PolarHBondContact O-N 3.2Å; Y64-Q68 PolarHBondContact OH-OE1 2.67Å; L66-Q68 VanDerWaalsContact C-N 3.34Å; L66-Q68 PolarHBondContact O-N 3.29Å; Q68-A70 VanDerWaalsContact C-N 3.25Å; Q68-A70 PolarHBondContact O-N 3.24Å; Q68-G71 PolarHBondContact O-N 3.47Å
69	S	92.5	Very high	92.8	Very high	96 Å²	96	64.7 Å²	64.7	67%	0.671	35%	0.348	S	S	*	.	H	α-helix	trans	-64.8	-27.8	176.6	75.3	0	0	0	0	113.5	S65 L66 G71	S65-S69 WeakPolarHBondContact O-CB 3.4Å; S65-S69 PolarHBondContact O-N 3.36Å; S65-S69 PolarHBondContact O-OG 3.02Å; L66-S69 WeakPolarHBondContact CA-OG 3.32Å; L66-S69 PolarHBondContact O-N 3.08Å; L66-S69 PolarHBondContact O-OG 2.9Å; S69-G71 PolarHBondContact O-N 3.27Å
70	A	92.1	Very high	92.7	Very high	68 Å²	68	66 Å²	66	56%	0.562	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	4.7	173.9	0	0	0	0	0	113.6	L66 A67 Q68 L72	L66-A70 WeakPolarHBondContact O-CB 3.41Å; L66-A70 PolarHBondContact O-N 2.9Å; A67-A70 PolarHBondContact O-N 2.67Å; Q68-A70 VanDerWaalsContact C-N 3.25Å; Q68-A70 PolarHBondContact O-N 3.24Å; A70-L72 HydrophobicContact CB-CD1 3.94Å
71	G	91.7	Very high	92.3	Very high	53 Å²	53	65.3 Å²	65.3	55%	0.546	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.5	20.5	177	0	0	0	0	0	115.1	A67 Q68 S69	A67-G71 PolarHBondContact O-N 3.17Å; Q68-G71 PolarHBondContact O-N 3.47Å; S69-G71 PolarHBondContact O-N 3.27Å
72	L	92.6	Very high	91.8	Very high	34 Å²	34	58.1 Å²	58.1	18%	0.178	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-85.2	132.4	168.1	-70.8	77.6	0	0	0	109.7	A67 A70 I120 R121 Y125	A67-L72 HydrophobicContact CB-CB 4.47Å; A67-L72 WeakPolarHBondContact O-CB 3.48Å; A67-L72 PolarHBondContact O-N 3.22Å; A70-L72 HydrophobicContact CB-CD1 3.94Å; L72-I120 HydrophobicContact CD2-CB 4.27Å; L72-I120 HydrophobicContact CD2-CD1 4.21Å; L72-I120 HydrophobicContact CD2-CG1 4.37Å; L72-R121 WeakPolarHBondContact CA-O 3.38Å; L72-Y125 HydrophobicContact CD2-CD1 3.73Å; L72-Y125 HydrophobicContact CD2-CE1 3.82Å
73	S	92.9	Very high	91.3	Very high	60 Å²	60	59.1 Å²	59.1	42%	0.42	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	136.6	170	62.6	0	0	0	0	110.8	I120 R121	S73-I120 WeakPolarHBondContact O-CA 3.42Å; S73-R121 PolarHBondContact N-O 3.23Å; S73-R121 PolarHBondContact O-N 2.95Å; S73-R121 PolarHBondContact OG-O 3.26Å
74	L	94.6	Very high	91	Very high	15 Å²	15	59.4 Å²	59.4	8%	0.079	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	118.6	170.7	171.7	61	0	0	0	109.8	F56 Y64 K98 C118 I120	F56-L74 HydrophobicContact CE2-CD2 4.29Å; Y64-L74 HydrophobicContact CD2-CB 4.49Å; Y64-L74 HydrophobicContact CD2-CD2 3.75Å; Y64-L74 HydrophobicContact CE2-CB 3.95Å; Y64-L74 HydrophobicContact CE2-CD2 3.54Å; Y64-L74 HydrophobicContact CE2-CG 4.39Å; L74-K98 PolarHBondContact O-NZ 3.32Å; L74-C118 WeakPolarHBondContact CD1-SG 3.36Å; L74-I120 HydrophobicContact CD1-CG2 4.13Å
75	M	94.2	Very high	90.7	Very high	59 Å²	59	66.4 Å²	66.4	29%	0.291	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	155.2	177	-60.8	178.3	-64.3	0	0	110.1	Y77 V119 R121	M75-Y77 HydrophobicContact CB-CE2 3.85Å; M75-V119 HydrophobicContact CB-CB 4.42Å; M75-V119 HydrophobicContact CE-CG1 4.19Å; M75-V119 PolarHBondContact N-O 3.17Å; M75-V119 PolarHBondContact O-N 2.86Å; M75-R121 HydrophobicContact CE-CB 3.98Å
76	W	96.1	Very high	90.6	Very high	11 Å²	11	66.3 Å²	66.3	4%	0.042	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	133.1	-179.8	-75.2	104.5	0	0	0	110.2	I51 C53 I89 F91 I103 A117 C118 I131	I51-W76 HydrophobicContact CG2-CH2 4.18Å; I51-W76 HydrophobicContact CG2-CZ3 4.5Å; C53-W76 HydrophobicContact CB-CH2 3.99Å; C53-W76 HydrophobicContact CB-CZ2 3.71Å; W76-I89 HydrophobicContact CB-CD1 4.08Å; W76-I89 PolarHBondContact O-N 2.64Å; W76-F91 HydrophobicContact CB-CZ 4.06Å; W76-F91 HydrophobicContact CG-CZ 4.47Å; W76-I103 HydrophobicContact CB-CD1 4.05Å; W76-I103 HydrophobicContact CD2-CD1 3.58Å; W76-I103 HydrophobicContact CD2-CG1 3.9Å; W76-I103 HydrophobicContact CE3-CD1 3.71Å; W76-I103 HydrophobicContact CE3-CG1 4.37Å; W76-I103 HydrophobicContact CG-CD1 3.78Å; W76-I103 HydrophobicContact CG-CG1 4.1Å; W76-I103 HydrophobicContact CZ2-CG1 4.18Å; W76-I103 HydrophobicContact CZ3-CD1 4.23Å; W76-A117 WeakPolarHBondContact CA-O 3.41Å; W76-C118 HydrophobicContact CD2-CB 4.32Å; W76-C118 HydrophobicContact CE3-CB 3.92Å; W76-C118 HydrophobicContact CH2-CB 3.85Å; W76-C118 HydrophobicContact CZ2-CB 4.22Å; W76-C118 HydrophobicContact CZ3-CB 3.68Å; W76-I131 HydrophobicContact CH2-CD1 4.02Å; W76-I131 HydrophobicContact CZ3-CD1 3.88Å
77	Y	95.1	Very high	90.5	Very high	66 Å²	66	68.7 Å²	68.7	26%	0.259	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	156.7	176.9	-57.3	-104.4	0	0	0	109.8	M75 E86 E87 P88 Y116 A117 V119	M75-Y77 HydrophobicContact CB-CE2 3.85Å; Y77-E86 HydrophobicContact CG-CB 4.48Å; Y77-E87 CarbonylContact C-O 3.41Å; Y77-E87 WeakPolarHBondContact CA-O 3.27Å; Y77-E87 WeakPolarHBondContact CB-O 3.12Å; Y77-P88 HydrophobicContact CD1-CB 4.11Å; Y77-P88 HydrophobicContact CE1-CB 4.08Å; Y77-Y116 CarbonylContact O-C 3.58Å; Y77-Y116 WeakPolarHBondContact O-CA 3.38Å; Y77-A117 PolarHBondContact N-O 3.5Å; Y77-A117 PolarHBondContact O-N 2.87Å; Y77-V119 HydrophobicContact CD2-CB 4.46Å; Y77-V119 HydrophobicContact CD2-CG2 3.58Å; Y77-V119 HydrophobicContact CE2-CB 4.15Å; Y77-V119 HydrophobicContact CE2-CG2 3.63Å
78	K	95.6	Very high	90.6	Very high	52 Å²	52	73.4 Å²	73.4	23%	0.226	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	138.8	174.4	-174.1	-179.2	180	-178.3	0	109.9	E86 E87 I89 Q111 L115 Y116	K78-E86 WeakPolarHBondContact O-CA 3.49Å; K78-E87 PolarHBondContact N-O 2.91Å; K78-E87 PolarHBondContact O-N 3.29Å; K78-I89 HydrophobicContact CB-CD1 4.05Å; K78-I89 HydrophobicContact CB-CG1 3.89Å; K78-Q111 PolarHBondContact NZ-O 3.42Å; K78-L115 CarbonylContact C-O 3.49Å; K78-L115 VanDerWaalsContact CA-O 3.32Å; K78-L115 WeakPolarHBondContact CA-O 3.39Å; K78-Y116 HydrophobicContact CB-CE1 4.47Å; K78-Y116 HydrophobicContact CD-CE1 4.32Å; K78-Y116 HydrophobicContact CG-CE1 4.35Å; K78-Y116 HydrophobicContact CG-CE2 4.45Å
79	S	94.3	Very high	90.7	Very high	8 Å²	8	69.1 Å²	69.1	6%	0.056	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	154.1	159.5	80	0	0	0	0	109.9	G81 G114 L115	S79-G81 PolarHBondContact OG-O 2.92Å; S79-G114 WeakPolarHBondContact O-CA 3.05Å; S79-L115 PolarHBondContact N-O 3.35Å; S79-L115 PolarHBondContact O-N 3.04Å
80	S	89.5	Confident	90.6	Very high	99 Å²	99	68.8 Å²	68.8	69%	0.692	42%	0.424	S	S	*	.	S	Bend	trans	-72.8	-37.1	179	-62.6	0	0	0	0	111.8	D84	S80-D84 WeakPolarHBondContact CB-OD2 3.41Å
81	G	82.3	Confident	90.7	Very high	13 Å²	13	68.7 Å²	68.7	13%	0.134	41%	0.411	C	S	.	.	S	Bend	trans	-153.2	-174.3	174.8	0	0	0	0	0	113.8	S79 G83 D84	S79-G81 PolarHBondContact OG-O 2.92Å; G81-G83 PolarHBondContact O-N 2.7Å; G81-D84 WeakPolarHBondContact CA-OD2 3.43Å; G81-D84 PolarHBondContact N-OD2 3.03Å; G81-D84 PolarHBondContact O-N 3.27Å
82	P	80.8	Confident	90.7	Very high	109 Å²	109	70.3 Å²	70.3	71%	0.708	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	119.9	177.1	-12.8	27.6	0	0	0	110.8	I36 L115	I36-P82 HydrophobicContact CD1-CG 4.26Å; P82-L115 HydrophobicContact CB-CD1 4.42Å; P82-L115 HydrophobicContact CG-CD1 4.17Å
83	G	79.6	Confident	90.5	Very high	84 Å²	84	71.3 Å²	71.3	87%	0.866	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.6	-8.7	179.9	0	0	0	0	0	115	G81	G81-G83 PolarHBondContact O-N 2.7Å
84	D	84.3	Confident	90.4	Very high	85 Å²	85	73 Å²	73	46%	0.455	44%	0.438	S	S	.	.	S	Bend	trans	-70.9	156.4	168.4	-67.8	-36.4	0	0	0	111.3	S80 G81	S80-D84 WeakPolarHBondContact CB-OD2 3.41Å; G81-D84 WeakPolarHBondContact CA-OD2 3.43Å; G81-D84 PolarHBondContact N-OD2 3.03Å; G81-D84 PolarHBondContact O-N 3.27Å
85	F	86.3	Confident	90.3	Very high	198 Å²	198	74.9 Å²	74.9	87%	0.868	44%	0.444	S	S	*	.			trans	-64.5	142.6	175.1	-72	-82.7	0	0	0	111.8
86	E	90.5	Very high	90.4	Very high	69 Å²	69	73.2 Å²	73.2	32%	0.322	44%	0.436	S	S	.	.			trans	-89.6	114.7	179	-72.5	177.5	157.2	0	0	110.6	Y77 K78 A117 K128	Y77-E86 HydrophobicContact CG-CB 4.48Å; K78-E86 WeakPolarHBondContact O-CA 3.49Å; E86-A117 WeakPolarHBondContact OE1-CB 3.4Å; E86-K128 IonicContact OE1-NZ 2.8Å; E86-K128 PolarHBondContact OE1-NZ 2.81Å; E86-K128 IonicContact OE2-NZ 3.77Å; E86-K128 PolarHBondContact OE2-NZ 3.02Å
87	E	91.8	Very high	90.4	Very high	144 Å²	144	73 Å²	73	67%	0.673	44%	0.436	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.6	140.1	176.7	-64.7	-169.6	154	0	0	111.4	Y77 K78	Y77-E87 CarbonylContact C-O 3.41Å; Y77-E87 WeakPolarHBondContact CA-O 3.27Å; Y77-E87 WeakPolarHBondContact CB-O 3.12Å; K78-E87 PolarHBondContact N-O 2.91Å; K78-E87 PolarHBondContact O-N 3.29Å
88	P	93.6	Very high	90.4	Very high	103 Å²	103	74 Å²	74	67%	0.669	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.8	137.3	177.4	29.1	-34.5	0	0	0	111.3	Y77	Y77-P88 HydrophobicContact CD1-CB 4.11Å; Y77-P88 HydrophobicContact CE1-CB 4.08Å
89	I	93.9	Very high	90.3	Very high	26 Å²	26	74.9 Å²	74.9	13%	0.133	45%	0.446	C	S	.	.	P	Polyproline II helix	trans	-83.2	124.1	-175	-63.5	167.2	0	0	0	111.4	W76 K78 F91 M96 I103 Y116	W76-I89 HydrophobicContact CB-CD1 4.08Å; W76-I89 PolarHBondContact O-N 2.64Å; K78-I89 HydrophobicContact CB-CD1 4.05Å; K78-I89 HydrophobicContact CB-CG1 3.89Å; I89-F91 HydrophobicContact CB-CE1 4.43Å; I89-F91 HydrophobicContact CB-CE2 4.05Å; I89-F91 HydrophobicContact CB-CZ 3.89Å; I89-F91 HydrophobicContact CG2-CD1 4.01Å; I89-F91 HydrophobicContact CG2-CD2 4.28Å; I89-F91 HydrophobicContact CG2-CE1 3.63Å; I89-F91 HydrophobicContact CG2-CE2 3.93Å; I89-F91 HydrophobicContact CG2-CG 4.32Å; I89-F91 HydrophobicContact CG2-CZ 3.59Å; I89-F91 WeakPolarHBondContact O-CD2 3.49Å; I89-F91 WeakPolarHBondContact O-CE2 3.35Å; I89-M96 HydrophobicContact CG2-CE 3.42Å; I89-M96 VanDerWaalsContact CG2-CE 3.42Å; I89-M96 HydrophobicContact CG2-SD 3.94Å; I89-I103 HydrophobicContact CD1-CD1 4.03Å; I89-Y116 HydrophobicContact CD1-CD1 3.46Å; I89-Y116 VanDerWaalsContact CD1-CD1 3.46Å; I89-Y116 HydrophobicContact CD1-CE1 3.62Å
90	A	91.6	Very high	90.2	Very high	88 Å²	88	81 Å²	81	73%	0.727	47%	0.474	S	S	*	.			trans	-86.8	108.9	167.9	0	0	0	0	0	110.4	M96	A90-M96 WeakPolarHBondContact O-CE 3.48Å
91	F	93.8	Very high	90.4	Very high	66 Å²	66	76.6 Å²	76.6	29%	0.289	44%	0.443	S	S	.	.			trans	-83.2	133.2	178.5	-61	-80.8	0	0	0	111.1	W76 I89 M96 K98 I103	W76-F91 HydrophobicContact CB-CZ 4.06Å; W76-F91 HydrophobicContact CG-CZ 4.47Å; I89-F91 HydrophobicContact CB-CE1 4.43Å; I89-F91 HydrophobicContact CB-CE2 4.05Å; I89-F91 HydrophobicContact CB-CZ 3.89Å; I89-F91 HydrophobicContact CG2-CD1 4.01Å; I89-F91 HydrophobicContact CG2-CD2 4.28Å; I89-F91 HydrophobicContact CG2-CE1 3.63Å; I89-F91 HydrophobicContact CG2-CE2 3.93Å; I89-F91 HydrophobicContact CG2-CG 4.32Å; I89-F91 HydrophobicContact CG2-CZ 3.59Å; I89-F91 WeakPolarHBondContact O-CD2 3.49Å; I89-F91 WeakPolarHBondContact O-CE2 3.35Å; F91-M96 WeakPolarHBondContact CB-O 3.41Å; F91-M96 HydrophobicContact CD1-CG 4.08Å; F91-M96 HydrophobicContact CE1-CG 4.41Å; F91-K98 HydrophobicContact CD1-CB 3.91Å; F91-K98 HydrophobicContact CD2-CB 4.04Å; F91-K98 HydrophobicContact CE1-CB 3.91Å; F91-K98 HydrophobicContact CE2-CB 4.05Å; F91-K98 HydrophobicContact CE2-CD 4.18Å; F91-K98 HydrophobicContact CG-CB 3.98Å; F91-K98 HydrophobicContact CZ-CB 3.98Å; F91-K98 HydrophobicContact CZ-CD 4.5Å; F91-K98 HydrophobicContact CZ-CG 4.41Å; F91-I103 HydrophobicContact CE1-CB 4.49Å; F91-I103 HydrophobicContact CE1-CD1 4Å; F91-I103 HydrophobicContact CE1-CG1 3.88Å; F91-I103 HydrophobicContact CE1-CG2 3.93Å; F91-I103 HydrophobicContact CZ-CD1 4.09Å; F91-I103 HydrophobicContact CZ-CG1 4.16Å
92	D	91.1	Very high	91.1	Very high	88 Å²	88	76 Å²	76	47%	0.471	44%	0.437	S	S	.	.			trans	-87.9	-11.2	177.5	68.1	14.6	0	0	0	113.2	S94 R95 M96	D92-S94 PolarHBondContact O-N 3.47Å; D92-S94 PolarHBondContact OD1-N 3.13Å; D92-R95 PolarHBondContact OD1-N 2.8Å; D92-R95 WeakPolarHBondContact OD2-CB 3.32Å; D92-R95 PolarHBondContact OD2-N 2.83Å; D92-M96 PolarHBondContact N-O 2.68Å; D92-M96 VanDerWaalsContact N-O 3.15Å; D92-M96 PolarHBondContact OD1-N 2.89Å
93	G	88.6	Confident	91.8	Very high	55 Å²	55	70.8 Å²	70.8	57%	0.567	40%	0.403	S	S	*	.	S	Bend	trans	71.4	-1	-178.4	0	0	0	0	0	115.2	M96	G93-M96 PolarHBondContact N-O 2.77Å
94	S	90.2	Very high	92.6	Very high	96 Å²	96	67.6 Å²	67.6	67%	0.671	37%	0.365	S	S	*	.	S	Bend	trans	-117.6	-66.9	-176.6	-58.7	0	0	0	0	111.5	D92	D92-S94 PolarHBondContact O-N 3.47Å; D92-S94 PolarHBondContact OD1-N 3.13Å
95	R	94.3	Very high	93.2	Very high	54 Å²	54	63.6 Å²	63.6	20%	0.204	34%	0.343	C	S	.	.	S	Bend	trans	-88.6	-41.7	179.4	-170.3	-158.5	71.8	87.5	-9.6	110.8	D92 F105 R106 P107 D112	D92-R95 PolarHBondContact OD1-N 2.8Å; D92-R95 WeakPolarHBondContact OD2-CB 3.32Å; D92-R95 PolarHBondContact OD2-N 2.83Å; R95-F105 CarbonylContact O-C 3.48Å; R95-F105 VanDerWaalsContact O-CA 3.26Å; R95-F105 WeakPolarHBondContact O-CA 3.26Å; R95-R106 PolarHBondContact O-N 2.74Å; R95-P107 WeakPolarHBondContact CG-O 3.13Å; R95-P107 PolarHBondContact NH1-O 3.11Å; R95-D112 IonicContact CZ-OD1 2.78Å; R95-D112 IonicContact CZ-OD2 2.88Å; R95-D112 IonicContact NH1-OD1 3.94Å; R95-D112 PolarHBondContact NH1-OD1 2.94Å; R95-D112 IonicContact NH1-OD2 2.89Å; R95-D112 PolarHBondContact NH1-OD2 2.89Å; R95-D112 IonicContact NH2-OD1 2.79Å; R95-D112 PolarHBondContact NH2-OD1 2.9Å; R95-D112 IonicContact NH2-OD2 3.25Å
96	M	95.3	Very high	93.6	Very high	23 Å²	23	57.6 Å²	57.6	11%	0.113	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	96.8	177.5	-170.7	176.7	61.1	0	0	109.4	I89 A90 F91 D92 G93 I103 W104 F105	I89-M96 HydrophobicContact CG2-CE 3.42Å; I89-M96 VanDerWaalsContact CG2-CE 3.42Å; I89-M96 HydrophobicContact CG2-SD 3.94Å; A90-M96 WeakPolarHBondContact O-CE 3.48Å; F91-M96 WeakPolarHBondContact CB-O 3.41Å; F91-M96 HydrophobicContact CD1-CG 4.08Å; F91-M96 HydrophobicContact CE1-CG 4.41Å; D92-M96 PolarHBondContact N-O 2.68Å; D92-M96 VanDerWaalsContact N-O 3.15Å; D92-M96 PolarHBondContact OD1-N 2.89Å; G93-M96 PolarHBondContact N-O 2.77Å; M96-I103 HydrophobicContact CG-CG2 4.02Å; M96-W104 WeakPolarHBondContact CA-O 3.48Å; M96-F105 HydrophobicContact CG-CD1 4.2Å; M96-F105 HydrophobicContact CG-CE1 3.86Å; M96-F105 HydrophobicContact CG-CZ 4.32Å; M96-F105 HydrophobicContact SD-CD1 4.43Å; M96-F105 HydrophobicContact SD-CE1 3.63Å; M96-F105 HydrophobicContact SD-CZ 4.13Å
97	S	96	Very high	93.8	Very high	7 Å²	7	55.9 Å²	55.9	5%	0.049	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	142.3	-176.5	45.2	0	0	0	0	111.2	E99 I103 W104 R106	S97-E99 PolarHBondContact OG-OE1 3.15Å; S97-I103 WeakPolarHBondContact O-CA 3.45Å; S97-W104 PolarHBondContact N-O 3.14Å; S97-W104 VanDerWaalsContact N-O 3.07Å; S97-W104 PolarHBondContact O-N 3.46Å; S97-R106 PolarHBondContact OG-NH1 2.85Å
98	K	95	Very high	94	Very high	86 Å²	86	49 Å²	49	37%	0.374	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	113.6	169.5	-177.7	-170.9	178.3	-174.8	0	108.2	L74 F91	L74-K98 PolarHBondContact O-NZ 3.32Å; F91-K98 HydrophobicContact CD1-CB 3.91Å; F91-K98 HydrophobicContact CD2-CB 4.04Å; F91-K98 HydrophobicContact CE1-CB 3.91Å; F91-K98 HydrophobicContact CE2-CB 4.05Å; F91-K98 HydrophobicContact CE2-CD 4.18Å; F91-K98 HydrophobicContact CG-CB 3.98Å; F91-K98 HydrophobicContact CZ-CB 3.98Å; F91-K98 HydrophobicContact CZ-CD 4.5Å; F91-K98 HydrophobicContact CZ-CG 4.41Å
99	E	94	Very high	94.2	Very high	71 Å²	71	47.6 Å²	47.6	33%	0.332	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	116.9	-178.9	-62.3	175.4	-166.6	0	0	108.8	S97 D101 S102 W104 R106	S97-E99 PolarHBondContact OG-OE1 3.15Å; E99-D101 PolarHBondContact O-N 3.09Å; E99-D101 VanDerWaalsContact O-N 3.1Å; E99-S102 PolarHBondContact N-O 2.97Å; E99-S102 PolarHBondContact O-N 2.74Å; E99-S102 VanDerWaalsContact O-O 3.11Å; E99-S102 PolarHBondContact O-OG 3.24Å; E99-W104 VanDerWaalsContact CD-CD1 3.47Å; E99-W104 PolarHBondContact OE2-NE1 3.43Å; E99-R106 IonicContact OE1-CZ 3.65Å; E99-R106 VanDerWaalsContact OE1-CZ 3.25Å; E99-R106 IonicContact OE1-NH1 2.84Å; E99-R106 PolarHBondContact OE1-NH1 3.09Å; E99-R106 IonicContact OE1-NH2 2.85Å; E99-R106 PolarHBondContact OE1-NH2 3.44Å; E99-R106 IonicContact OE2-CZ 2.7Å; E99-R106 IonicContact OE2-NH2 3.84Å; E99-R106 PolarHBondContact OE2-NH2 3Å
100	E	92.2	Very high	94.3	Very high	136 Å²	136	49.9 Å²	49.9	64%	0.636	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.5	-111.4	-175.1	-56.1	-175.2	148.2	0	0	112.8	Y64	Y64-E100 HydrophobicContact CD1-CB 4.05Å; Y64-E100 HydrophobicContact CE1-CB 4.02Å
101	D	94	Very high	94.4	Very high	8 Å²	8	53.4 Å²	53.4	4%	0.043	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.6	7	-176.2	74.2	-27.8	0	0	0	113.5	R50 C53 F56 Y57 Y64 E99	R50-D101 IonicContact NH2-OD1 3.54Å; R50-D101 PolarHBondContact NH2-OD1 2.84Å; C53-D101 VanDerWaalsContact CB-O 3.31Å; C53-D101 WeakPolarHBondContact CB-O 3.43Å; C53-D101 PolarHBondContact N-O 3.5Å; F56-D101 HydrophobicContact CD2-CB 4Å; F56-D101 HydrophobicContact CE2-CB 4.14Å; Y57-D101 WeakPolarHBondContact CE2-OD2 3.43Å; Y57-D101 PolarHBondContact OH-OD2 2.75Å; Y64-D101 HydrophobicContact CD1-CB 4.43Å; Y64-D101 HydrophobicContact CD2-CB 4.17Å; Y64-D101 HydrophobicContact CG-CB 3.85Å; E99-D101 PolarHBondContact O-N 3.09Å; E99-D101 VanDerWaalsContact O-N 3.1Å
102	S	95.6	Very high	94.5	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	157.9	-163.1	65.5	0	0	0	0	114	R50 I51 E99	R50-S102 PolarHBondContact NE-OG 2.81Å; R50-S102 PolarHBondContact NH2-OG 3.2Å; I51-S102 CarbonylContact O-C 3.52Å; I51-S102 WeakPolarHBondContact O-CA 3.42Å; I51-S102 WeakPolarHBondContact O-CB 3.3Å; E99-S102 PolarHBondContact N-O 2.97Å; E99-S102 PolarHBondContact O-N 2.74Å; E99-S102 VanDerWaalsContact O-O 3.11Å; E99-S102 PolarHBondContact O-OG 3.24Å
103	I	96.4	Very high	94.7	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	131.7	168.3	-55.1	175.8	0	0	0	108.2	R50 I51 W76 I89 F91 M96 S97 F105 Y116	R50-I103 CarbonylContact C-O 3.49Å; R50-I103 WeakPolarHBondContact CA-O 3.23Å; I51-I103 PolarHBondContact N-O 2.98Å; I51-I103 PolarHBondContact O-N 2.88Å; W76-I103 HydrophobicContact CB-CD1 4.05Å; W76-I103 HydrophobicContact CD2-CD1 3.58Å; W76-I103 HydrophobicContact CD2-CG1 3.9Å; W76-I103 HydrophobicContact CE3-CD1 3.71Å; W76-I103 HydrophobicContact CE3-CG1 4.37Å; W76-I103 HydrophobicContact CG-CD1 3.78Å; W76-I103 HydrophobicContact CG-CG1 4.1Å; W76-I103 HydrophobicContact CZ2-CG1 4.18Å; W76-I103 HydrophobicContact CZ3-CD1 4.23Å; I89-I103 HydrophobicContact CD1-CD1 4.03Å; F91-I103 HydrophobicContact CE1-CB 4.49Å; F91-I103 HydrophobicContact CE1-CD1 4Å; F91-I103 HydrophobicContact CE1-CG1 3.88Å; F91-I103 HydrophobicContact CE1-CG2 3.93Å; F91-I103 HydrophobicContact CZ-CD1 4.09Å; F91-I103 HydrophobicContact CZ-CG1 4.16Å; M96-I103 HydrophobicContact CG-CG2 4.02Å; S97-I103 WeakPolarHBondContact O-CA 3.45Å; I103-F105 HydrophobicContact CB-CE2 4.14Å; I103-F105 HydrophobicContact CG2-CD2 4.12Å; I103-F105 HydrophobicContact CG2-CE2 3.47Å; I103-F105 VanDerWaalsContact CG2-CE2 3.47Å; I103-F105 HydrophobicContact CG2-CZ 3.72Å; I103-Y116 HydrophobicContact CD1-CD1 3.73Å; I103-Y116 HydrophobicContact CD1-CE1 4.34Å
104	W	96.2	Very high	95	Very high	17 Å²	17	46.3 Å²	46.3	6%	0.064	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	137.2	170.8	-79.4	93.9	0	0	0	111.6	R50 M96 S97 E99 R106 D169 F170	R50-W104 HydrophobicContact CB-CD2 3.77Å; R50-W104 HydrophobicContact CB-CE3 3.86Å; R50-W104 HydrophobicContact CB-CG 4.43Å; R50-W104 HydrophobicContact CB-CH2 4.19Å; R50-W104 HydrophobicContact CB-CZ2 4.12Å; R50-W104 HydrophobicContact CB-CZ3 4.06Å; R50-W104 HydrophobicContact CG-CD2 3.87Å; R50-W104 HydrophobicContact CG-CE3 4.47Å; R50-W104 HydrophobicContact CG-CG 4.23Å; R50-W104 HydrophobicContact CG-CZ2 4.07Å; M96-W104 WeakPolarHBondContact CA-O 3.48Å; S97-W104 PolarHBondContact N-O 3.14Å; S97-W104 VanDerWaalsContact N-O 3.07Å; S97-W104 PolarHBondContact O-N 3.46Å; E99-W104 VanDerWaalsContact CD-CD1 3.47Å; E99-W104 PolarHBondContact OE2-NE1 3.43Å; W104-R106 VanDerWaalsContact CE2-NH2 3.27Å; W104-R106 HydrophobicContact CE3-CG 4.37Å; W104-D169 HydrophobicContact CH2-CB 4Å; W104-F170 HydrophobicContact CZ3-CE1 4.11Å
105	F	96.5	Very high	95.3	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	125.3	169.2	-59.2	-98.6	0	0	0	108.8	P48 V49 I51 R95 M96 I103 T108 D112 Y116 L133	P48-F105 VanDerWaalsContact CA-O 3.23Å; P48-F105 WeakPolarHBondContact CA-O 3.49Å; V49-F105 HydrophobicContact CG1-CB 4.07Å; V49-F105 HydrophobicContact CG1-CD2 3.75Å; V49-F105 HydrophobicContact CG1-CG 4.22Å; V49-F105 PolarHBondContact N-O 3.24Å; V49-F105 VanDerWaalsContact N-O 3.11Å; V49-F105 PolarHBondContact O-N 3.35Å; I51-F105 HydrophobicContact CD1-CE2 3.8Å; I51-F105 HydrophobicContact CG1-CE2 4.19Å; R95-F105 CarbonylContact O-C 3.48Å; R95-F105 VanDerWaalsContact O-CA 3.26Å; R95-F105 WeakPolarHBondContact O-CA 3.26Å; M96-F105 HydrophobicContact CG-CD1 4.2Å; M96-F105 HydrophobicContact CG-CE1 3.86Å; M96-F105 HydrophobicContact CG-CZ 4.32Å; M96-F105 HydrophobicContact SD-CD1 4.43Å; M96-F105 HydrophobicContact SD-CE1 3.63Å; M96-F105 HydrophobicContact SD-CZ 4.13Å; I103-F105 HydrophobicContact CB-CE2 4.14Å; I103-F105 HydrophobicContact CG2-CD2 4.12Å; I103-F105 HydrophobicContact CG2-CE2 3.47Å; I103-F105 VanDerWaalsContact CG2-CE2 3.47Å; I103-F105 HydrophobicContact CG2-CZ 3.72Å; F105-T108 HydrophobicContact CB-CG2 3.59Å; F105-T108 HydrophobicContact CG-CG2 4.13Å; F105-D112 HydrophobicContact CD1-CB 4.14Å; F105-D112 HydrophobicContact CE1-CB 3.93Å; F105-Y116 HydrophobicContact CE1-CE1 4.44Å; F105-Y116 HydrophobicContact CZ-CD1 4.46Å; F105-Y116 AromaticContact CZ-CE1 3.67Å; F105-Y116 HydrophobicContact CZ-CE1 3.67Å; F105-Y116 HydrophobicContact CZ-CE2 4.4Å; F105-Y116 AromaticContact CZ-CZ 3.64Å; F105-L133 HydrophobicContact CE1-CD2 4.47Å; F105-L133 HydrophobicContact CE2-CD2 4.14Å; F105-L133 HydrophobicContact CZ-CD2 4.13Å
106	R	95	Very high	95.4	Very high	72 Å²	72	40 Å²	40	27%	0.272	20%	0.197	S	C	.	.	S	Bend	trans	-143.7	79.8	-174.3	-58	-175.6	-168	120.8	-5.8	110.7	R95 S97 E99 W104 F223	R95-R106 PolarHBondContact O-N 2.74Å; S97-R106 PolarHBondContact OG-NH1 2.85Å; E99-R106 IonicContact OE1-CZ 3.65Å; E99-R106 VanDerWaalsContact OE1-CZ 3.25Å; E99-R106 IonicContact OE1-NH1 2.84Å; E99-R106 PolarHBondContact OE1-NH1 3.09Å; E99-R106 IonicContact OE1-NH2 2.85Å; E99-R106 PolarHBondContact OE1-NH2 3.44Å; E99-R106 IonicContact OE2-CZ 2.7Å; E99-R106 IonicContact OE2-NH2 3.84Å; E99-R106 PolarHBondContact OE2-NH2 3Å; W104-R106 VanDerWaalsContact CE2-NH2 3.27Å; W104-R106 HydrophobicContact CE3-CG 4.37Å; R106-F223 HydrophobicContact CB-CE2 4.38Å
107	P	95.3	Very high	95.4	Very high	34 Å²	34	38.9 Å²	38.9	22%	0.221	19%	0.192	C	C	.	.	S	Bend	cis	-94.2	175.9	-3.1	37.5	-34.7	0	0	0	113.4	G46 R95 F223	G46-P107 VanDerWaalsContact O-CB 3.24Å; G46-P107 WeakPolarHBondContact O-CB 3.07Å; R95-P107 WeakPolarHBondContact CG-O 3.13Å; R95-P107 PolarHBondContact NH1-O 3.11Å; P107-F223 HydrophobicContact CB-CD1 4.05Å; P107-F223 HydrophobicContact CB-CE1 3.78Å; P107-F223 HydrophobicContact CB-CZ 4.44Å; P107-F223 HydrophobicContact CG-CE1 3.88Å
108	T	96.2	Very high	95.4	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.19	C	C	.	.			trans	-72.1	143.7	166.3	53.9	0	0	0	0	113	V43 L44 G46 E47 V49 F105 D112 V135	V43-T108 HydrophobicContact CG2-CG2 4.01Å; L44-T108 PolarHBondContact O-OG1 3.02Å; G46-T108 PolarHBondContact N-O 3.15Å; E47-T108 PolarHBondContact O-N 3.15Å; E47-T108 PolarHBondContact O-OG1 2.8Å; V49-T108 HydrophobicContact CB-CG2 4.3Å; V49-T108 HydrophobicContact CG1-CG2 3.48Å; V49-T108 VanDerWaalsContact CG1-CG2 3.48Å; F105-T108 HydrophobicContact CB-CG2 3.59Å; F105-T108 HydrophobicContact CG-CG2 4.13Å; T108-D112 WeakPolarHBondContact CA-OD2 3.34Å; T108-V135 HydrophobicContact CG2-CG2 4.2Å
109	L	96.7	Very high	95.4	Very high	72 Å²	72	34.9 Å²	34.9	38%	0.377	18%	0.175	S	C	.	.			trans	-113.1	154.9	171.7	-57.9	176.1	0	0	0	109.4	Q111 D112	L109-Q111 PolarHBondContact O-N 2.86Å; L109-Q111 VanDerWaalsContact O-N 3.13Å; L109-D112 PolarHBondContact N-OD2 2.79Å; L109-D112 WeakPolarHBondContact O-CB 3.15Å; L109-D112 PolarHBondContact O-N 2.85Å
110	L	95.5	Very high	95.5	Very high	75 Å²	75	31.6 Å²	31.6	39%	0.393	16%	0.159	S	C	.	.	G	3₁₀ helix	trans	-55.1	-35	178.1	-65.2	172.9	0	0	0	112.8	V45 D112 S113 V135 E137	V45-L110 HydrophobicContact CB-CD2 3.88Å; V45-L110 HydrophobicContact CB-CG 4.24Å; V45-L110 HydrophobicContact CG1-CD2 4.37Å; V45-L110 HydrophobicContact CG2-CD2 4.21Å; V45-L110 HydrophobicContact CG2-CG 4Å; L110-D112 PolarHBondContact O-N 2.87Å; L110-S113 WeakPolarHBondContact O-CB 3.11Å; L110-S113 PolarHBondContact O-N 2.8Å; L110-S113 PolarHBondContact O-OG 2.69Å; L110-V135 HydrophobicContact CD2-CG1 4.4Å; L110-E137 HydrophobicContact CD1-CG 4.02Å; L110-E137 HydrophobicContact CD2-CG 3.81Å; L110-E137 HydrophobicContact CG-CG 4.5Å
111	Q	94.2	Very high	95.5	Very high	162 Å²	162	29.4 Å²	29.4	76%	0.757	15%	0.145	S	C	*	.	G	3₁₀ helix	trans	-66.6	-15.5	176.9	-64.6	176.9	-4.7	0	0	114.1	K78 L109 S113	K78-Q111 PolarHBondContact NZ-O 3.42Å; L109-Q111 PolarHBondContact O-N 2.86Å; L109-Q111 VanDerWaalsContact O-N 3.13Å; Q111-S113 PolarHBondContact O-N 2.8Å
112	D	95.4	Very high	95.3	Very high	9 Å²	9	31.3 Å²	31.3	5%	0.048	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-74.3	-13.8	175.1	-62.7	-43.6	0	0	0	112.3	R95 F105 T108 L109 L110 G114 Y116 L133 V135	R95-D112 IonicContact CZ-OD1 2.78Å; R95-D112 IonicContact CZ-OD2 2.88Å; R95-D112 IonicContact NH1-OD1 3.94Å; R95-D112 PolarHBondContact NH1-OD1 2.94Å; R95-D112 IonicContact NH1-OD2 2.89Å; R95-D112 PolarHBondContact NH1-OD2 2.89Å; R95-D112 IonicContact NH2-OD1 2.79Å; R95-D112 PolarHBondContact NH2-OD1 2.9Å; R95-D112 IonicContact NH2-OD2 3.25Å; F105-D112 HydrophobicContact CD1-CB 4.14Å; F105-D112 HydrophobicContact CE1-CB 3.93Å; T108-D112 WeakPolarHBondContact CA-OD2 3.34Å; L109-D112 PolarHBondContact N-OD2 2.79Å; L109-D112 WeakPolarHBondContact O-CB 3.15Å; L109-D112 PolarHBondContact O-N 2.85Å; L110-D112 PolarHBondContact O-N 2.87Å; D112-G114 PolarHBondContact O-N 3.38Å; D112-Y116 VanDerWaalsContact O-CE2 3.27Å; D112-Y116 WeakPolarHBondContact O-CE2 3.37Å; D112-Y116 PolarHBondContact O-OH 3.38Å; D112-L133 HydrophobicContact CB-CD2 3.92Å; D112-V135 HydrophobicContact CB-CG2 4.21Å
113	S	95.6	Very high	95	Very high	42 Å²	42	36.2 Å²	36.2	29%	0.294	19%	0.19	S	C	.	.			trans	-54.3	137.8	174.4	-58.7	0	0	0	0	111.8	L110 Q111 L133 V135	L110-S113 WeakPolarHBondContact O-CB 3.11Å; L110-S113 PolarHBondContact O-N 2.8Å; L110-S113 PolarHBondContact O-OG 2.69Å; Q111-S113 PolarHBondContact O-N 2.8Å; S113-L133 WeakPolarHBondContact CA-O 3.24Å; S113-V135 PolarHBondContact OG-N 2.72Å; S113-V135 PolarHBondContact OG-O 2.95Å
114	G	95.2	Very high	94.6	Very high	8 Å²	8	41.6 Å²	41.6	8%	0.082	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	154.3	-166.3	-178.4	0	0	0	0	0	113.4	S79 D112 L133	S79-G114 WeakPolarHBondContact O-CA 3.05Å; D112-G114 PolarHBondContact O-N 3.38Å; G114-L133 PolarHBondContact N-O 3.4Å; G114-L133 PolarHBondContact O-N 3.17Å; G114-L133 VanDerWaalsContact O-O 3.1Å
115	L	96.7	Very high	94.4	Very high	15 Å²	15	44.7 Å²	44.7	8%	0.079	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	131.6	174	-56.5	-179.9	0	0	0	109.8	I36 K78 S79 P82	I36-L115 HydrophobicContact CD1-CD1 3.7Å; I36-L115 HydrophobicContact CD1-CD2 3.99Å; I36-L115 HydrophobicContact CG1-CD1 4.11Å; I36-L115 HydrophobicContact CG1-CD2 4.38Å; I36-L115 HydrophobicContact CG2-CD2 4.49Å; K78-L115 CarbonylContact C-O 3.49Å; K78-L115 VanDerWaalsContact CA-O 3.32Å; K78-L115 WeakPolarHBondContact CA-O 3.39Å; S79-L115 PolarHBondContact N-O 3.35Å; S79-L115 PolarHBondContact O-N 3.04Å; P82-L115 HydrophobicContact CB-CD1 4.42Å; P82-L115 HydrophobicContact CG-CD1 4.17Å
116	Y	96.7	Very high	94.3	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.008	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	100.1	-179.1	-74.3	-98	0	0	0	109.5	I51 Y77 K78 I89 I103 F105 D112 C118 I131 L133	I51-Y116 HydrophobicContact CD1-CD2 4.28Å; I51-Y116 HydrophobicContact CD1-CG 4.46Å; Y77-Y116 CarbonylContact O-C 3.58Å; Y77-Y116 WeakPolarHBondContact O-CA 3.38Å; K78-Y116 HydrophobicContact CB-CE1 4.47Å; K78-Y116 HydrophobicContact CD-CE1 4.32Å; K78-Y116 HydrophobicContact CG-CE1 4.35Å; K78-Y116 HydrophobicContact CG-CE2 4.45Å; I89-Y116 HydrophobicContact CD1-CD1 3.46Å; I89-Y116 VanDerWaalsContact CD1-CD1 3.46Å; I89-Y116 HydrophobicContact CD1-CE1 3.62Å; I103-Y116 HydrophobicContact CD1-CD1 3.73Å; I103-Y116 HydrophobicContact CD1-CE1 4.34Å; F105-Y116 HydrophobicContact CE1-CE1 4.44Å; F105-Y116 HydrophobicContact CZ-CD1 4.46Å; F105-Y116 AromaticContact CZ-CE1 3.67Å; F105-Y116 HydrophobicContact CZ-CE1 3.67Å; F105-Y116 HydrophobicContact CZ-CE2 4.4Å; F105-Y116 AromaticContact CZ-CZ 3.64Å; D112-Y116 VanDerWaalsContact O-CE2 3.27Å; D112-Y116 WeakPolarHBondContact O-CE2 3.37Å; D112-Y116 PolarHBondContact O-OH 3.38Å; Y116-C118 PolarHBondContact O-N 2.86Å; Y116-I131 PolarHBondContact N-O 2.87Å; Y116-I131 PolarHBondContact O-N 2.69Å; Y116-L133 HydrophobicContact CD2-CB 4.01Å; Y116-L133 HydrophobicContact CE2-CB 3.94Å; Y116-L133 HydrophobicContact CE2-CD2 3.97Å
117	A	95.8	Very high	94.2	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.008	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	109.9	179.9	0	0	0	0	0	110.9	W76 Y77 E86 V129	W76-A117 WeakPolarHBondContact CA-O 3.41Å; Y77-A117 PolarHBondContact N-O 3.5Å; Y77-A117 PolarHBondContact O-N 2.87Å; E86-A117 WeakPolarHBondContact OE1-CB 3.4Å; A117-V129 WeakPolarHBondContact CA-O 3.46Å
118	C	95.5	Very high	94.2	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	121.5	166.4	174.5	0	0	0	0	109.1	C53 L74 W76 Y116 K128 V129 I131	C53-C118 HydrophobicContact CB-CB 3.79Å; C53-C118 WeakPolarHBondContact CB-SG 3.34Å; C53-C118 WeakPolarHBondContact SG-CB 3.47Å; C53-C118 CovalentContact SG-SG 2.02Å; C53-C118 PolarHBondContact SG-SG 2.89Å; L74-C118 WeakPolarHBondContact CD1-SG 3.36Å; W76-C118 HydrophobicContact CD2-CB 4.32Å; W76-C118 HydrophobicContact CE3-CB 3.92Å; W76-C118 HydrophobicContact CH2-CB 3.85Å; W76-C118 HydrophobicContact CZ2-CB 4.22Å; W76-C118 HydrophobicContact CZ3-CB 3.68Å; Y116-C118 PolarHBondContact O-N 2.86Å; C118-K128 CarbonylContact O-C 3.52Å; C118-K128 WeakPolarHBondContact O-CA 3.34Å; C118-K128 WeakPolarHBondContact O-CB 3.18Å; C118-V129 HydrophobicContact CB-CG1 4.49Å; C118-V129 PolarHBondContact N-O 2.82Å; C118-V129 PolarHBondContact O-N 3.27Å; C118-I131 HydrophobicContact CB-CD1 4.11Å
119	V	95.3	Very high	94.2	Very high	9 Å²	9	42.3 Å²	42.3	6%	0.055	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	123.2	179.5	-174	0	0	0	0	109.6	M75 Y77 K128	M75-V119 HydrophobicContact CB-CB 4.42Å; M75-V119 HydrophobicContact CE-CG1 4.19Å; M75-V119 PolarHBondContact N-O 3.17Å; M75-V119 PolarHBondContact O-N 2.86Å; Y77-V119 HydrophobicContact CD2-CB 4.46Å; Y77-V119 HydrophobicContact CD2-CG2 3.58Å; Y77-V119 HydrophobicContact CE2-CB 4.15Å; Y77-V119 HydrophobicContact CE2-CG2 3.63Å; V119-K128 HydrophobicContact CB-CB 4.23Å; V119-K128 HydrophobicContact CG1-CB 4.32Å; V119-K128 HydrophobicContact CG2-CB 3.74Å; V119-K128 HydrophobicContact CG2-CD 4.26Å
120	I	94.5	Very high	94.1	Very high	2 Å²	2	39.3 Å²	39.3	1%	0.01	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	129	166.9	62.4	-178.9	0	0	0	109.6	L55 F56 I60 L72 S73 L74 Y125 C126 M127	L55-I120 HydrophobicContact CD1-CB 4.41Å; L55-I120 HydrophobicContact CD1-CD1 3.81Å; L55-I120 HydrophobicContact CD1-CG1 3.73Å; L55-I120 HydrophobicContact CD1-CG2 4.05Å; F56-I120 HydrophobicContact CE1-CG2 4.5Å; F56-I120 HydrophobicContact CZ-CG2 3.93Å; I60-I120 HydrophobicContact CD1-CD1 3.56Å; L72-I120 HydrophobicContact CD2-CB 4.27Å; L72-I120 HydrophobicContact CD2-CD1 4.21Å; L72-I120 HydrophobicContact CD2-CG1 4.37Å; S73-I120 WeakPolarHBondContact O-CA 3.42Å; L74-I120 HydrophobicContact CD1-CG2 4.13Å; I120-Y125 HydrophobicContact CD1-CE1 3.97Å; I120-Y125 HydrophobicContact CG1-CE1 4.11Å; I120-C126 WeakPolarHBondContact O-CA 3.4Å; I120-M127 HydrophobicContact CD1-CB 4.26Å; I120-M127 HydrophobicContact CG1-CB 3.91Å; I120-M127 PolarHBondContact N-O 2.9Å; I120-M127 PolarHBondContact O-N 2.86Å
121	R	93.2	Very high	94.2	Very high	89 Å²	89	35.7 Å²	35.7	34%	0.336	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	145.2	-175.2	-171.4	166.7	-174.3	123.3	6.6	113.4	A28 L72 S73 M75 Y125 C126	A28-R121 PolarHBondContact O-NH2 3.48Å; A28-R121 VanDerWaalsContact O-NH2 3.07Å; L72-R121 WeakPolarHBondContact CA-O 3.38Å; S73-R121 PolarHBondContact N-O 3.23Å; S73-R121 PolarHBondContact O-N 2.95Å; S73-R121 PolarHBondContact OG-O 3.26Å; M75-R121 HydrophobicContact CE-CB 3.98Å; R121-Y125 CarbonylContact C-O 3.48Å; R121-Y125 VanDerWaalsContact CA-O 3.31Å; R121-Y125 WeakPolarHBondContact CA-O 3.34Å; R121-C126 HydrophobicContact CB-CB 4.48Å; R121-C126 HydrophobicContact CG-CB 4.05Å; R121-C126 PolarHBondContact NH1-SG 3.31Å
122	N	89.9	Confident	94.3	Very high	49 Å²	49	28.9 Å²	28.9	26%	0.262	16%	0.161	S	C	.	.			trans	-131.2	-162	157	79.9	8.7	0	0	0	109.7	T124 Y125	N122-T124 VanDerWaalsContact C-N 3.31Å; N122-T124 PolarHBondContact O-N 2.73Å; N122-T124 PolarHBondContact OD1-N 2.89Å; N122-T124 PolarHBondContact OD1-OG1 2.79Å; N122-Y125 PolarHBondContact N-O 2.64Å; N122-Y125 WeakPolarHBondContact OD1-CB 2.92Å; N122-Y125 PolarHBondContact OD1-N 3.32Å
123	S	88.6	Confident	94.4	Very high	103 Å²	103	28.6 Å²	28.6	72%	0.72	16%	0.159	S	C	*	.	S	Bend	trans	-63.7	-26.9	-179.6	51.2	0	0	0	0	115.3
124	T	89.6	Confident	94.4	Very high	112 Å²	112	29.3 Å²	29.3	69%	0.687	16%	0.162	S	C	*	.	S	Bend	trans	-126.4	-16.3	-174.4	57.4	0	0	0	0	114.2	N122	N122-T124 VanDerWaalsContact C-N 3.31Å; N122-T124 PolarHBondContact O-N 2.73Å; N122-T124 PolarHBondContact OD1-N 2.89Å; N122-T124 PolarHBondContact OD1-OG1 2.79Å
125	Y	90.5	Very high	94.5	Very high	82 Å²	82	29.3 Å²	29.3	32%	0.322	16%	0.161	S	C	.	.			trans	-118	132.7	-176.6	-178	-98.5	0	0	0	110.5	L72 I120 R121 N122 M127	L72-Y125 HydrophobicContact CD2-CD1 3.73Å; L72-Y125 HydrophobicContact CD2-CE1 3.82Å; I120-Y125 HydrophobicContact CD1-CE1 3.97Å; I120-Y125 HydrophobicContact CG1-CE1 4.11Å; R121-Y125 CarbonylContact C-O 3.48Å; R121-Y125 VanDerWaalsContact CA-O 3.31Å; R121-Y125 WeakPolarHBondContact CA-O 3.34Å; N122-Y125 PolarHBondContact N-O 2.64Å; N122-Y125 WeakPolarHBondContact OD1-CB 2.92Å; N122-Y125 PolarHBondContact OD1-N 3.32Å; Y125-M127 HydrophobicContact CE1-CB 4.1Å; Y125-M127 VanDerWaalsContact OH-CE 3.28Å; Y125-M127 WeakPolarHBondContact OH-CE 3.47Å; Y125-M127 PolarHBondContact OH-SD 3.42Å
126	C	94.3	Very high	94.4	Very high	11 Å²	11	29.1 Å²	29.1	7%	0.074	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	130.3	171.6	-170.9	0	0	0	0	109.7	C31 T32 I120 R121	C31-C126 HydrophobicContact CB-CB 3.86Å; C31-C126 WeakPolarHBondContact CB-SG 3.49Å; C31-C126 WeakPolarHBondContact SG-CB 3.29Å; C31-C126 CovalentContact SG-SG 2.05Å; C31-C126 PolarHBondContact SG-SG 2.97Å; T32-C126 PolarHBondContact N-O 3Å; T32-C126 PolarHBondContact OG1-O 3.45Å; I120-C126 WeakPolarHBondContact O-CA 3.4Å; R121-C126 HydrophobicContact CB-CB 4.48Å; R121-C126 HydrophobicContact CG-CB 4.05Å; R121-C126 PolarHBondContact NH1-SG 3.31Å
127	M	94.7	Very high	94.4	Very high	18 Å²	18	34.6 Å²	34.6	9%	0.089	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	139.5	175.1	-178.5	173.2	-76.1	0	0	109.6	C31 T32 W34 L55 I60 I120 Y125	C31-M127 PolarHBondContact SG-N 3.31Å; T32-M127 HydrophobicContact CG2-CE 4.22Å; T32-M127 CarbonylContact O-C 3.57Å; T32-M127 WeakPolarHBondContact O-CA 3.36Å; W34-M127 HydrophobicContact CZ2-CE 4.17Å; W34-M127 PolarHBondContact NE1-SD 3.32Å; L55-M127 HydrophobicContact CD1-CG 4.37Å; L55-M127 HydrophobicContact CD2-CG 3.98Å; L55-M127 HydrophobicContact CD2-SD 4.13Å; I60-M127 HydrophobicContact CG2-SD 3.85Å; I120-M127 HydrophobicContact CD1-CB 4.26Å; I120-M127 HydrophobicContact CG1-CB 3.91Å; I120-M127 PolarHBondContact N-O 2.9Å; I120-M127 PolarHBondContact O-N 2.86Å; Y125-M127 HydrophobicContact CE1-CB 4.1Å; Y125-M127 VanDerWaalsContact OH-CE 3.28Å; Y125-M127 WeakPolarHBondContact OH-CE 3.47Å; Y125-M127 PolarHBondContact OH-SD 3.42Å
128	K	94.6	Very high	94.4	Very high	27 Å²	27	38.8 Å²	38.8	12%	0.117	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	155.9	175.8	75	167.5	-169.2	165.7	0	113.6	T32 D33 W34 E86 C118 V119	T32-K128 PolarHBondContact O-N 3.08Å; D33-K128 HydrophobicContact CB-CG 4.11Å; D33-K128 WeakPolarHBondContact OD1-CE 3.35Å; D33-K128 WeakPolarHBondContact OD2-CE 3.23Å; D33-K128 IonicContact OD2-NZ 3.22Å; D33-K128 PolarHBondContact OD2-NZ 3.07Å; W34-K128 PolarHBondContact N-O 3.28Å; E86-K128 IonicContact OE1-NZ 2.8Å; E86-K128 PolarHBondContact OE1-NZ 2.81Å; E86-K128 IonicContact OE2-NZ 3.77Å; E86-K128 PolarHBondContact OE2-NZ 3.02Å; C118-K128 CarbonylContact O-C 3.52Å; C118-K128 WeakPolarHBondContact O-CA 3.34Å; C118-K128 WeakPolarHBondContact O-CB 3.18Å; V119-K128 HydrophobicContact CB-CB 4.23Å; V119-K128 HydrophobicContact CG1-CB 4.32Å; V119-K128 HydrophobicContact CG2-CB 3.74Å; V119-K128 HydrophobicContact CG2-CD 4.26Å
129	V	95.7	Very high	94.3	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	142.8	169.4	71.1	0	0	0	0	109.1	W34 S35 D37 A54 L55 Y59 A117 C118 I131	W34-V129 HydrophobicContact CB-CB 4.09Å; W34-V129 HydrophobicContact CB-CG2 3.92Å; S35-V129 WeakPolarHBondContact O-CG2 3.4Å; D37-V129 HydrophobicContact CB-CG2 3.99Å; A54-V129 HydrophobicContact CB-CG1 3.97Å; L55-V129 HydrophobicContact CD2-CB 3.8Å; L55-V129 HydrophobicContact CD2-CG1 3.59Å; L55-V129 HydrophobicContact CG-CB 4.35Å; L55-V129 HydrophobicContact CG-CG1 3.63Å; Y59-V129 HydrophobicContact CE2-CG2 4.04Å; A117-V129 WeakPolarHBondContact CA-O 3.46Å; C118-V129 HydrophobicContact CB-CG1 4.49Å; C118-V129 PolarHBondContact N-O 2.82Å; C118-V129 PolarHBondContact O-N 3.27Å; V129-I131 HydrophobicContact CG1-CD1 4.11Å
130	S	95.7	Very high	94.2	Very high	9 Å²	9	47.7 Å²	47.7	6%	0.063	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	127.8	179.8	-65.8	0	0	0	0	111.2	S35 I36 D37	S35-S130 PolarHBondContact O-N 2.91Å; I36-S130 CarbonylContact C-O 3.56Å; I36-S130 VanDerWaalsContact CA-O 3.23Å; I36-S130 WeakPolarHBondContact CA-O 3.35Å; D37-S130 PolarHBondContact N-O 3.29Å
131	I	96.7	Very high	94	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	130.6	176.3	-59.7	90.6	0	0	0	108.7	D37 Y41 I51 A54 W76 Y116 C118 V129	D37-I131 HydrophobicContact CB-CG1 4.33Å; Y41-I131 HydrophobicContact CD2-CG2 3.5Å; Y41-I131 HydrophobicContact CE2-CG2 3.61Å; I51-I131 HydrophobicContact CG2-CB 3.99Å; I51-I131 HydrophobicContact CG2-CG1 4.49Å; I51-I131 HydrophobicContact CG2-CG2 3.72Å; A54-I131 HydrophobicContact CB-CD1 4.26Å; A54-I131 HydrophobicContact CB-CG1 4.04Å; W76-I131 HydrophobicContact CH2-CD1 4.02Å; W76-I131 HydrophobicContact CZ3-CD1 3.88Å; Y116-I131 PolarHBondContact N-O 2.87Å; Y116-I131 PolarHBondContact O-N 2.69Å; C118-I131 HydrophobicContact CB-CD1 4.11Å; V129-I131 HydrophobicContact CG1-CD1 4.11Å
132	S	96.6	Very high	94.1	Very high	19 Å²	19	50.1 Å²	50.1	13%	0.133	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	124.6	-179.7	-177.4	0	0	0	0	111.2	Y41	Y41-S132 PolarHBondContact N-O 2.76Å
133	L	96.7	Very high	94.4	Very high	2 Å²	2	49 Å²	49	1%	0.01	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	127.2	167.3	177.7	63	0	0	0	109.2	Y41 V43 V49 I51 F105 D112 S113 G114 Y116 V135	Y41-L133 CarbonylContact O-C 3.53Å; Y41-L133 WeakPolarHBondContact O-CA 3.23Å; V43-L133 HydrophobicContact CG2-CD1 4.22Å; V49-L133 HydrophobicContact CG1-CD1 4.14Å; I51-L133 HydrophobicContact CD1-CB 3.79Å; I51-L133 HydrophobicContact CD1-CD1 4.2Å; I51-L133 HydrophobicContact CD1-CD2 3.97Å; I51-L133 HydrophobicContact CD1-CG 4.17Å; F105-L133 HydrophobicContact CE1-CD2 4.47Å; F105-L133 HydrophobicContact CE2-CD2 4.14Å; F105-L133 HydrophobicContact CZ-CD2 4.13Å; D112-L133 HydrophobicContact CB-CD2 3.92Å; S113-L133 WeakPolarHBondContact CA-O 3.24Å; G114-L133 PolarHBondContact N-O 3.4Å; G114-L133 PolarHBondContact O-N 3.17Å; G114-L133 VanDerWaalsContact O-O 3.1Å; Y116-L133 HydrophobicContact CD2-CB 4.01Å; Y116-L133 HydrophobicContact CE2-CB 3.94Å; Y116-L133 HydrophobicContact CE2-CD2 3.97Å; L133-V135 HydrophobicContact CD1-CG2 4.17Å; L133-V135 HydrophobicContact CD2-CG2 4.03Å; L133-V135 HydrophobicContact CG-CG2 3.97Å
134	T	96.5	Very high	94.7	Very high	58 Å²	58	44.9 Å²	44.9	36%	0.356	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	121.5	169.3	-48.2	0	0	0	0	109	Y41 Q42 V43 M148	Y41-T134 PolarHBondContact O-N 2.66Å; Q42-T134 WeakPolarHBondContact CA-O 3.48Å; V43-T134 PolarHBondContact N-O 2.94Å; V43-T134 VanDerWaalsContact N-O 3.12Å; T134-M148 HydrophobicContact CG2-CE 3.44Å; T134-M148 VanDerWaalsContact CG2-CE 3.44Å; T134-M148 WeakPolarHBondContact O-CE 3.49Å
135	V	96.8	Very high	95.1	Very high	8 Å²	8	40.7 Å²	40.7	5%	0.048	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	117.2	176.8	-172.4	0	0	0	0	108.2	V43 V45 T108 L110 D112 S113 L133	V43-V135 HydrophobicContact CG2-CG2 4.27Å; V43-V135 WeakPolarHBondContact O-CA 3.24Å; V45-V135 HydrophobicContact CB-CG1 3.98Å; V45-V135 HydrophobicContact CG2-CG1 4.44Å; T108-V135 HydrophobicContact CG2-CG2 4.2Å; L110-V135 HydrophobicContact CD2-CG1 4.4Å; D112-V135 HydrophobicContact CB-CG2 4.21Å; S113-V135 PolarHBondContact OG-N 2.72Å; S113-V135 PolarHBondContact OG-O 2.95Å; L133-V135 HydrophobicContact CD1-CG2 4.17Å; L133-V135 HydrophobicContact CD2-CG2 4.03Å; L133-V135 HydrophobicContact CG-CG2 3.97Å
136	G	95.5	Very high	95.2	Very high	10 Å²	10	39.5 Å²	39.5	10%	0.103	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	156.9	-175	0	0	0	0	0	113.1	V43 L44 V45	V43-G136 PolarHBondContact O-N 2.92Å; L44-G136 CarbonylContact C-O 3.56Å; L44-G136 VanDerWaalsContact CA-O 3.29Å; L44-G136 WeakPolarHBondContact CA-O 3.41Å; V45-G136 PolarHBondContact N-O 2.76Å
137	E	96.2	Very high	95.2	Very high	118 Å²	118	47.9 Å²	47.9	55%	0.551	28%	0.279	S	S	*	.	P	Polyproline II helix	trans	-80.8	158	161.9	-57.6	-171.8	126.2	0	0	109.6	V45 L110 N145	V45-E137 HydrophobicContact CG1-CG 4.19Å; L110-E137 HydrophobicContact CD1-CG 4.02Å; L110-E137 HydrophobicContact CD2-CG 3.81Å; L110-E137 HydrophobicContact CG-CG 4.5Å; E137-N145 WeakPolarHBondContact O-CB 3.16Å; E137-N145 PolarHBondContact O-ND2 3.49Å
138	N	95	Very high	95.1	Very high	89 Å²	89	48.5 Å²	48.5	48%	0.476	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-69.9	148.3	169	55.5	-47.4	0	0	0	110.5	L44 L142	L44-N138 HydrophobicContact CD2-CB 4.28Å; N138-L142 PolarHBondContact ND2-O 2.89Å
139	D	95	Very high	95.1	Very high	47 Å²	47	48.6 Å²	48.6	25%	0.251	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-66.3	156.2	176.8	-66	-20.8	0	0	0	110.8	G141 L142 Y144 N145 S146	D139-G141 PolarHBondContact O-N 3.03Å; D139-G141 VanDerWaalsContact O-N 3.1Å; D139-L142 HydrophobicContact CB-CB 4.24Å; D139-L142 HydrophobicContact CB-CD1 4Å; D139-L142 HydrophobicContact CB-CG 4.48Å; D139-L142 PolarHBondContact O-N 3.15Å; D139-Y144 PolarHBondContact N-O 3.12Å; D139-N145 PolarHBondContact OD1-ND2 2.81Å; D139-S146 WeakPolarHBondContact OD2-CB 3.23Å; D139-S146 PolarHBondContact OD2-N 2.77Å; D139-S146 PolarHBondContact OD2-OG 3.27Å
140	T	92.4	Very high	95.1	Very high	148 Å²	148	51.5 Å²	51.5	91%	0.908	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	114.7	-172.5	43.6	0	0	0	0	112.7	L142	T140-L142 VanDerWaalsContact C-N 3.29Å; T140-L142 PolarHBondContact O-N 3.04Å
141	G	90.7	Very high	95.1	Very high	86 Å²	86	57.7 Å²	57.7	89%	0.887	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	4.7	-178.3	0	0	0	0	0	115.1	D139	D139-G141 PolarHBondContact O-N 3.03Å; D139-G141 VanDerWaalsContact O-N 3.1Å
142	L	95.4	Very high	95.1	Very high	57 Å²	57	59.3 Å²	59.3	30%	0.298	33%	0.328	S	S	.	.	S	Bend	trans	-112	167.4	178.1	-59.8	177.8	0	0	0	111.2	N138 D139 T140 Y144	N138-L142 PolarHBondContact ND2-O 2.89Å; D139-L142 HydrophobicContact CB-CB 4.24Å; D139-L142 HydrophobicContact CB-CD1 4Å; D139-L142 HydrophobicContact CB-CG 4.48Å; D139-L142 PolarHBondContact O-N 3.15Å; T140-L142 VanDerWaalsContact C-N 3.29Å; T140-L142 PolarHBondContact O-N 3.04Å; L142-Y144 HydrophobicContact CD1-CE2 3.89Å
143	C	95.2	Very high	95	Very high	25 Å²	25	62.7 Å²	62.7	17%	0.169	34%	0.34	C	S	.	.	S	Bend	trans	-105.4	8.4	-179.2	68.3	0	0	0	0	113	C185 T215	C143-C185 VanDerWaalsContact CA-SG 3.52Å; C143-C185 HydrophobicContact CB-CB 3.65Å; C143-C185 WeakPolarHBondContact CB-SG 3.32Å; C143-C185 PolarHBondContact N-SG 2.74Å; C143-C185 WeakPolarHBondContact SG-CA 3.44Å; C143-C185 WeakPolarHBondContact SG-CB 3.48Å; C143-C185 CovalentContact SG-SG 2.04Å; C143-C185 PolarHBondContact SG-SG 2.8Å; C143-T215 PolarHBondContact SG-OG1 3.05Å; C143-T215 VanDerWaalsContact SG-OG1 3.42Å
144	Y	95.9	Very high	95	Very high	17 Å²	17	62.9 Å²	62.9	7%	0.067	34%	0.342	C	S	.	.	S	Bend	trans	-143.2	168.4	-178.5	60.5	-104.3	0	0	0	110.1	D139 L142 K149 C185 N213 T228	D139-Y144 PolarHBondContact N-O 3.12Å; L142-Y144 HydrophobicContact CD1-CE2 3.89Å; Y144-K149 HydrophobicContact CD2-CD 3.92Å; Y144-K149 HydrophobicContact CD2-CG 4.28Å; Y144-K149 HydrophobicContact CE2-CD 3.9Å; Y144-C185 WeakPolarHBondContact CD1-SG 3.39Å; Y144-C185 VanDerWaalsContact CE1-SG 3.53Å; Y144-N213 HydrophobicContact CE1-CB 3.74Å; Y144-N213 PolarHBondContact OH-ND2 2.93Å; Y144-T228 WeakPolarHBondContact CB-OG1 3.42Å; Y144-T228 HydrophobicContact CD1-CG2 3.71Å; Y144-T228 HydrophobicContact CE1-CG2 4.27Å; Y144-T228 HydrophobicContact CG-CG2 3.91Å
145	N	96.1	Very high	95	Very high	24 Å²	24	62.5 Å²	62.5	13%	0.128	34%	0.336	C	S	.	.			trans	-105.5	129.7	167.9	-172.5	-68.4	0	0	0	109	L44 E137 D139 K147 M148	L44-N145 HydrophobicContact CD2-CB 4.2Å; E137-N145 WeakPolarHBondContact O-CB 3.16Å; E137-N145 PolarHBondContact O-ND2 3.49Å; D139-N145 PolarHBondContact OD1-ND2 2.81Å; N145-K147 PolarHBondContact O-N 3.33Å; N145-K147 VanDerWaalsContact O-N 3.15Å; N145-K147 WeakPolarHBondContact OD1-CB 3.13Å; N145-K147 PolarHBondContact OD1-N 3.21Å; N145-M148 HydrophobicContact CB-CB 4.13Å; N145-M148 HydrophobicContact CB-CG 4.03Å; N145-M148 HydrophobicContact CB-SD 4.07Å; N145-M148 CarbonylContact O-C 3.57Å; N145-M148 PolarHBondContact O-N 3.4Å
146	S	94.4	Very high	94.9	Very high	56 Å²	56	64 Å²	64	39%	0.392	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-19.7	-173.6	-63.4	0	0	0	0	113.7	D139	D139-S146 WeakPolarHBondContact OD2-CB 3.23Å; D139-S146 PolarHBondContact OD2-N 2.77Å; D139-S146 PolarHBondContact OD2-OG 3.27Å
147	K	93.7	Very high	94.8	Very high	187 Å²	187	67.2 Å²	67.2	81%	0.813	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-13.4	173.8	-58.8	175.5	-179.1	174.3	0	113	Q42 N145	Q42-K147 PolarHBondContact OE1-O 3.31Å; N145-K147 PolarHBondContact O-N 3.33Å; N145-K147 VanDerWaalsContact O-N 3.15Å; N145-K147 WeakPolarHBondContact OD1-CB 3.13Å; N145-K147 PolarHBondContact OD1-N 3.21Å
148	M	92.5	Very high	94.7	Very high	31 Å²	31	66.9 Å²	66.9	15%	0.153	36%	0.361	C	S	.	.	S	Bend	trans	-118.8	48.9	-172	-55.2	-177.5	159.2	0	0	111.7	Q42 T134 N145	Q42-M148 HydrophobicContact CB-CB 4.24Å; Q42-M148 HydrophobicContact CB-CE 4.31Å; Q42-M148 HydrophobicContact CB-CG 4.04Å; Q42-M148 HydrophobicContact CB-SD 4.28Å; T134-M148 HydrophobicContact CG2-CE 3.44Å; T134-M148 VanDerWaalsContact CG2-CE 3.44Å; T134-M148 WeakPolarHBondContact O-CE 3.49Å; N145-M148 HydrophobicContact CB-CB 4.13Å; N145-M148 HydrophobicContact CB-CG 4.03Å; N145-M148 HydrophobicContact CB-SD 4.07Å; N145-M148 CarbonylContact O-C 3.57Å; N145-M148 PolarHBondContact O-N 3.4Å
149	K	94.4	Very high	94.8	Very high	30 Å²	30	66.5 Å²	66.5	13%	0.13	37%	0.366	C	S	.	.			trans	-111.9	149.2	178.7	-61.2	-169.2	-58.8	178	0	111.4	Y144 F151 N213 T228 E230	Y144-K149 HydrophobicContact CD2-CD 3.92Å; Y144-K149 HydrophobicContact CD2-CG 4.28Å; Y144-K149 HydrophobicContact CE2-CD 3.9Å; K149-F151 HydrophobicContact CB-CZ 4.4Å; K149-F151 WeakPolarHBondContact O-CE2 3.5Å; K149-N213 WeakPolarHBondContact CD-OD1 3.07Å; K149-N213 PolarHBondContact NZ-OD1 3.13Å; K149-T228 HydrophobicContact CD-CG2 4.23Å; K149-T228 HydrophobicContact CG-CG2 4.36Å; K149-E230 VanDerWaalsContact CE-OE2 3.24Å; K149-E230 WeakPolarHBondContact CE-OE2 3.35Å; K149-E230 IonicContact NZ-OE1 3.46Å; K149-E230 PolarHBondContact NZ-OE1 3.39Å; K149-E230 IonicContact NZ-OE2 2.77Å; K149-E230 PolarHBondContact NZ-OE2 3.23Å
150	Y	96.4	Very high	94.9	Very high	61 Å²	61	66 Å²	66	24%	0.239	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	152.7	159.8	-60.7	-80.7	0	0	0	109.3	R165 D166 R227 T228 T229 E230	Y150-R165 HydrophobicContact CE1-CB 4.39Å; Y150-R165 HydrophobicContact CE2-CB 4.49Å; Y150-D166 PolarHBondContact OH-OD2 3.03Å; Y150-R227 HydrophobicContact CE2-CB 4.22Å; Y150-T228 PolarHBondContact N-O 3.17Å; Y150-T229 CarbonylContact O-C 3.6Å; Y150-T229 WeakPolarHBondContact O-CA 3.32Å; Y150-E230 PolarHBondContact O-N 3.32Å
151	F	95.9	Very high	95.1	Very high	138 Å²	138	63.6 Å²	63.6	61%	0.605	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.7	131.6	178.1	-60.7	-88.8	0	0	0	109.2	K149 E230	K149-F151 HydrophobicContact CB-CZ 4.4Å; K149-F151 WeakPolarHBondContact O-CE2 3.5Å; F151-E230 HydrophobicContact CD1-CB 4.14Å; F151-E230 HydrophobicContact CE1-CB 4.44Å; F151-E230 WeakPolarHBondContact CE1-OE2 3.46Å
152	E	96	Very high	95.4	Very high	34 Å²	34	59.6 Å²	59.6	16%	0.159	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	146.3	178	-79.5	-73	-169	0	0	110.6	K160 R165 T229 E230 L231 T232	E152-K160 WeakPolarHBondContact OE2-CE 3.45Å; E152-K160 IonicContact OE2-NZ 3.03Å; E152-K160 PolarHBondContact OE2-NZ 3.21Å; E152-R165 IonicContact OE1-CZ 2.69Å; E152-R165 IonicContact OE1-NH2 3.57Å; E152-R165 PolarHBondContact OE1-NH2 2.98Å; E152-T229 HydrophobicContact CB-CG2 3.77Å; E152-T229 HydrophobicContact CG-CG2 3.47Å; E152-T229 VanDerWaalsContact CG-CG2 3.47Å; E152-E230 PolarHBondContact N-O 3.3Å; E152-L231 HydrophobicContact CB-CD1 4.13Å; E152-T232 PolarHBondContact O-N 2.96Å; E152-T232 PolarHBondContact O-OG1 2.82Å
153	K	95	Very high	95.4	Very high	90 Å²	90	58.7 Å²	58.7	39%	0.391	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	144.6	172.5	-79.3	177.4	177.2	-176.8	0	110.9	K160 T232 D276	K153-K160 VanDerWaalsContact O-CE 3.31Å; K153-K160 WeakPolarHBondContact O-CE 3.33Å; K153-K160 PolarHBondContact O-NZ 2.99Å; K153-T232 WeakPolarHBondContact CA-O 3.39Å; K153-T232 WeakPolarHBondContact CG-OG1 3.31Å; K153-D276 IonicContact NZ-OD1 2.7Å; K153-D276 PolarHBondContact NZ-OD1 2.94Å; K153-D276 IonicContact NZ-OD2 2.77Å; K153-D276 PolarHBondContact NZ-OD2 3.34Å
154	A	96.3	Very high	95.4	Very high	7 Å²	7	57.8 Å²	57.8	6%	0.058	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	144.7	172.8	0	0	0	0	0	111.4	K160 V206 L231 T232 V233 T234	A154-K160 HydrophobicContact CB-CB 3.81Å; A154-K160 HydrophobicContact CB-CD 3.99Å; A154-K160 HydrophobicContact CB-CG 3.83Å; A154-V206 HydrophobicContact CB-CG1 4.01Å; A154-V206 HydrophobicContact CB-CG2 4.1Å; A154-L231 HydrophobicContact CB-CD1 3.89Å; A154-T232 PolarHBondContact N-O 3.22Å; A154-V233 CarbonylContact O-C 3.58Å; A154-V233 VanDerWaalsContact O-CA 3.28Å; A154-V233 WeakPolarHBondContact O-CA 3.29Å; A154-T234 PolarHBondContact O-N 3.12Å; A154-T234 PolarHBondContact O-OG1 3.4Å
155	E	95.9	Very high	95.3	Very high	50 Å²	50	61.8 Å²	61.8	23%	0.234	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	137.8	172.7	-72.3	170.6	-122.4	0	0	110.6	K158 T234 P236 L237	E155-K158 HydrophobicContact CB-CB 4.07Å; E155-K158 HydrophobicContact CB-CG 3.5Å; E155-K158 HydrophobicContact CG-CG 4.47Å; E155-K158 WeakPolarHBondContact O-CB 3.48Å; E155-K158 PolarHBondContact O-N 2.9Å; E155-K158 VanDerWaalsContact OE2-CE 3.31Å; E155-K158 WeakPolarHBondContact OE2-CE 3.45Å; E155-T234 CarbonylContact C-O 3.49Å; E155-T234 WeakPolarHBondContact CA-O 3.45Å; E155-P236 WeakPolarHBondContact OE2-CA 3.31Å; E155-L237 PolarHBondContact OE2-N 3.04Å; E155-L237 VanDerWaalsContact OE2-N 3.08Å
156	L	95.3	Very high	95.1	Very high	38 Å²	38	62.8 Å²	62.8	20%	0.199	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	146.1	169.3	-74.6	174.1	0	0	0	111.5	K158 V233 T234 L310	L156-K158 PolarHBondContact O-N 3.13Å; L156-V233 HydrophobicContact CD2-CG1 3.53Å; L156-V233 HydrophobicContact CG-CG1 3.67Å; L156-T234 WeakPolarHBondContact CG-O 3.47Å; L156-T234 PolarHBondContact N-O 3.2Å; L156-L310 HydrophobicContact CD1-CD1 3.72Å; L156-L310 HydrophobicContact CD1-CD2 4.16Å; L156-L310 HydrophobicContact CD1-CG 4.48Å
157	S	92.6	Very high	95	Very high	79 Å²	79	60.3 Å²	60.3	55%	0.552	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.3	-7.5	-176.6	75.8	0	0	0	0	116.6	V206	S157-V206 PolarHBondContact N-O 3.49Å
158	K	94.9	Very high	94.8	Very high	110 Å²	110	57.2 Å²	57.2	48%	0.478	28%	0.282	S	S	.	.	S	Bend	trans	-86.8	168.4	170.6	-54.5	-66.1	-176.8	159.3	0	110.7	E155 L156 E205 V206	E155-K158 HydrophobicContact CB-CB 4.07Å; E155-K158 HydrophobicContact CB-CG 3.5Å; E155-K158 HydrophobicContact CG-CG 4.47Å; E155-K158 WeakPolarHBondContact O-CB 3.48Å; E155-K158 PolarHBondContact O-N 2.9Å; E155-K158 VanDerWaalsContact OE2-CE 3.31Å; E155-K158 WeakPolarHBondContact OE2-CE 3.45Å; L156-K158 PolarHBondContact O-N 3.13Å; K158-E205 WeakPolarHBondContact O-CA 3.25Å; K158-V206 WeakPolarHBondContact O-CG2 3.32Å; K158-V206 PolarHBondContact O-N 3.29Å
159	S	96.6	Very high	94.7	Very high	82 Å²	82	57.8 Å²	57.8	57%	0.573	29%	0.285	S	S	*	.			trans	-87	138.7	168.4	58.9	0	0	0	0	111.3	I203 R204	S159-I203 CarbonylContact C-O 3.48Å; S159-I203 WeakPolarHBondContact CA-O 3.46Å; S159-R204 WeakPolarHBondContact CA-O 3.47Å; S159-R204 WeakPolarHBondContact CB-O 3.43Å
160	K	97.2	Very high	94.4	Very high	37 Å²	37	56.9 Å²	56.9	16%	0.161	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	130.4	171.4	-179.8	67.5	179.4	-169	0	110.8	E152 K153 A154 I162 I203 V206 L231	E152-K160 WeakPolarHBondContact OE2-CE 3.45Å; E152-K160 IonicContact OE2-NZ 3.03Å; E152-K160 PolarHBondContact OE2-NZ 3.21Å; K153-K160 VanDerWaalsContact O-CE 3.31Å; K153-K160 WeakPolarHBondContact O-CE 3.33Å; K153-K160 PolarHBondContact O-NZ 2.99Å; A154-K160 HydrophobicContact CB-CB 3.81Å; A154-K160 HydrophobicContact CB-CD 3.99Å; A154-K160 HydrophobicContact CB-CG 3.83Å; K160-I162 HydrophobicContact CG-CG1 4.3Å; K160-I203 PolarHBondContact N-O 2.88Å; K160-I203 PolarHBondContact O-N 3.48Å; K160-V206 HydrophobicContact CB-CG2 3.66Å; K160-L231 HydrophobicContact CG-CD1 4.13Å
161	E	96.9	Very high	94	Very high	97 Å²	97	56.5 Å²	56.5	45%	0.453	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	136	165	-169.9	168.6	69.2	0	0	110	T200 L201 L202	E161-T200 HydrophobicContact CG-CG2 4.09Å; E161-T200 WeakPolarHBondContact OE2-CB 3.4Å; E161-T200 PolarHBondContact OE2-OG1 2.94Å; E161-L201 CarbonylContact C-O 3.56Å; E161-L201 WeakPolarHBondContact CA-O 3.23Å; E161-L202 HydrophobicContact CB-CD1 4.18Å
162	I	97.1	Very high	93.2	Very high	1 Å²	1	54.6 Å²	54.6	1%	0.005	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	117.8	171.8	-54.1	176.3	0	0	0	106.8	K160 W181 T200 L201 I203 Y214 T229 L231	K160-I162 HydrophobicContact CG-CG1 4.3Å; I162-W181 HydrophobicContact CG2-CH2 4.04Å; I162-W181 HydrophobicContact CG2-CZ3 4.1Å; I162-T200 WeakPolarHBondContact O-CA 3.44Å; I162-L201 HydrophobicContact CB-CB 4.49Å; I162-L201 PolarHBondContact N-O 2.92Å; I162-L201 PolarHBondContact O-N 2.93Å; I162-I203 HydrophobicContact CD1-CD1 4.48Å; I162-Y214 HydrophobicContact CD1-CD1 4.12Å; I162-Y214 HydrophobicContact CD1-CD2 3.9Å; I162-Y214 HydrophobicContact CD1-CE1 4.34Å; I162-Y214 HydrophobicContact CD1-CE2 4.16Å; I162-Y214 HydrophobicContact CD1-CG 3.89Å; I162-T229 HydrophobicContact CG2-CG2 4.16Å; I162-L231 HydrophobicContact CD1-CD1 4.41Å; I162-L231 HydrophobicContact CD1-CD2 4.3Å
163	S	95.6	Very high	92.4	Very high	38 Å²	38	59 Å²	59	27%	0.266	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	144.5	176.7	54.3	0	0	0	0	111.9	R165	S163-R165 PolarHBondContact O-N 2.98Å; S163-R165 VanDerWaalsContact O-N 3.12Å
164	C	94.9	Very high	91.7	Very high	6 Å²	6	61.2 Å²	61.2	4%	0.041	33%	0.331	C	S	.	.			trans	-79.4	88.3	170.4	-166.2	0	0	0	0	108.8	I167 W181 D199 C216	C164-I167 HydrophobicContact CB-CD1 4.01Å; C164-I167 WeakPolarHBondContact O-CD1 3.14Å; C164-I167 VanDerWaalsContact O-CG1 3.31Å; C164-I167 WeakPolarHBondContact O-CG1 3.39Å; C164-W181 HydrophobicContact CB-CH2 4.23Å; C164-W181 HydrophobicContact CB-CZ2 4.07Å; C164-D199 WeakPolarHBondContact CB-O 3.29Å; C164-D199 PolarHBondContact N-O 2.83Å; C164-C216 VanDerWaalsContact CA-SG 3.58Å; C164-C216 HydrophobicContact CB-CB 3.81Å; C164-C216 WeakPolarHBondContact CB-SG 3.37Å; C164-C216 WeakPolarHBondContact SG-CB 3.47Å; C164-C216 CovalentContact SG-SG 2.04Å; C164-C216 PolarHBondContact SG-SG 3.29Å
165	R	94	Very high	91	Very high	101 Å²	101	68.7 Å²	68.7	38%	0.381	36%	0.358	S	S	.	.			trans	-73.2	155.4	-171	-60.1	-179.3	179.7	-158.4	3.1	113.8	Y150 E152 S163 R227	Y150-R165 HydrophobicContact CE1-CB 4.39Å; Y150-R165 HydrophobicContact CE2-CB 4.49Å; E152-R165 IonicContact OE1-CZ 2.69Å; E152-R165 IonicContact OE1-NH2 3.57Å; E152-R165 PolarHBondContact OE1-NH2 2.98Å; S163-R165 PolarHBondContact O-N 2.98Å; S163-R165 VanDerWaalsContact O-N 3.12Å; R165-R227 WeakPolarHBondContact O-CG 3.24Å
166	D	92.3	Very high	90.1	Very high	46 Å²	46	73.9 Å²	73.9	25%	0.246	38%	0.382	C	S	.	.	S	Bend	trans	57.1	50.5	174	-67.9	-82.8	0	0	0	113	K39 Y150 E168	K39-D166 VanDerWaalsContact CE-OD1 3.28Å; K39-D166 WeakPolarHBondContact CE-OD1 3.48Å; K39-D166 IonicContact NZ-OD1 2.81Å; K39-D166 PolarHBondContact NZ-OD1 3.4Å; Y150-D166 PolarHBondContact OH-OD2 3.03Å; D166-E168 VanDerWaalsContact CA-OE2 3.3Å; D166-E168 WeakPolarHBondContact CA-OE2 3.41Å
167	I	92.6	Very high	89.4	Confident	3 Å²	3	73.2 Å²	73.2	2%	0.015	38%	0.38	C	S	.	.			trans	-125.6	2.3	175.9	69.2	173.9	0	0	0	113.7	C164 D169 F170 L171 I179 D199 L218 R227	C164-I167 HydrophobicContact CB-CD1 4.01Å; C164-I167 WeakPolarHBondContact O-CD1 3.14Å; C164-I167 VanDerWaalsContact O-CG1 3.31Å; C164-I167 WeakPolarHBondContact O-CG1 3.39Å; I167-D169 VanDerWaalsContact C-N 3.26Å; I167-D169 PolarHBondContact O-N 3.19Å; I167-F170 HydrophobicContact CB-CD2 4.11Å; I167-F170 HydrophobicContact CG2-CD2 4.49Å; I167-F170 WeakPolarHBondContact O-CA 3.49Å; I167-F170 WeakPolarHBondContact O-CB 3.19Å; I167-F170 PolarHBondContact O-N 3.37Å; I167-L171 HydrophobicContact CD1-CD1 4.15Å; I167-L171 HydrophobicContact CD1-CD2 4.03Å; I167-L171 HydrophobicContact CD1-CG 4.23Å; I167-L171 HydrophobicContact CG1-CD1 4.05Å; I167-L171 HydrophobicContact CG1-CD2 4.44Å; I167-L171 HydrophobicContact CG1-CG 4.12Å; I167-L171 PolarHBondContact O-N 3.3Å; I167-I179 HydrophobicContact CD1-CD1 3.85Å; I167-D199 HydrophobicContact CD1-CB 4.03Å; I167-L218 HydrophobicContact CB-CD2 4.2Å; I167-L218 HydrophobicContact CD1-CD2 4.46Å; I167-R227 HydrophobicContact CG2-CG 4.28Å
168	E	88.8	Confident	89.1	Confident	123 Å²	123	76 Å²	76	58%	0.575	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-60.6	-35.5	-169.7	-57.4	86.4	164	0	0	112.3	D166 F170 L171	D166-E168 VanDerWaalsContact CA-OE2 3.3Å; D166-E168 WeakPolarHBondContact CA-OE2 3.41Å; E168-F170 PolarHBondContact O-N 3.29Å; E168-L171 PolarHBondContact O-N 3.27Å
169	D	89.2	Confident	89	Confident	42 Å²	42	71.9 Å²	71.9	23%	0.225	37%	0.368	C	S	.	.	G	3₁₀ helix	trans	-70.4	-6.9	175.7	-67.4	-63.9	0	0	0	113.6	R50 K52 W104 I167	R50-D169 VanDerWaalsContact CD-OD1 3.29Å; R50-D169 WeakPolarHBondContact CD-OD1 3.27Å; R50-D169 IonicContact CZ-OD1 2.68Å; R50-D169 IonicContact NE-OD1 3.2Å; R50-D169 IonicContact NH1-OD1 2.66Å; R50-D169 PolarHBondContact NH1-OD1 3.28Å; K52-D169 WeakPolarHBondContact CE-OD1 3.27Å; K52-D169 IonicContact NZ-OD1 2.68Å; K52-D169 PolarHBondContact NZ-OD1 3.07Å; K52-D169 IonicContact NZ-OD2 2.88Å; K52-D169 PolarHBondContact NZ-OD2 3.36Å; W104-D169 HydrophobicContact CH2-CB 4Å; I167-D169 VanDerWaalsContact C-N 3.26Å; I167-D169 PolarHBondContact O-N 3.19Å
170	F	89.4	Confident	88.9	Confident	12 Å²	12	72.1 Å²	72.1	5%	0.053	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-110.8	-7.6	178.2	-45.1	-51.9	0	0	0	113.4	P48 W104 I167 E168 L218 Y220 V225	P48-F170 HydrophobicContact CB-CE1 4.11Å; P48-F170 HydrophobicContact CG-CE1 3.87Å; P48-F170 HydrophobicContact CG-CZ 4.2Å; P48-F170 WeakPolarHBondContact O-CZ 3.43Å; W104-F170 HydrophobicContact CZ3-CE1 4.11Å; I167-F170 HydrophobicContact CB-CD2 4.11Å; I167-F170 HydrophobicContact CG2-CD2 4.49Å; I167-F170 WeakPolarHBondContact O-CA 3.49Å; I167-F170 WeakPolarHBondContact O-CB 3.19Å; I167-F170 PolarHBondContact O-N 3.37Å; E168-F170 PolarHBondContact O-N 3.29Å; F170-L218 HydrophobicContact CB-CD2 3.75Å; F170-L218 HydrophobicContact CD2-CD2 4.42Å; F170-Y220 HydrophobicContact CB-CD1 4.48Å; F170-Y220 HydrophobicContact CB-CD2 3.84Å; F170-Y220 HydrophobicContact CB-CE2 4.38Å; F170-Y220 HydrophobicContact CB-CG 3.9Å; F170-Y220 AromaticContact CD1-CD1 3.77Å; F170-Y220 HydrophobicContact CD1-CD1 3.77Å; F170-Y220 HydrophobicContact CD1-CE1 4.02Å; F170-Y220 HydrophobicContact CD1-CG 4.06Å; F170-Y220 HydrophobicContact CG-CD1 4.46Å; F170-Y220 HydrophobicContact CG-CG 4.3Å; F170-Y220 VanDerWaalsContact O-CD2 3.29Å; F170-Y220 WeakPolarHBondContact O-CD2 3.38Å; F170-V225 HydrophobicContact CD2-CG1 4.14Å; F170-V225 HydrophobicContact CD2-CG2 4.06Å; F170-V225 HydrophobicContact CE2-CB 4.48Å; F170-V225 HydrophobicContact CE2-CG1 3.84Å; F170-V225 HydrophobicContact CE2-CG2 3.92Å; F170-V225 HydrophobicContact CZ-CG2 4.22Å
171	L	86.7	Confident	88.8	Confident	52 Å²	52	71.2 Å²	71.2	27%	0.272	36%	0.358	S	S	.	.			trans	-88.2	125.5	-179.2	-67.1	-178.1	0	0	0	111.3	I167 E168 P177	I167-L171 HydrophobicContact CD1-CD1 4.15Å; I167-L171 HydrophobicContact CD1-CD2 4.03Å; I167-L171 HydrophobicContact CD1-CG 4.23Å; I167-L171 HydrophobicContact CG1-CD1 4.05Å; I167-L171 HydrophobicContact CG1-CD2 4.44Å; I167-L171 HydrophobicContact CG1-CG 4.12Å; I167-L171 PolarHBondContact O-N 3.3Å; E168-L171 PolarHBondContact O-N 3.27Å; L171-P177 HydrophobicContact CD2-CB 3.56Å; L171-P177 HydrophobicContact CD2-CG 3.66Å
172	L	81	Confident	88.8	Confident	99 Å²	99	68.7 Å²	68.7	52%	0.518	34%	0.344	S	S	.	.			trans	-91.4	127.7	169.3	-71	97	0	0	0	110	T174 R175 Y220	L172-T174 PolarHBondContact O-N 3.12Å; L172-R175 HydrophobicContact CB-CB 4.44Å; L172-R175 PolarHBondContact O-N 3Å; L172-Y220 HydrophobicContact CD1-CE2 4.37Å
173	P	77.8	Confident	88.8	Confident	127 Å²	127	69.6 Å²	69.6	83%	0.825	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-26	-178.9	-26.5	34.6	0	0	0	114.7
174	T	80.3	Confident	88.7	Confident	135 Å²	135	71.1 Å²	71.1	83%	0.828	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-8.7	-174.8	50.7	0	0	0	0	114.5	L172	L172-T174 PolarHBondContact O-N 3.12Å
175	R	81.8	Confident	88.8	Confident	165 Å²	165	72.2 Å²	72.2	62%	0.623	36%	0.359	S	S	*	.	S	Bend	trans	-131.3	129.9	-176.2	-175.1	174.7	177.3	163.2	-0.2	110.1	L172 E178	L172-R175 HydrophobicContact CB-CB 4.44Å; L172-R175 PolarHBondContact O-N 3Å; R175-E178 IonicContact CZ-OE1 3.52Å; R175-E178 IonicContact NH2-OE1 3.69Å; R175-E178 PolarHBondContact NH2-OE1 3.04Å
176	E	78.1	Confident	88.9	Confident	158 Å²	158	76.7 Å²	76.7	74%	0.738	38%	0.375	S	S	*	.			trans	-66.5	132.1	171.9	-65	-167.8	148.6	0	0	110	E178	E176-E178 PolarHBondContact O-N 2.87Å
177	P	80.6	Confident	89	Confident	24 Å²	24	80.1 Å²	80.1	16%	0.156	40%	0.398	C	S	.	.			trans	-75.1	125.8	-179.6	33.1	-36.5	0	0	0	109.9	L171 I179 R198 L218	L171-P177 HydrophobicContact CD2-CB 3.56Å; L171-P177 HydrophobicContact CD2-CG 3.66Å; P177-I179 VanDerWaalsContact C-N 3.25Å; P177-I179 HydrophobicContact CB-CD1 3.97Å; P177-I179 HydrophobicContact CB-CG1 4.01Å; P177-I179 HydrophobicContact CG-CD1 3.87Å; P177-I179 HydrophobicContact CG-CG1 4.33Å; P177-I179 PolarHBondContact O-N 3.02Å; P177-R198 HydrophobicContact CG-CG 3.86Å; P177-L218 HydrophobicContact CB-CD1 3.86Å
178	E	85	Confident	88.9	Confident	139 Å²	139	85.7 Å²	85.7	65%	0.65	42%	0.422	S	S	*	.			trans	-76.9	76.3	174.6	-69.3	166.5	-133	0	0	109.6	R175 E176	R175-E178 IonicContact CZ-OE1 3.52Å; R175-E178 IonicContact NH2-OE1 3.69Å; R175-E178 PolarHBondContact NH2-OE1 3.04Å; E176-E178 PolarHBondContact O-N 2.87Å
179	I	92.4	Very high	89.2	Confident	23 Å²	23	86.6 Å²	86.6	12%	0.118	44%	0.436	C	S	.	.			trans	-88.9	123.8	-179.8	-66.2	167.7	0	0	0	110.2	I167 P177 D199 C216 E217 L218	I167-I179 HydrophobicContact CD1-CD1 3.85Å; P177-I179 VanDerWaalsContact C-N 3.25Å; P177-I179 HydrophobicContact CB-CD1 3.97Å; P177-I179 HydrophobicContact CB-CG1 4.01Å; P177-I179 HydrophobicContact CG-CD1 3.87Å; P177-I179 HydrophobicContact CG-CG1 4.33Å; P177-I179 PolarHBondContact O-N 3.02Å; I179-D199 HydrophobicContact CD1-CB 4.06Å; I179-C216 HydrophobicContact CG2-CB 3.74Å; I179-E217 WeakPolarHBondContact CA-O 3.39Å; I179-L218 HydrophobicContact CG1-CB 4.3Å; I179-L218 HydrophobicContact CG1-CD1 3.87Å
180	L	94.4	Very high	89.4	Confident	87 Å²	87	87.5 Å²	87.5	46%	0.455	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	133	174.6	-62	178.3	0	0	0	110.3	Y182 C216 E217	L180-Y182 HydrophobicContact CB-CE2 3.75Å; L180-C216 CarbonylContact O-C 3.58Å; L180-C216 WeakPolarHBondContact O-CA 3.19Å; L180-E217 HydrophobicContact CB-CB 4.47Å; L180-E217 PolarHBondContact N-O 2.82Å; L180-E217 PolarHBondContact O-N 2.86Å
181	W	96.1	Very high	89.7	Confident	18 Å²	18	89.8 Å²	89.8	7%	0.068	45%	0.445	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	136.5	177.8	-71.6	89.1	0	0	0	111.8	I162 C164 W190 F196 L201 T215 C216	I162-W181 HydrophobicContact CG2-CH2 4.04Å; I162-W181 HydrophobicContact CG2-CZ3 4.1Å; C164-W181 HydrophobicContact CB-CH2 4.23Å; C164-W181 HydrophobicContact CB-CZ2 4.07Å; W181-W190 HydrophobicContact CB-CZ2 3.87Å; W181-W190 WeakPolarHBondContact O-CZ2 3.24Å; W181-F196 HydrophobicContact CB-CE1 3.77Å; W181-F196 AromaticContact CD1-CD1 3.46Å; W181-F196 VanDerWaalsContact CD1-CD1 3.46Å; W181-F196 AromaticContact CD1-CE1 3.59Å; W181-F196 HydrophobicContact CG-CD1 4.05Å; W181-F196 AromaticContact CG-CE1 3.71Å; W181-F196 HydrophobicContact CG-CE1 3.71Å; W181-F196 AromaticContact NE1-CD1 3.92Å; W181-L201 HydrophobicContact CB-CD1 4.33Å; W181-L201 HydrophobicContact CD2-CB 4.12Å; W181-L201 HydrophobicContact CD2-CD1 3.8Å; W181-L201 HydrophobicContact CE3-CB 4.36Å; W181-L201 HydrophobicContact CE3-CD1 3.72Å; W181-L201 HydrophobicContact CG-CD1 4.1Å; W181-L201 HydrophobicContact CH2-CB 4.16Å; W181-L201 HydrophobicContact CZ2-CB 3.91Å; W181-L201 HydrophobicContact CZ3-CB 4.38Å; W181-L201 HydrophobicContact CZ3-CD1 4.28Å; W181-T215 CarbonylContact C-O 3.6Å; W181-T215 WeakPolarHBondContact CA-O 3.31Å; W181-C216 HydrophobicContact CD2-CB 3.92Å; W181-C216 HydrophobicContact CE3-CB 3.87Å; W181-C216 HydrophobicContact CH2-CB 3.88Å; W181-C216 HydrophobicContact CZ2-CB 3.9Å; W181-C216 HydrophobicContact CZ3-CB 3.85Å
182	Y	96.6	Very high	90	Very high	43 Å²	43	93.3 Å²	93.3	17%	0.169	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	150.4	179.8	-56.2	-101.6	0	0	0	109.9	L180 R186 T187 Y214 T215 E217	L180-Y182 HydrophobicContact CB-CE2 3.75Å; Y182-R186 WeakPolarHBondContact CA-O 3.38Å; Y182-T187 HydrophobicContact CD1-CG2 3.9Å; Y182-T187 HydrophobicContact CE1-CG2 3.6Å; Y182-Y214 WeakPolarHBondContact O-CA 3.25Å; Y182-T215 PolarHBondContact N-O 3.15Å; Y182-T215 PolarHBondContact O-N 3.1Å; Y182-E217 HydrophobicContact CD2-CB 4.47Å; Y182-E217 HydrophobicContact CE2-CB 3.75Å
183	K	96.3	Very high	90.6	Very high	20 Å²	20	90.1 Å²	90.1	9%	0.087	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	127.1	171.7	-174.8	60.6	166.8	63.8	0	108.4	C185 R186 K188 W190 D210 I211 Y214	K183-C185 PolarHBondContact O-N 3.4Å; K183-R186 PolarHBondContact N-O 2.91Å; K183-R186 PolarHBondContact O-N 3.17Å; K183-R186 VanDerWaalsContact O-N 3.08Å; K183-K188 HydrophobicContact CB-CD 4.36Å; K183-W190 HydrophobicContact CB-CH2 3.9Å; K183-W190 HydrophobicContact CB-CZ3 4.45Å; K183-D210 VanDerWaalsContact CE-O 3.26Å; K183-D210 WeakPolarHBondContact CE-O 3.41Å; K183-I211 PolarHBondContact NZ-O 3.15Å; K183-Y214 HydrophobicContact CD-CD1 4.2Å; K183-Y214 HydrophobicContact CD-CD2 3.95Å; K183-Y214 HydrophobicContact CD-CE1 4.06Å; K183-Y214 HydrophobicContact CD-CE2 3.76Å; K183-Y214 HydrophobicContact CD-CG 4.15Å
184	E	95.1	Very high	91.5	Very high	71 Å²	71	84.7 Å²	84.7	33%	0.332	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.5	43.4	-169.6	-49.1	-42.1	134.6	0	0	112.9	R186 G212 N213	E184-R186 PolarHBondContact O-N 3.02Å; E184-G212 WeakPolarHBondContact OE1-CA 3.34Å; E184-N213 PolarHBondContact N-O 2.78Å; E184-N213 PolarHBondContact OE1-N 3.47Å; E184-N213 PolarHBondContact OE2-ND2 3.07Å
185	C	95.8	Very high	92.2	Very high	29 Å²	29	80.5 Å²	80.5	20%	0.196	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.7	19.1	-178.5	-62.4	0	0	0	0	116.1	C143 Y144 K183	C143-C185 VanDerWaalsContact CA-SG 3.52Å; C143-C185 HydrophobicContact CB-CB 3.65Å; C143-C185 WeakPolarHBondContact CB-SG 3.32Å; C143-C185 PolarHBondContact N-SG 2.74Å; C143-C185 WeakPolarHBondContact SG-CA 3.44Å; C143-C185 WeakPolarHBondContact SG-CB 3.48Å; C143-C185 CovalentContact SG-SG 2.04Å; C143-C185 PolarHBondContact SG-SG 2.8Å; Y144-C185 WeakPolarHBondContact CD1-SG 3.39Å; Y144-C185 VanDerWaalsContact CE1-SG 3.53Å; K183-C185 PolarHBondContact O-N 3.4Å
186	R	96.3	Very high	92.7	Very high	195 Å²	195	76.8 Å²	76.8	74%	0.736	38%	0.383	S	S	*	.	B	Isolated β-bridge	trans	-119	148.2	175.5	-63.8	179.6	-173.5	-159.1	0.7	110.4	Y182 K183 E184	Y182-R186 WeakPolarHBondContact CA-O 3.38Å; K183-R186 PolarHBondContact N-O 2.91Å; K183-R186 PolarHBondContact O-N 3.17Å; K183-R186 VanDerWaalsContact O-N 3.08Å; E184-R186 PolarHBondContact O-N 3.02Å
187	T	94.4	Very high	93.1	Very high	118 Å²	118	76.5 Å²	76.5	72%	0.724	38%	0.38	S	S	*	.			trans	-67.1	135.5	165.7	48.6	0	0	0	0	108.6	Y182	Y182-T187 HydrophobicContact CD1-CG2 3.9Å; Y182-T187 HydrophobicContact CE1-CG2 3.6Å
188	K	91.9	Very high	93.5	Very high	120 Å²	120	83 Å²	83	52%	0.522	40%	0.401	S	S	.	.			trans	-132.1	141.6	-179	-167.9	175.6	-173.4	178.8	0	108.9	K183 W190	K183-K188 HydrophobicContact CB-CD 4.36Å; K188-W190 VanDerWaalsContact O-CD1 3.27Å; K188-W190 PolarHBondContact O-N 3.15Å; K188-W190 VanDerWaalsContact O-N 3.09Å; K188-W190 PolarHBondContact O-NE1 2.89Å
189	T	93.8	Very high	93.8	Very high	142 Å²	142	78.5 Å²	78.5	87%	0.871	38%	0.381	S	S	*	.			trans	-68.9	106.5	167.8	-52.2	0	0	0	0	108.3
190	W	94.6	Very high	93.9	Very high	60 Å²	60	78 Å²	78	23%	0.227	38%	0.38	C	S	.	.			trans	-72.4	141.5	-178.9	-60.4	105	0	0	0	111.3	W181 K183 K188 I194 F196 L201 Y214	W181-W190 HydrophobicContact CB-CZ2 3.87Å; W181-W190 WeakPolarHBondContact O-CZ2 3.24Å; K183-W190 HydrophobicContact CB-CH2 3.9Å; K183-W190 HydrophobicContact CB-CZ3 4.45Å; K188-W190 VanDerWaalsContact O-CD1 3.27Å; K188-W190 PolarHBondContact O-N 3.15Å; K188-W190 VanDerWaalsContact O-N 3.09Å; K188-W190 PolarHBondContact O-NE1 2.89Å; W190-I194 HydrophobicContact CE3-CD1 3.71Å; W190-I194 HydrophobicContact CE3-CG2 4.42Å; W190-I194 HydrophobicContact CZ3-CD1 4.14Å; W190-F196 HydrophobicContact CB-CE2 3.97Å; W190-F196 HydrophobicContact CB-CZ 4.14Å; W190-F196 AromaticContact CD1-CE2 3.84Å; W190-F196 AromaticContact CD1-CZ 3.58Å; W190-F196 HydrophobicContact CD2-CE2 4.38Å; W190-F196 AromaticContact CD2-CZ 3.65Å; W190-F196 HydrophobicContact CD2-CZ 3.65Å; W190-F196 AromaticContact CE2-CZ 3.76Å; W190-F196 HydrophobicContact CE3-CZ 4.31Å; W190-F196 AromaticContact CG-CE2 3.81Å; W190-F196 HydrophobicContact CG-CE2 3.81Å; W190-F196 AromaticContact CG-CZ 3.54Å; W190-F196 HydrophobicContact CG-CZ 3.54Å; W190-F196 HydrophobicContact CZ2-CZ 4.47Å; W190-F196 AromaticContact NE1-CZ 3.71Å; W190-L201 HydrophobicContact CH2-CD1 4.2Å; W190-L201 HydrophobicContact CZ3-CD1 4.42Å; W190-Y214 AromaticContact CH2-CD1 3.92Å; W190-Y214 HydrophobicContact CH2-CD1 3.92Å; W190-Y214 AromaticContact CH2-CE1 3.87Å; W190-Y214 HydrophobicContact CH2-CE1 3.87Å; W190-Y214 HydrophobicContact CZ3-CD1 4.28Å; W190-Y214 AromaticContact CZ3-CE1 3.76Å; W190-Y214 HydrophobicContact CZ3-CE1 3.76Å
191	R	94.8	Very high	94	Very high	61 Å²	61	73.9 Å²	73.9	23%	0.23	36%	0.358	C	S	.	.			trans	-74.7	149.6	176.4	65.4	177.3	-173.4	-95.4	6.2	110.9	S193 I194 I203 E205 D210	R191-S193 VanDerWaalsContact CD-OG 3.27Å; R191-S193 WeakPolarHBondContact CD-OG 3.21Å; R191-S193 PolarHBondContact NE-OG 3.08Å; R191-S193 PolarHBondContact O-N 2.94Å; R191-I194 HydrophobicContact CG-CD1 4.01Å; R191-I194 HydrophobicContact CG-CG1 3.97Å; R191-I194 PolarHBondContact O-N 3.5Å; R191-I203 VanDerWaalsContact NH2-CG2 3.33Å; R191-E205 PolarHBondContact NH2-O 3.36Å; R191-D210 IonicContact CZ-OD1 3.99Å; R191-D210 IonicContact CZ-OD2 3.58Å; R191-D210 IonicContact NH1-OD1 3.55Å; R191-D210 PolarHBondContact NH1-OD1 3.3Å; R191-D210 IonicContact NH1-OD2 3.81Å; R191-D210 VanDerWaalsContact NH2-CG 3.35Å; R191-D210 IonicContact NH2-OD1 3.47Å; R191-D210 PolarHBondContact NH2-OD1 3.24Å; R191-D210 IonicContact NH2-OD2 2.78Å; R191-D210 PolarHBondContact NH2-OD2 2.95Å
192	P	93.7	Very high	94	Very high	126 Å²	126	75.7 Å²	75.7	82%	0.818	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-14.2	-177.7	-25.5	35.1	0	0	0	116.3	I194	P192-I194 VanDerWaalsContact C-N 3.29Å
193	S	93.5	Very high	94	Very high	31 Å²	31	73.6 Å²	73.6	22%	0.217	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-1.1	173.4	53.8	0	0	0	0	114.2	R191 R204	R191-S193 VanDerWaalsContact CD-OG 3.27Å; R191-S193 WeakPolarHBondContact CD-OG 3.21Å; R191-S193 PolarHBondContact NE-OG 3.08Å; R191-S193 PolarHBondContact O-N 2.94Å; S193-R204 WeakPolarHBondContact O-CB 3.14Å; S193-R204 WeakPolarHBondContact O-CG 3.16Å; S193-R204 PolarHBondContact O-N 3.37Å
194	I	95.3	Very high	94	Very high	13 Å²	13	80.1 Å²	80.1	7%	0.067	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	122.5	167	-63.7	174.8	0	0	0	108	W190 R191 P192 F196 L201 L202 I203	W190-I194 HydrophobicContact CE3-CD1 3.71Å; W190-I194 HydrophobicContact CE3-CG2 4.42Å; W190-I194 HydrophobicContact CZ3-CD1 4.14Å; R191-I194 HydrophobicContact CG-CD1 4.01Å; R191-I194 HydrophobicContact CG-CG1 3.97Å; R191-I194 PolarHBondContact O-N 3.5Å; P192-I194 VanDerWaalsContact C-N 3.29Å; I194-F196 HydrophobicContact CG2-CE1 4.3Å; I194-F196 HydrophobicContact CG2-CE2 4.03Å; I194-F196 HydrophobicContact CG2-CZ 3.77Å; I194-L201 HydrophobicContact CG2-CD2 3.65Å; I194-L201 HydrophobicContact CG2-CG 3.85Å; I194-L202 CarbonylContact C-O 3.56Å; I194-L202 WeakPolarHBondContact CA-O 3.42Å; I194-I203 HydrophobicContact CG1-CG1 4.29Å; I194-I203 HydrophobicContact CG1-CG2 4.42Å
195	V	94.8	Very high	94	Very high	48 Å²	48	80.8 Å²	80.8	29%	0.291	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	128.9	-178.1	-177.9	0	0	0	0	109.2	L202	V195-L202 HydrophobicContact CB-CB 4.4Å; V195-L202 PolarHBondContact N-O 3.32Å; V195-L202 PolarHBondContact O-N 3.38Å
196	F	92.9	Very high	94.1	Very high	86 Å²	86	79.6 Å²	79.6	38%	0.377	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	132.7	173.5	-59	-80.8	0	0	0	109.6	W181 W190 I194 L201	W181-F196 HydrophobicContact CB-CE1 3.77Å; W181-F196 AromaticContact CD1-CD1 3.46Å; W181-F196 VanDerWaalsContact CD1-CD1 3.46Å; W181-F196 AromaticContact CD1-CE1 3.59Å; W181-F196 HydrophobicContact CG-CD1 4.05Å; W181-F196 AromaticContact CG-CE1 3.71Å; W181-F196 HydrophobicContact CG-CE1 3.71Å; W181-F196 AromaticContact NE1-CD1 3.92Å; W190-F196 HydrophobicContact CB-CE2 3.97Å; W190-F196 HydrophobicContact CB-CZ 4.14Å; W190-F196 AromaticContact CD1-CE2 3.84Å; W190-F196 AromaticContact CD1-CZ 3.58Å; W190-F196 HydrophobicContact CD2-CE2 4.38Å; W190-F196 AromaticContact CD2-CZ 3.65Å; W190-F196 HydrophobicContact CD2-CZ 3.65Å; W190-F196 AromaticContact CE2-CZ 3.76Å; W190-F196 HydrophobicContact CE3-CZ 4.31Å; W190-F196 AromaticContact CG-CE2 3.81Å; W190-F196 HydrophobicContact CG-CE2 3.81Å; W190-F196 AromaticContact CG-CZ 3.54Å; W190-F196 HydrophobicContact CG-CZ 3.54Å; W190-F196 HydrophobicContact CZ2-CZ 4.47Å; W190-F196 AromaticContact NE1-CZ 3.71Å; I194-F196 HydrophobicContact CG2-CE1 4.3Å; I194-F196 HydrophobicContact CG2-CE2 4.03Å; I194-F196 HydrophobicContact CG2-CZ 3.77Å; F196-L201 HydrophobicContact CD1-CB 4.32Å; F196-L201 HydrophobicContact CD1-CG 4.19Å; F196-L201 HydrophobicContact CE1-CB 4.26Å; F196-L201 HydrophobicContact CE1-CD1 3.72Å; F196-L201 HydrophobicContact CE1-CG 3.69Å; F196-L201 HydrophobicContact CZ-CD1 4.41Å; F196-L201 HydrophobicContact CZ-CG 4.42Å
197	K	87.5	Confident	94.1	Very high	152 Å²	152	75.5 Å²	75.5	66%	0.661	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.3	105.5	-179.4	-176.3	-172.7	176.1	-169	0	109.8	D199 T200	K197-D199 PolarHBondContact O-N 2.96Å; K197-T200 PolarHBondContact N-O 3.31Å; K197-T200 PolarHBondContact O-N 3.42Å; K197-T200 PolarHBondContact O-OG1 3.44Å
198	R	88.4	Confident	94.1	Very high	160 Å²	160	74.8 Å²	74.8	60%	0.604	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	-97.1	-176.9	-176.1	-171.1	-95.1	174.3	-9.1	111.3	P177	P177-R198 HydrophobicContact CG-CG 3.86Å
199	D	91.8	Very high	94.3	Very high	45 Å²	45	75.2 Å²	75.2	24%	0.241	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108	0.4	-174.9	57.2	-58.8	0	0	0	113.7	C164 I167 I179 K197	C164-D199 WeakPolarHBondContact CB-O 3.29Å; C164-D199 PolarHBondContact N-O 2.83Å; I167-D199 HydrophobicContact CD1-CB 4.03Å; I179-D199 HydrophobicContact CD1-CB 4.06Å; K197-D199 PolarHBondContact O-N 2.96Å
200	T	94.4	Very high	94.4	Very high	14 Å²	14	68.7 Å²	68.7	9%	0.086	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	148.2	-179.6	78.8	0	0	0	0	114.1	E161 I162 K197	E161-T200 HydrophobicContact CG-CG2 4.09Å; E161-T200 WeakPolarHBondContact OE2-CB 3.4Å; E161-T200 PolarHBondContact OE2-OG1 2.94Å; I162-T200 WeakPolarHBondContact O-CA 3.44Å; K197-T200 PolarHBondContact N-O 3.31Å; K197-T200 PolarHBondContact O-N 3.42Å; K197-T200 PolarHBondContact O-OG1 3.44Å
201	L	95.2	Very high	94.5	Very high	0 Å²	0	69.3 Å²	69.3	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	111.5	170.4	-177.8	171	0	0	0	107.5	E161 I162 W181 W190 I194 F196 I203 Y214	E161-L201 CarbonylContact C-O 3.56Å; E161-L201 WeakPolarHBondContact CA-O 3.23Å; I162-L201 HydrophobicContact CB-CB 4.49Å; I162-L201 PolarHBondContact N-O 2.92Å; I162-L201 PolarHBondContact O-N 2.93Å; W181-L201 HydrophobicContact CB-CD1 4.33Å; W181-L201 HydrophobicContact CD2-CB 4.12Å; W181-L201 HydrophobicContact CD2-CD1 3.8Å; W181-L201 HydrophobicContact CE3-CB 4.36Å; W181-L201 HydrophobicContact CE3-CD1 3.72Å; W181-L201 HydrophobicContact CG-CD1 4.1Å; W181-L201 HydrophobicContact CH2-CB 4.16Å; W181-L201 HydrophobicContact CZ2-CB 3.91Å; W181-L201 HydrophobicContact CZ3-CB 4.38Å; W181-L201 HydrophobicContact CZ3-CD1 4.28Å; W190-L201 HydrophobicContact CH2-CD1 4.2Å; W190-L201 HydrophobicContact CZ3-CD1 4.42Å; I194-L201 HydrophobicContact CG2-CD2 3.65Å; I194-L201 HydrophobicContact CG2-CG 3.85Å; F196-L201 HydrophobicContact CD1-CB 4.32Å; F196-L201 HydrophobicContact CD1-CG 4.19Å; F196-L201 HydrophobicContact CE1-CB 4.26Å; F196-L201 HydrophobicContact CE1-CD1 3.72Å; F196-L201 HydrophobicContact CE1-CG 3.69Å; F196-L201 HydrophobicContact CZ-CD1 4.41Å; F196-L201 HydrophobicContact CZ-CG 4.42Å; L201-I203 HydrophobicContact CD2-CD1 4.21Å; L201-I203 HydrophobicContact CD2-CG1 3.5Å; L201-I203 VanDerWaalsContact CD2-CG1 3.5Å; L201-Y214 HydrophobicContact CD1-CD1 3.66Å; L201-Y214 HydrophobicContact CD1-CE1 3.97Å; L201-Y214 HydrophobicContact CD2-CE1 4.45Å
202	L	96.8	Very high	94.6	Very high	55 Å²	55	66.8 Å²	66.8	29%	0.288	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	109.9	178.8	175.5	64.8	0	0	0	110.7	E161 I194 V195	E161-L202 HydrophobicContact CB-CD1 4.18Å; I194-L202 CarbonylContact C-O 3.56Å; I194-L202 WeakPolarHBondContact CA-O 3.42Å; V195-L202 HydrophobicContact CB-CB 4.4Å; V195-L202 PolarHBondContact N-O 3.32Å; V195-L202 PolarHBondContact O-N 3.38Å
203	I	97	Very high	94.7	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	112.1	166.8	-50.2	-178.3	0	0	0	107.4	S159 K160 I162 R191 I194 L201 E205 V206 D210 Y214 L231	S159-I203 CarbonylContact C-O 3.48Å; S159-I203 WeakPolarHBondContact CA-O 3.46Å; K160-I203 PolarHBondContact N-O 2.88Å; K160-I203 PolarHBondContact O-N 3.48Å; I162-I203 HydrophobicContact CD1-CD1 4.48Å; R191-I203 VanDerWaalsContact NH2-CG2 3.33Å; I194-I203 HydrophobicContact CG1-CG1 4.29Å; I194-I203 HydrophobicContact CG1-CG2 4.42Å; L201-I203 HydrophobicContact CD2-CD1 4.21Å; L201-I203 HydrophobicContact CD2-CG1 3.5Å; L201-I203 VanDerWaalsContact CD2-CG1 3.5Å; I203-E205 WeakPolarHBondContact CG2-O 3.24Å; I203-V206 HydrophobicContact CB-CG2 4.07Å; I203-V206 HydrophobicContact CG2-CG2 3.79Å; I203-D210 HydrophobicContact CD1-CB 4.27Å; I203-Y214 HydrophobicContact CD1-CE1 4.46Å; I203-L231 HydrophobicContact CD1-CD2 3.97Å
204	R	95.9	Very high	94.9	Very high	157 Å²	157	60 Å²	60	59%	0.592	28%	0.275	S	S	*	.	S	Bend	trans	-69.8	-33.5	-178.9	-69.2	-179.1	178.9	179	1.1	113.7	S159 S193	S159-R204 WeakPolarHBondContact CA-O 3.47Å; S159-R204 WeakPolarHBondContact CB-O 3.43Å; S193-R204 WeakPolarHBondContact O-CB 3.14Å; S193-R204 WeakPolarHBondContact O-CG 3.16Å; S193-R204 PolarHBondContact O-N 3.37Å
205	E	95.7	Very high	95	Very high	85 Å²	85	59.5 Å²	59.5	40%	0.397	27%	0.272	S	S	.	.	S	Bend	trans	-142.3	111.6	179.9	-178.1	-167.8	-130.7	0	0	107.3	K158 R191 I203 R207	K158-E205 WeakPolarHBondContact O-CA 3.25Å; R191-E205 PolarHBondContact NH2-O 3.36Å; I203-E205 WeakPolarHBondContact CG2-O 3.24Å; E205-R207 IonicContact OE2-CZ 3.68Å; E205-R207 IonicContact OE2-NE 3.92Å; E205-R207 PolarHBondContact OE2-NE 3.49Å; E205-R207 IonicContact OE2-NH2 3.77Å; E205-R207 PolarHBondContact OE2-NH2 2.93Å
206	V	97	Very high	95.1	Very high	3 Å²	3	57.3 Å²	57.3	2%	0.018	26%	0.259	C	S	.	.			trans	-81.6	138	-178.1	173.5	0	0	0	0	110.7	A154 S157 K158 K160 I203 V233	A154-V206 HydrophobicContact CB-CG1 4.01Å; A154-V206 HydrophobicContact CB-CG2 4.1Å; S157-V206 PolarHBondContact N-O 3.49Å; K158-V206 WeakPolarHBondContact O-CG2 3.32Å; K158-V206 PolarHBondContact O-N 3.29Å; K160-V206 HydrophobicContact CB-CG2 3.66Å; I203-V206 HydrophobicContact CB-CG2 4.07Å; I203-V206 HydrophobicContact CG2-CG2 3.79Å; V206-V233 HydrophobicContact CG1-CB 4.42Å; V206-V233 HydrophobicContact CG1-CG1 3.76Å; V206-V233 HydrophobicContact CG1-CG2 3.72Å
207	R	96.3	Very high	95.2	Very high	110 Å²	110	54.2 Å²	54.2	42%	0.415	25%	0.245	S	C	.	.			trans	-127.6	164.1	-179.4	-58.8	178.5	-176.3	-171.1	-4.3	110	E205 D209 D210	E205-R207 IonicContact OE2-CZ 3.68Å; E205-R207 IonicContact OE2-NE 3.92Å; E205-R207 PolarHBondContact OE2-NE 3.49Å; E205-R207 IonicContact OE2-NH2 3.77Å; E205-R207 PolarHBondContact OE2-NH2 2.93Å; R207-D209 PolarHBondContact O-N 3.03Å; R207-D210 PolarHBondContact N-OD2 3.35Å; R207-D210 VanDerWaalsContact O-CB 3.31Å; R207-D210 WeakPolarHBondContact O-CB 3.37Å; R207-D210 PolarHBondContact O-N 3.22Å
208	E	95.6	Very high	95.5	Very high	102 Å²	102	47.2 Å²	47.2	48%	0.477	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-60	-35.6	175.3	-167.9	176.5	-175.9	0	0	111.9	D210 I211 H309 L310	E208-D210 PolarHBondContact O-N 2.73Å; E208-I211 HydrophobicContact CG-CD1 3.8Å; E208-I211 WeakPolarHBondContact O-CB 3.42Å; E208-I211 VanDerWaalsContact O-CG1 3.25Å; E208-I211 WeakPolarHBondContact O-CG1 3.25Å; E208-I211 PolarHBondContact O-N 3.19Å; E208-H309 IonicContact OE1-CE1 2.84Å; E208-H309 PolarHBondContact OE1-CE1 3.42Å; E208-H309 VanDerWaalsContact OE1-CE1 3.28Å; E208-H309 IonicContact OE1-NE2 2.76Å; E208-L310 HydrophobicContact CG-CD2 4.35Å
209	D	94.5	Very high	95.6	Very high	130 Å²	130	46.4 Å²	46.4	70%	0.695	22%	0.216	S	C	*	.	G	3₁₀ helix	trans	-57.3	-15.1	172.8	-67.7	-36	0	0	0	115.1	R207	R207-D209 PolarHBondContact O-N 3.03Å
210	D	96.3	Very high	95.5	Very high	5 Å²	5	47.7 Å²	47.7	3%	0.027	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-82.6	-16.5	176.9	-66.3	-48.7	0	0	0	112.9	K183 R191 I203 R207 E208 G212 Y214 L231	K183-D210 VanDerWaalsContact CE-O 3.26Å; K183-D210 WeakPolarHBondContact CE-O 3.41Å; R191-D210 IonicContact CZ-OD1 3.99Å; R191-D210 IonicContact CZ-OD2 3.58Å; R191-D210 IonicContact NH1-OD1 3.55Å; R191-D210 PolarHBondContact NH1-OD1 3.3Å; R191-D210 IonicContact NH1-OD2 3.81Å; R191-D210 VanDerWaalsContact NH2-CG 3.35Å; R191-D210 IonicContact NH2-OD1 3.47Å; R191-D210 PolarHBondContact NH2-OD1 3.24Å; R191-D210 IonicContact NH2-OD2 2.78Å; R191-D210 PolarHBondContact NH2-OD2 2.95Å; I203-D210 HydrophobicContact CD1-CB 4.27Å; R207-D210 PolarHBondContact N-OD2 3.35Å; R207-D210 VanDerWaalsContact O-CB 3.31Å; R207-D210 WeakPolarHBondContact O-CB 3.37Å; R207-D210 PolarHBondContact O-N 3.22Å; E208-D210 PolarHBondContact O-N 2.73Å; D210-G212 PolarHBondContact O-N 3.34Å; D210-Y214 WeakPolarHBondContact CB-OH 3.19Å; D210-Y214 WeakPolarHBondContact O-CE2 3.4Å; D210-Y214 PolarHBondContact O-OH 3.37Å; D210-Y214 VanDerWaalsContact O-OH 3.07Å; D210-Y214 PolarHBondContact OD1-OH 3.47Å; D210-L231 HydrophobicContact CB-CD2 4.1Å
211	I	96.9	Very high	95	Very high	73 Å²	73	50.1 Å²	50.1	37%	0.374	25%	0.246	S	C	.	.			trans	-54.1	133.1	-179.7	-67	169	0	0	0	111.1	K183 E208 V233 L310	K183-I211 PolarHBondContact NZ-O 3.15Å; E208-I211 HydrophobicContact CG-CD1 3.8Å; E208-I211 WeakPolarHBondContact O-CB 3.42Å; E208-I211 VanDerWaalsContact O-CG1 3.25Å; E208-I211 WeakPolarHBondContact O-CG1 3.25Å; E208-I211 PolarHBondContact O-N 3.19Å; I211-V233 HydrophobicContact CD1-CB 4.04Å; I211-V233 HydrophobicContact CG1-CB 3.56Å; I211-V233 HydrophobicContact CG1-CG2 3.54Å; I211-L310 HydrophobicContact CD1-CD2 4.47Å
212	G	96.2	Very high	94.6	Very high	8 Å²	8	54.1 Å²	54.1	8%	0.082	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	129.2	-158.1	170	0	0	0	0	0	114.9	E184 D210 Y214 L231	E184-G212 WeakPolarHBondContact OE1-CA 3.34Å; D210-G212 PolarHBondContact O-N 3.34Å; G212-Y214 WeakPolarHBondContact O-CD2 3.37Å; G212-L231 PolarHBondContact N-O 3.38Å; G212-L231 PolarHBondContact O-N 2.87Å
213	N	97.4	Very high	94.4	Very high	13 Å²	13	54.6 Å²	54.6	7%	0.07	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	114.3	-163.4	-53.3	-84.4	0	0	0	112	Y144 K149 E184 T228	Y144-N213 HydrophobicContact CE1-CB 3.74Å; Y144-N213 PolarHBondContact OH-ND2 2.93Å; K149-N213 WeakPolarHBondContact CD-OD1 3.07Å; K149-N213 PolarHBondContact NZ-OD1 3.13Å; E184-N213 PolarHBondContact N-O 2.78Å; E184-N213 PolarHBondContact OE1-N 3.47Å; E184-N213 PolarHBondContact OE2-ND2 3.07Å; N213-T228 HydrophobicContact CB-CG2 4.06Å
214	Y	97.4	Very high	94.3	Very high	2 Å²	2	56.5 Å²	56.5	1%	0.008	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	119.3	173.9	-70.1	-103.3	0	0	0	109.9	I162 Y182 K183 W190 L201 I203 D210 G212 T228 T229 L231	I162-Y214 HydrophobicContact CD1-CD1 4.12Å; I162-Y214 HydrophobicContact CD1-CD2 3.9Å; I162-Y214 HydrophobicContact CD1-CE1 4.34Å; I162-Y214 HydrophobicContact CD1-CE2 4.16Å; I162-Y214 HydrophobicContact CD1-CG 3.89Å; Y182-Y214 WeakPolarHBondContact O-CA 3.25Å; K183-Y214 HydrophobicContact CD-CD1 4.2Å; K183-Y214 HydrophobicContact CD-CD2 3.95Å; K183-Y214 HydrophobicContact CD-CE1 4.06Å; K183-Y214 HydrophobicContact CD-CE2 3.76Å; K183-Y214 HydrophobicContact CD-CG 4.15Å; W190-Y214 AromaticContact CH2-CD1 3.92Å; W190-Y214 HydrophobicContact CH2-CD1 3.92Å; W190-Y214 AromaticContact CH2-CE1 3.87Å; W190-Y214 HydrophobicContact CH2-CE1 3.87Å; W190-Y214 HydrophobicContact CZ3-CD1 4.28Å; W190-Y214 AromaticContact CZ3-CE1 3.76Å; W190-Y214 HydrophobicContact CZ3-CE1 3.76Å; L201-Y214 HydrophobicContact CD1-CD1 3.66Å; L201-Y214 HydrophobicContact CD1-CE1 3.97Å; L201-Y214 HydrophobicContact CD2-CE1 4.45Å; I203-Y214 HydrophobicContact CD1-CE1 4.46Å; D210-Y214 WeakPolarHBondContact CB-OH 3.19Å; D210-Y214 WeakPolarHBondContact O-CE2 3.4Å; D210-Y214 PolarHBondContact O-OH 3.37Å; D210-Y214 VanDerWaalsContact O-OH 3.07Å; D210-Y214 PolarHBondContact OD1-OH 3.47Å; G212-Y214 WeakPolarHBondContact O-CD2 3.37Å; Y214-T228 CarbonylContact O-C 3.48Å; Y214-T228 VanDerWaalsContact O-CA 3.32Å; Y214-T228 WeakPolarHBondContact O-CA 3.43Å; Y214-T229 PolarHBondContact N-O 2.84Å; Y214-T229 PolarHBondContact O-N 2.68Å; Y214-L231 HydrophobicContact CD2-CB 3.93Å; Y214-L231 HydrophobicContact CE2-CB 3.75Å; Y214-L231 HydrophobicContact CE2-CD2 3.78Å; Y214-L231 HydrophobicContact CE2-CG 4.42Å
215	T	97.2	Very high	94.2	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.006	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	125	177.3	-54.4	0	0	0	0	109.7	C143 W181 Y182 R226 R227 T228	C143-T215 PolarHBondContact SG-OG1 3.05Å; C143-T215 VanDerWaalsContact SG-OG1 3.42Å; W181-T215 CarbonylContact C-O 3.6Å; W181-T215 WeakPolarHBondContact CA-O 3.31Å; Y182-T215 PolarHBondContact N-O 3.15Å; Y182-T215 PolarHBondContact O-N 3.1Å; T215-R226 HydrophobicContact CG2-CB 4.18Å; T215-R227 WeakPolarHBondContact CA-O 3.29Å; T215-T228 WeakPolarHBondContact CB-OG1 3.24Å; T215-T228 WeakPolarHBondContact CG2-OG1 3.27Å; T215-T228 PolarHBondContact OG1-OG1 2.86Å
216	C	96.2	Very high	94.2	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.014	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	140.6	163.8	57.3	0	0	0	0	110	C164 I179 L180 W181 R226 R227	C164-C216 VanDerWaalsContact CA-SG 3.58Å; C164-C216 HydrophobicContact CB-CB 3.81Å; C164-C216 WeakPolarHBondContact CB-SG 3.37Å; C164-C216 WeakPolarHBondContact SG-CB 3.47Å; C164-C216 CovalentContact SG-SG 2.04Å; C164-C216 PolarHBondContact SG-SG 3.29Å; I179-C216 HydrophobicContact CG2-CB 3.74Å; L180-C216 CarbonylContact O-C 3.58Å; L180-C216 WeakPolarHBondContact O-CA 3.19Å; W181-C216 HydrophobicContact CD2-CB 3.92Å; W181-C216 HydrophobicContact CE3-CB 3.87Å; W181-C216 HydrophobicContact CH2-CB 3.88Å; W181-C216 HydrophobicContact CZ2-CB 3.9Å; W181-C216 HydrophobicContact CZ3-CB 3.85Å; C216-R226 VanDerWaalsContact O-CA 3.28Å; C216-R226 WeakPolarHBondContact O-CA 3.3Å; C216-R227 PolarHBondContact N-O 3.11Å; C216-R227 PolarHBondContact O-N 2.93Å; C216-R227 VanDerWaalsContact O-N 3.08Å; C216-R227 PolarHBondContact SG-O 3.3Å; C216-R227 VanDerWaalsContact SG-O 3.39Å
217	E	95.5	Very high	94.2	Very high	21 Å²	21	49.6 Å²	49.6	10%	0.098	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	125.2	174.3	-173.5	177.4	103.6	0	0	109.6	I179 L180 Y182 V224 V225 R226	I179-E217 WeakPolarHBondContact CA-O 3.39Å; L180-E217 HydrophobicContact CB-CB 4.47Å; L180-E217 PolarHBondContact N-O 2.82Å; L180-E217 PolarHBondContact O-N 2.86Å; Y182-E217 HydrophobicContact CD2-CB 4.47Å; Y182-E217 HydrophobicContact CE2-CB 3.75Å; E217-V224 VanDerWaalsContact CD-CG1 3.44Å; E217-V224 HydrophobicContact CG-CG1 3.28Å; E217-V225 WeakPolarHBondContact CA-O 3.45Å; E217-R226 HydrophobicContact CB-CG 4.35Å; E217-R226 HydrophobicContact CG-CG 4.14Å; E217-R226 IonicContact OE2-CZ 3.25Å; E217-R226 IonicContact OE2-NE 2.64Å; E217-R226 PolarHBondContact OE2-NE 2.86Å; E217-R226 IonicContact OE2-NH2 3.14Å; E217-R226 PolarHBondContact OE2-NH2 3.37Å
218	L	93.9	Very high	94.2	Very high	6 Å²	6	44.6 Å²	44.6	3%	0.031	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	139.3	175.3	175.5	64.5	0	0	0	109.7	I167 F170 P177 I179 V224 V225	I167-L218 HydrophobicContact CB-CD2 4.2Å; I167-L218 HydrophobicContact CD1-CD2 4.46Å; F170-L218 HydrophobicContact CB-CD2 3.75Å; F170-L218 HydrophobicContact CD2-CD2 4.42Å; P177-L218 HydrophobicContact CB-CD1 3.86Å; I179-L218 HydrophobicContact CG1-CB 4.3Å; I179-L218 HydrophobicContact CG1-CD1 3.87Å; L218-V224 WeakPolarHBondContact O-CA 3.36Å; L218-V225 HydrophobicContact CB-CB 4.44Å; L218-V225 PolarHBondContact N-O 3.43Å; L218-V225 PolarHBondContact O-N 2.88Å
219	K	91	Very high	94.3	Very high	142 Å²	142	40 Å²	40	62%	0.617	23%	0.23	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-102.8	123.4	173.8	-67	178.1	-177.9	172.2	0	110.4	V224	K219-V224 HydrophobicContact CG-CG2 4.49Å
220	Y	88.6	Confident	94.5	Very high	72 Å²	72	36.2 Å²	36.2	28%	0.282	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	126.4	-178	178.7	-93.2	0	0	0	111.1	F170 L172 G222 F223	F170-Y220 HydrophobicContact CB-CD1 4.48Å; F170-Y220 HydrophobicContact CB-CD2 3.84Å; F170-Y220 HydrophobicContact CB-CE2 4.38Å; F170-Y220 HydrophobicContact CB-CG 3.9Å; F170-Y220 AromaticContact CD1-CD1 3.77Å; F170-Y220 HydrophobicContact CD1-CD1 3.77Å; F170-Y220 HydrophobicContact CD1-CE1 4.02Å; F170-Y220 HydrophobicContact CD1-CG 4.06Å; F170-Y220 HydrophobicContact CG-CD1 4.46Å; F170-Y220 HydrophobicContact CG-CG 4.3Å; F170-Y220 VanDerWaalsContact O-CD2 3.29Å; F170-Y220 WeakPolarHBondContact O-CD2 3.38Å; L172-Y220 HydrophobicContact CD1-CE2 4.37Å; Y220-G222 PolarHBondContact O-N 3.5Å; Y220-G222 VanDerWaalsContact O-N 3.14Å; Y220-F223 PolarHBondContact N-O 3.47Å; Y220-F223 WeakPolarHBondContact O-CA 3.35Å; Y220-F223 WeakPolarHBondContact O-CB 3.44Å; Y220-F223 PolarHBondContact O-N 3.27Å
221	G	84	Confident	94.6	Very high	65 Å²	65	36 Å²	36	67%	0.67	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.1	23.1	174.8	0	0	0	0	0	115.6	F223	G221-F223 VanDerWaalsContact C-N 3.25Å; G221-F223 PolarHBondContact O-N 2.88Å
222	G	87.5	Confident	94.5	Very high	85 Å²	85	35 Å²	35	88%	0.876	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.4	-11.2	-172.2	0	0	0	0	0	114.4	Y220	Y220-G222 PolarHBondContact O-N 3.5Å; Y220-G222 VanDerWaalsContact O-N 3.14Å
223	F	92.9	Very high	94.6	Very high	64 Å²	64	35 Å²	35	28%	0.281	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	166.4	172.4	-52.1	-75.3	0	0	0	111.6	P48 R106 P107 Y220 G221	P48-F223 HydrophobicContact CG-CB 4.14Å; P48-F223 HydrophobicContact CG-CD2 4.48Å; R106-F223 HydrophobicContact CB-CE2 4.38Å; P107-F223 HydrophobicContact CB-CD1 4.05Å; P107-F223 HydrophobicContact CB-CE1 3.78Å; P107-F223 HydrophobicContact CB-CZ 4.44Å; P107-F223 HydrophobicContact CG-CE1 3.88Å; Y220-F223 PolarHBondContact N-O 3.47Å; Y220-F223 WeakPolarHBondContact O-CA 3.35Å; Y220-F223 WeakPolarHBondContact O-CB 3.44Å; Y220-F223 PolarHBondContact O-N 3.27Å; G221-F223 VanDerWaalsContact C-N 3.25Å; G221-F223 PolarHBondContact O-N 2.88Å
224	V	93.8	Very high	94.5	Very high	41 Å²	41	35 Å²	35	25%	0.248	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	136.9	175.1	-175.9	0	0	0	0	108.2	E47 E217 L218 K219 R226	E47-V224 WeakPolarHBondContact CG-O 3.18Å; E217-V224 VanDerWaalsContact CD-CG1 3.44Å; E217-V224 HydrophobicContact CG-CG1 3.28Å; L218-V224 WeakPolarHBondContact O-CA 3.36Å; K219-V224 HydrophobicContact CG-CG2 4.49Å; V224-R226 HydrophobicContact CG1-CG 4.24Å
225	V	95	Very high	94.4	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.012	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	125.9	177.3	176.7	0	0	0	0	108.1	P48 F170 E217 L218	P48-V225 HydrophobicContact CG-CG2 3.69Å; F170-V225 HydrophobicContact CD2-CG1 4.14Å; F170-V225 HydrophobicContact CD2-CG2 4.06Å; F170-V225 HydrophobicContact CE2-CB 4.48Å; F170-V225 HydrophobicContact CE2-CG1 3.84Å; F170-V225 HydrophobicContact CE2-CG2 3.92Å; F170-V225 HydrophobicContact CZ-CG2 4.22Å; E217-V225 WeakPolarHBondContact CA-O 3.45Å; L218-V225 HydrophobicContact CB-CB 4.44Å; L218-V225 PolarHBondContact N-O 3.43Å; L218-V225 PolarHBondContact O-N 2.88Å
226	R	95.8	Very high	94.3	Very high	80 Å²	80	37.6 Å²	37.6	30%	0.302	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	137.5	178.8	-61	-170.8	-173.4	90.2	4.2	112.2	L44 E47 T215 C216 E217 V224	L44-R226 HydrophobicContact CD1-CB 4.45Å; E47-R226 PolarHBondContact OE1-N 3.47Å; T215-R226 HydrophobicContact CG2-CB 4.18Å; C216-R226 VanDerWaalsContact O-CA 3.28Å; C216-R226 WeakPolarHBondContact O-CA 3.3Å; E217-R226 HydrophobicContact CB-CG 4.35Å; E217-R226 HydrophobicContact CG-CG 4.14Å; E217-R226 IonicContact OE2-CZ 3.25Å; E217-R226 IonicContact OE2-NE 2.64Å; E217-R226 PolarHBondContact OE2-NE 2.86Å; E217-R226 IonicContact OE2-NH2 3.14Å; E217-R226 PolarHBondContact OE2-NH2 3.37Å; V224-R226 HydrophobicContact CG1-CG 4.24Å
227	R	96.1	Very high	94.2	Very high	17 Å²	17	42.2 Å²	42.2	6%	0.064	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	129.7	172.8	-53.4	-75.9	173.3	-103.2	4.1	108	E47 Y150 R165 I167 T215 C216	E47-R227 IonicContact OE2-CZ 3.96Å; E47-R227 IonicContact OE2-NH1 3.4Å; E47-R227 PolarHBondContact OE2-NH1 2.9Å; E47-R227 IonicContact OE2-NH2 3.91Å; Y150-R227 HydrophobicContact CE2-CB 4.22Å; R165-R227 WeakPolarHBondContact O-CG 3.24Å; I167-R227 HydrophobicContact CG2-CG 4.28Å; T215-R227 WeakPolarHBondContact CA-O 3.29Å; C216-R227 PolarHBondContact N-O 3.11Å; C216-R227 PolarHBondContact O-N 2.93Å; C216-R227 VanDerWaalsContact O-N 3.08Å; C216-R227 PolarHBondContact SG-O 3.3Å; C216-R227 VanDerWaalsContact SG-O 3.39Å
228	T	97.4	Very high	94.2	Very high	5 Å²	5	42.9 Å²	42.9	3%	0.031	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	129.1	-177.3	-61.7	0	0	0	0	110.5	Y144 K149 Y150 N213 Y214 T215	Y144-T228 WeakPolarHBondContact CB-OG1 3.42Å; Y144-T228 HydrophobicContact CD1-CG2 3.71Å; Y144-T228 HydrophobicContact CE1-CG2 4.27Å; Y144-T228 HydrophobicContact CG-CG2 3.91Å; K149-T228 HydrophobicContact CD-CG2 4.23Å; K149-T228 HydrophobicContact CG-CG2 4.36Å; Y150-T228 PolarHBondContact N-O 3.17Å; N213-T228 HydrophobicContact CB-CG2 4.06Å; Y214-T228 CarbonylContact O-C 3.48Å; Y214-T228 VanDerWaalsContact O-CA 3.32Å; Y214-T228 WeakPolarHBondContact O-CA 3.43Å; T215-T228 WeakPolarHBondContact CB-OG1 3.24Å; T215-T228 WeakPolarHBondContact CG2-OG1 3.27Å; T215-T228 PolarHBondContact OG1-OG1 2.86Å
229	T	97.9	Very high	94.2	Very high	5 Å²	5	47.9 Å²	47.9	3%	0.031	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	123.8	175.3	-54.8	0	0	0	0	109.1	Y150 E152 I162 Y214	Y150-T229 CarbonylContact O-C 3.6Å; Y150-T229 WeakPolarHBondContact O-CA 3.32Å; E152-T229 HydrophobicContact CB-CG2 3.77Å; E152-T229 HydrophobicContact CG-CG2 3.47Å; E152-T229 VanDerWaalsContact CG-CG2 3.47Å; I162-T229 HydrophobicContact CG2-CG2 4.16Å; Y214-T229 PolarHBondContact N-O 2.84Å; Y214-T229 PolarHBondContact O-N 2.68Å
230	E	97.6	Very high	94.4	Very high	52 Å²	52	46.7 Å²	46.7	24%	0.243	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	117.4	167.7	179.6	160.2	-141.9	0	0	109.2	K149 Y150 F151 E152	K149-E230 VanDerWaalsContact CE-OE2 3.24Å; K149-E230 WeakPolarHBondContact CE-OE2 3.35Å; K149-E230 IonicContact NZ-OE1 3.46Å; K149-E230 PolarHBondContact NZ-OE1 3.39Å; K149-E230 IonicContact NZ-OE2 2.77Å; K149-E230 PolarHBondContact NZ-OE2 3.23Å; Y150-E230 PolarHBondContact O-N 3.32Å; F151-E230 HydrophobicContact CD1-CB 4.14Å; F151-E230 HydrophobicContact CE1-CB 4.44Å; F151-E230 WeakPolarHBondContact CE1-OE2 3.46Å; E152-E230 PolarHBondContact N-O 3.3Å
231	L	97.4	Very high	94.8	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	117.1	174.2	-174.5	69.4	0	0	0	109.5	E152 A154 K160 I162 I203 D210 G212 Y214 V233	E152-L231 HydrophobicContact CB-CD1 4.13Å; A154-L231 HydrophobicContact CB-CD1 3.89Å; K160-L231 HydrophobicContact CG-CD1 4.13Å; I162-L231 HydrophobicContact CD1-CD1 4.41Å; I162-L231 HydrophobicContact CD1-CD2 4.3Å; I203-L231 HydrophobicContact CD1-CD2 3.97Å; D210-L231 HydrophobicContact CB-CD2 4.1Å; G212-L231 PolarHBondContact N-O 3.38Å; G212-L231 PolarHBondContact O-N 2.87Å; Y214-L231 HydrophobicContact CD2-CB 3.93Å; Y214-L231 HydrophobicContact CE2-CB 3.75Å; Y214-L231 HydrophobicContact CE2-CD2 3.78Å; Y214-L231 HydrophobicContact CE2-CG 4.42Å; L231-V233 HydrophobicContact CD2-CG2 4.28Å; L231-V233 HydrophobicContact CG-CG2 4.3Å
232	T	96.6	Very high	95.4	Very high	52 Å²	52	41.8 Å²	41.8	32%	0.319	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	139.8	167	52.8	0	0	0	0	109.3	E152 K153 A154	E152-T232 PolarHBondContact O-N 2.96Å; E152-T232 PolarHBondContact O-OG1 2.82Å; K153-T232 WeakPolarHBondContact CA-O 3.39Å; K153-T232 WeakPolarHBondContact CG-OG1 3.31Å; A154-T232 PolarHBondContact N-O 3.22Å
233	V	96.6	Very high	95.8	Very high	9 Å²	9	44.1 Å²	44.1	6%	0.055	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	136.2	-177.1	179.3	0	0	0	0	109.5	A154 L156 V206 I211 L231 L310	A154-V233 CarbonylContact O-C 3.58Å; A154-V233 VanDerWaalsContact O-CA 3.28Å; A154-V233 WeakPolarHBondContact O-CA 3.29Å; L156-V233 HydrophobicContact CD2-CG1 3.53Å; L156-V233 HydrophobicContact CG-CG1 3.67Å; V206-V233 HydrophobicContact CG1-CB 4.42Å; V206-V233 HydrophobicContact CG1-CG1 3.76Å; V206-V233 HydrophobicContact CG1-CG2 3.72Å; I211-V233 HydrophobicContact CD1-CB 4.04Å; I211-V233 HydrophobicContact CG1-CB 3.56Å; I211-V233 HydrophobicContact CG1-CG2 3.54Å; L231-V233 HydrophobicContact CD2-CG2 4.28Å; L231-V233 HydrophobicContact CG-CG2 4.3Å; V233-L310 HydrophobicContact CG1-CD2 4.33Å
234	T	96.4	Very high	95.9	Very high	11 Å²	11	41.6 Å²	41.6	7%	0.067	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	163.1	179.2	58.3	0	0	0	0	110.8	A154 E155 L156 Y273 L310	A154-T234 PolarHBondContact O-N 3.12Å; A154-T234 PolarHBondContact O-OG1 3.4Å; E155-T234 CarbonylContact C-O 3.49Å; E155-T234 WeakPolarHBondContact CA-O 3.45Å; L156-T234 WeakPolarHBondContact CG-O 3.47Å; L156-T234 PolarHBondContact N-O 3.2Å; T234-Y273 HydrophobicContact CG2-CD2 4.29Å; T234-Y273 HydrophobicContact CG2-CE1 4.26Å; T234-Y273 HydrophobicContact CG2-CE2 3.85Å; T234-Y273 WeakPolarHBondContact OG1-CE1 3.44Å; T234-L310 CarbonylContact C-O 3.58Å; T234-L310 WeakPolarHBondContact CA-O 3.28Å; T234-L310 WeakPolarHBondContact CB-O 3.49Å
235	A	95	Very high	96	Very high	5 Å²	5	42.8 Å²	42.8	4%	0.041	22%	0.217	C	C	.	.	P	Polyproline II helix	trans	-56.9	154.5	164.5	0	0	0	0	0	109.9	Y273 L310 E312	A235-Y273 WeakPolarHBondContact O-CD1 3.46Å; A235-L310 PolarHBondContact N-O 2.93Å; A235-E312 HydrophobicContact CB-CG 3.62Å
236	P	95.3	Very high	96	Very high	54 Å²	54	47.4 Å²	47.4	35%	0.351	24%	0.235	S	C	.	.	P	Polyproline II helix	trans	-59.8	151.2	171.2	28.7	-35.9	0	0	0	110.3	E155 T238	E155-P236 WeakPolarHBondContact OE2-CA 3.31Å; P236-T238 PolarHBondContact O-N 3.06Å; P236-T238 VanDerWaalsContact O-N 3.08Å
237	L	94.8	Very high	96	Very high	99 Å²	99	43.6 Å²	43.6	52%	0.518	22%	0.221	S	C	.	.	P	Polyproline II helix	trans	-51.7	119.3	174	-77.8	167.1	0	0	0	110.3	E155 Y273	E155-L237 PolarHBondContact OE2-N 3.04Å; E155-L237 VanDerWaalsContact OE2-N 3.08Å; L237-Y273 WeakPolarHBondContact CA-O 3.3Å; L237-Y273 HydrophobicContact CD2-CD1 4.23Å; L237-Y273 HydrophobicContact CD2-CE1 4.24Å
238	T	94.3	Very high	95.8	Very high	34 Å²	34	48 Å²	48	21%	0.209	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-67.5	143	-173.4	-170.7	0	0	0	0	111.5	P236 K240 Y273 S274 N340	P236-T238 PolarHBondContact O-N 3.06Å; P236-T238 VanDerWaalsContact O-N 3.08Å; T238-K240 PolarHBondContact OG1-N 3.36Å; T238-Y273 WeakPolarHBondContact CG2-O 3.29Å; T238-Y273 PolarHBondContact N-O 3.44Å; T238-S274 WeakPolarHBondContact CG2-OG 3.32Å; T238-N340 PolarHBondContact O-ND2 3Å
239	D	95	Very high	95.4	Very high	111 Å²	111	52.1 Å²	52.1	59%	0.594	26%	0.262	S	S	*	.			trans	-101.9	6.5	172.6	79.4	-32.1	0	0	0	112.3
240	K	95.3	Very high	94.8	Very high	117 Å²	117	57.5 Å²	57.5	51%	0.509	30%	0.3	S	S	.	.	S	Bend	trans	-110.5	152.2	-178.2	-53.9	-49.8	177.4	-139.7	0	112	T238 N338 N340	T238-K240 PolarHBondContact OG1-N 3.36Å; K240-N338 PolarHBondContact O-ND2 3.05Å; K240-N340 PolarHBondContact N-ND2 3Å; K240-N340 PolarHBondContact O-ND2 2.87Å
241	P	96	Very high	94.3	Very high	32 Å²	32	61.7 Å²	61.7	21%	0.208	32%	0.317	C	S	.	.			trans	-67.5	164	164.3	30.5	-34.5	0	0	0	111	N338 R343	P241-N338 WeakPolarHBondContact CA-OD1 3.49Å; P241-R343 HydrophobicContact CB-CG 4.39Å
242	P	96.8	Very high	93.9	Very high	3 Å²	3	66 Å²	66	2%	0.019	34%	0.34	C	S	.	.			trans	-63.7	152.2	176.4	-15.5	31.3	0	0	0	110.8	F270 F271 V336 N338	P242-F270 WeakPolarHBondContact CA-O 3.2Å; P242-F271 HydrophobicContact CB-CD1 3.77Å; P242-F271 HydrophobicContact CB-CD2 4.32Å; P242-F271 HydrophobicContact CB-CE1 3.73Å; P242-F271 HydrophobicContact CB-CE2 4.28Å; P242-F271 HydrophobicContact CB-CG 4.07Å; P242-F271 HydrophobicContact CB-CZ 3.98Å; P242-F271 HydrophobicContact CG-CD1 3.57Å; P242-F271 HydrophobicContact CG-CE1 3.4Å; P242-F271 HydrophobicContact CG-CG 4.36Å; P242-F271 HydrophobicContact CG-CZ 4.07Å; P242-V336 HydrophobicContact CB-CB 4Å; P242-V336 HydrophobicContact CB-CG2 3.91Å; P242-V336 HydrophobicContact CG-CB 4.35Å; P242-V336 HydrophobicContact CG-CG2 4.44Å; P242-N338 HydrophobicContact CG-CB 3.98Å
243	K	96.1	Very high	93.7	Very high	134 Å²	134	64.5 Å²	64.5	58%	0.583	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.6	118.2	-177	-176.6	-179	-179.6	-178	0	110.6	L245 A269 F270	K243-L245 HydrophobicContact CD-CD2 4.39Å; K243-L245 HydrophobicContact CG-CD2 4.37Å; K243-A269 WeakPolarHBondContact O-CA 3.31Å; K243-F270 HydrophobicContact CB-CB 4.45Å; K243-F270 PolarHBondContact N-O 3.41Å; K243-F270 PolarHBondContact O-N 2.9Å
244	L	95.8	Very high	93.5	Very high	11 Å²	11	69.1 Å²	69.1	6%	0.058	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	129.6	173.3	-113	151.2	0	0	0	110.6	P247 E249 V336 A345	L244-P247 VanDerWaalsContact CD2-O 3.31Å; L244-P247 WeakPolarHBondContact CD2-O 3.33Å; L244-E249 HydrophobicContact CB-CG 3.78Å; L244-E249 HydrophobicContact CD1-CG 4.36Å; L244-V336 HydrophobicContact CD1-CG1 4.32Å; L244-V336 HydrophobicContact CD1-CG2 3.96Å; L244-V336 HydrophobicContact CG-CG1 4.16Å; L244-V336 HydrophobicContact CG-CG2 4.16Å; L244-A345 HydrophobicContact CD1-CB 3.79Å; L244-A345 HydrophobicContact CD2-CB 4.08Å; L244-A345 HydrophobicContact CG-CB 4.41Å
245	L	95.2	Very high	93.2	Very high	66 Å²	66	71 Å²	71	35%	0.346	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	-39.5	-179.3	-55.8	179	0	0	0	111.3	K243 R268 F270 E314	K243-L245 HydrophobicContact CD-CD2 4.39Å; K243-L245 HydrophobicContact CG-CD2 4.37Å; L245-R268 HydrophobicContact CB-CB 4.33Å; L245-R268 WeakPolarHBondContact CB-O 3.42Å; L245-R268 PolarHBondContact N-O 3.03Å; L245-F270 HydrophobicContact CD1-CB 4.32Å; L245-E314 HydrophobicContact CD1-CG 3.92Å
246	Y	94.8	Very high	93.1	Very high	99 Å²	99	76.9 Å²	76.9	39%	0.388	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	130.3	174.7	-176.8	-90.2	0	0	0	109.3	T266 C267 R268	Y246-T266 WeakPolarHBondContact CD1-O 3.23Å; Y246-T266 VanDerWaalsContact CE1-O 3.29Å; Y246-T266 WeakPolarHBondContact CE1-O 3.44Å; Y246-C267 CarbonylContact O-C 3.54Å; Y246-C267 VanDerWaalsContact O-CA 3.29Å; Y246-C267 WeakPolarHBondContact O-CA 3.45Å; Y246-R268 PolarHBondContact N-O 2.95Å; Y246-R268 VanDerWaalsContact N-O 3.17Å; Y246-R268 PolarHBondContact O-N 3.36Å
247	P	94.9	Very high	92.8	Very high	0 Å²	0	75 Å²	75	0%	0	38%	0.376	C	S	.	.	S	Bend	cis	-60.4	172	-12	26.7	-34	0	0	0	112.5	L244 T253 A345 V347	L244-P247 VanDerWaalsContact CD2-O 3.31Å; L244-P247 WeakPolarHBondContact CD2-O 3.33Å; P247-T253 HydrophobicContact CB-CG2 4.03Å; P247-T253 WeakPolarHBondContact CB-OG1 3.22Å; P247-A345 HydrophobicContact CB-CB 4.14Å; P247-A345 HydrophobicContact CG-CB 3.72Å; P247-V347 HydrophobicContact CB-CG2 4.03Å; P247-V347 HydrophobicContact CG-CG2 3.71Å
248	M	92.6	Very high	92.5	Very high	110 Å²	110	73.2 Å²	73.2	54%	0.542	37%	0.365	S	S	.	.	B	Isolated β-bridge	trans	-94.6	131.2	-177.9	-61.7	-176.7	75.4	0	0	110.8	S250 K251	M248-S250 PolarHBondContact O-N 3.19Å; M248-K251 HydrophobicContact CB-CB 4.43Å; M248-K251 PolarHBondContact O-N 3.05Å
249	E	88.6	Confident	92.2	Very high	90 Å²	90	75 Å²	75	42%	0.421	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.1	-33	-174.9	-61.7	178.2	-169.3	0	0	114.7	L244 R343	L244-E249 HydrophobicContact CB-CG 3.78Å; L244-E249 HydrophobicContact CD1-CG 4.36Å; E249-R343 WeakPolarHBondContact OE1-CB 3.35Å; E249-R343 WeakPolarHBondContact OE1-CG 3.42Å; E249-R343 WeakPolarHBondContact OE2-CD 3.49Å; E249-R343 IonicContact OE2-NE 2.66Å
250	S	85.6	Confident	91.8	Very high	119 Å²	119	71.7 Å²	71.7	83%	0.832	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	2.3	-177.4	61.6	0	0	0	0	115.4	M248	M248-S250 PolarHBondContact O-N 3.19Å
251	K	87.8	Confident	91.6	Very high	139 Å²	139	70 Å²	70	60%	0.604	36%	0.362	S	S	*	.	B	Isolated β-bridge	trans	-136.8	114	-175.7	-178	-178.3	176.7	-176.1	0	111.1	M248 T253	M248-K251 HydrophobicContact CB-CB 4.43Å; M248-K251 PolarHBondContact O-N 3.05Å; K251-T253 PolarHBondContact O-N 3.37Å
252	L	89.4	Confident	91.5	Very high	91 Å²	91	72.3 Å²	72.3	48%	0.476	38%	0.379	S	S	.	.			trans	-59.4	111.7	167.1	-172.8	70.8	0	0	0	109.1	L348	L252-L348 HydrophobicContact CD1-CB 4.16Å; L252-L348 HydrophobicContact CD2-CB 4.15Å; L252-L348 HydrophobicContact CD2-CD2 4.3Å; L252-L348 HydrophobicContact CG-CB 4.18Å
253	T	91.2	Very high	91.3	Very high	21 Å²	21	72.4 Å²	72.4	13%	0.129	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	126.4	173.9	48.2	0	0	0	0	108.9	P247 K251 S346 V347 L348	P247-T253 HydrophobicContact CB-CG2 4.03Å; P247-T253 WeakPolarHBondContact CB-OG1 3.22Å; K251-T253 PolarHBondContact O-N 3.37Å; T253-S346 PolarHBondContact N-O 3.42Å; T253-S346 PolarHBondContact OG1-O 2.99Å; T253-V347 CarbonylContact O-C 3.59Å; T253-V347 VanDerWaalsContact O-CA 3.27Å; T253-V347 WeakPolarHBondContact O-CA 3.37Å; T253-V347 WeakPolarHBondContact O-CG1 3.49Å; T253-L348 PolarHBondContact O-N 3.08Å
254	I	92	Very high	91.3	Very high	106 Å²	106	69.3 Å²	69.3	54%	0.544	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	129.5	176.1	-54.3	176.9	0	0	0	107.8	L348 H350	I254-L348 HydrophobicContact CG1-CD2 4.41Å; I254-H350 HydrophobicContact CG2-CB 3.9Å
255	Q	91.7	Very high	91.3	Very high	51 Å²	51	68.8 Å²	68.8	24%	0.238	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	116.1	173	-175.4	160.3	-17.5	0	0	108.7	N264 L265 V347 L348 H350	Q255-N264 PolarHBondContact NE2-O 2.99Å; Q255-L265 HydrophobicContact CB-CD2 4.34Å; Q255-L265 VanDerWaalsContact CD-CD2 3.43Å; Q255-L265 HydrophobicContact CG-CD2 4.21Å; Q255-V347 HydrophobicContact CB-CG1 3.85Å; Q255-L348 PolarHBondContact N-O 2.81Å; Q255-H350 PolarHBondContact O-N 3.4Å
256	E	91.1	Very high	91.3	Very high	127 Å²	127	67.8 Å²	67.8	59%	0.593	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.1	134	-179	-64.3	-175.9	172.2	0	0	111.1	H350 R352	E256-H350 WeakPolarHBondContact CA-O 3.48Å; E256-R352 HydrophobicContact CB-CB 4.22Å
257	T	89.2	Confident	91.5	Very high	15 Å²	15	63.1 Å²	63.1	9%	0.092	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	163.7	174.7	-168	0	0	0	0	111.1	V324 L349 H350 K351 R352	T257-V324 HydrophobicContact CG2-CB 4.23Å; T257-V324 HydrophobicContact CG2-CG1 3.8Å; T257-V324 HydrophobicContact CG2-CG2 4.02Å; T257-L349 HydrophobicContact CG2-CD1 3.64Å; T257-L349 HydrophobicContact CG2-CD2 4.44Å; T257-L349 HydrophobicContact CG2-CG 4.04Å; T257-H350 PolarHBondContact N-O 2.77Å; T257-K351 CarbonylContact O-C 3.51Å; T257-K351 WeakPolarHBondContact O-CA 3.5Å; T257-R352 PolarHBondContact O-N 2.88Å
258	Q	88.7	Confident	91.6	Very high	61 Å²	61	67.9 Å²	67.9	29%	0.285	36%	0.363	S	S	.	.			trans	-95.2	155.8	168.4	-47.8	-156.9	-84.4	0	0	110	D261 R352	Q258-D261 HydrophobicContact CB-CB 4.46Å; Q258-D261 WeakPolarHBondContact CB-OD2 3.33Å; Q258-D261 PolarHBondContact O-N 2.77Å; Q258-R352 HydrophobicContact CG-CB 4.45Å
259	L	89.2	Confident	91.8	Very high	71 Å²	71	62.7 Å²	62.7	37%	0.372	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	134.4	171.2	-66	172.7	0	0	0	108.8	D261 V324 E326 K351	L259-D261 VanDerWaalsContact C-N 3.34Å; L259-V324 WeakPolarHBondContact CA-O 3.17Å; L259-V324 HydrophobicContact CD2-CG1 4.39Å; L259-E326 HydrophobicContact CD2-CB 4.43Å; L259-K351 HydrophobicContact CD1-CD 4.16Å; L259-K351 HydrophobicContact CG-CD 4.37Å
260	G	87	Confident	92.2	Very high	42 Å²	42	61.8 Å²	61.8	43%	0.433	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.1	-29.6	-175.5	0	0	0	0	0	115	S323 V324	G260-S323 WeakPolarHBondContact CA-OG 3.46Å; G260-S323 PolarHBondContact O-OG 3.39Å; G260-V324 PolarHBondContact N-O 3.22Å
261	D	90.4	Very high	92.8	Very high	81 Å²	81	56.7 Å²	56.7	43%	0.433	30%	0.295	S	S	.	.	S	Bend	trans	-69.1	160.3	173.6	-74.5	-10.9	0	0	0	111	Q258 L259 V324	Q258-D261 HydrophobicContact CB-CB 4.46Å; Q258-D261 WeakPolarHBondContact CB-OD2 3.33Å; Q258-D261 PolarHBondContact O-N 2.77Å; L259-D261 VanDerWaalsContact C-N 3.34Å; D261-V324 VanDerWaalsContact O-CG2 3.29Å; D261-V324 WeakPolarHBondContact O-CG2 3.32Å; D261-V324 PolarHBondContact O-N 3.27Å
262	S	93	Very high	93.2	Very high	82 Å²	82	50.4 Å²	50.4	57%	0.573	27%	0.27	S	S	*	.			trans	-85.7	142.6	172	64.2	0	0	0	0	112.2	V321 D322	S262-V321 CarbonylContact C-O 3.49Å; S262-V321 WeakPolarHBondContact CA-O 3.35Å; S262-V321 WeakPolarHBondContact CB-O 3.42Å; S262-D322 WeakPolarHBondContact CB-O 3.41Å
263	A	93.9	Very high	93.4	Very high	4 Å²	4	47.1 Å²	47.1	3%	0.033	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	133.8	175.5	0	0	0	0	0	110.9	I320 V321 V324 L349	A263-I320 WeakPolarHBondContact O-CA 3.39Å; A263-V321 HydrophobicContact CB-CB 4.39Å; A263-V321 PolarHBondContact N-O 3.25Å; A263-V321 PolarHBondContact O-N 3.49Å; A263-V324 HydrophobicContact CB-CG2 3.67Å; A263-L349 HydrophobicContact CB-CD1 3.94Å; A263-L349 HydrophobicContact CB-CD2 4.48Å
264	N	95.2	Very high	93.5	Very high	69 Å²	69	48.4 Å²	48.4	37%	0.369	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	111.4	175	-178.8	-31.6	0	0	0	109.2	Q255 T266 S318 L319 I320	Q255-N264 PolarHBondContact NE2-O 2.99Å; N264-T266 PolarHBondContact OD1-OG1 2.96Å; N264-T266 VanDerWaalsContact OD1-OG1 3.12Å; N264-S318 VanDerWaalsContact OD1-CB 3.32Å; N264-S318 WeakPolarHBondContact OD1-CB 3.49Å; N264-S318 PolarHBondContact OD1-OG 3.44Å; N264-S318 VanDerWaalsContact OD1-OG 3.07Å; N264-L319 CarbonylContact C-O 3.58Å; N264-L319 WeakPolarHBondContact CA-O 3.46Å; N264-I320 HydrophobicContact CB-CG1 4.39Å
265	L	95.5	Very high	93.5	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.005	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	99.1	174.4	-43.6	-173.4	0	0	0	108	Q255 W283 S318 L319 Y332 V347 L349	Q255-L265 HydrophobicContact CB-CD2 4.34Å; Q255-L265 VanDerWaalsContact CD-CD2 3.43Å; Q255-L265 HydrophobicContact CG-CD2 4.21Å; L265-W283 HydrophobicContact CB-CH2 3.77Å; L265-W283 HydrophobicContact CB-CZ2 3.77Å; L265-W283 HydrophobicContact CB-CZ3 4.41Å; L265-W283 HydrophobicContact CD1-CZ3 4.43Å; L265-W283 WeakPolarHBondContact O-CZ2 3.36Å; L265-S318 CarbonylContact O-C 3.6Å; L265-S318 WeakPolarHBondContact O-CA 3.46Å; L265-L319 HydrophobicContact CB-CB 4.25Å; L265-L319 HydrophobicContact CD1-CD2 4.24Å; L265-L319 PolarHBondContact N-O 3.47Å; L265-L319 PolarHBondContact O-N 3Å; L265-Y332 HydrophobicContact CD1-CD1 4.39Å; L265-Y332 HydrophobicContact CD1-CD2 3.64Å; L265-Y332 HydrophobicContact CD1-CE2 4.4Å; L265-Y332 HydrophobicContact CD1-CG 3.62Å; L265-V347 HydrophobicContact CD1-CB 4.43Å; L265-V347 HydrophobicContact CD2-CG1 4.27Å; L265-L349 HydrophobicContact CD2-CD1 4.25Å
266	T	96.5	Very high	93.3	Very high	45 Å²	45	47.6 Å²	47.6	28%	0.276	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	133.1	175.8	-54.8	0	0	0	0	110.3	Y246 N264 R268 S316 S318	Y246-T266 WeakPolarHBondContact CD1-O 3.23Å; Y246-T266 VanDerWaalsContact CE1-O 3.29Å; Y246-T266 WeakPolarHBondContact CE1-O 3.44Å; N264-T266 PolarHBondContact OD1-OG1 2.96Å; N264-T266 VanDerWaalsContact OD1-OG1 3.12Å; T266-R268 HydrophobicContact CG2-CG 4.38Å; T266-S316 VanDerWaalsContact CG2-OG 3.31Å; T266-S316 WeakPolarHBondContact CG2-OG 3.43Å; T266-S318 PolarHBondContact OG1-OG 2.92Å; T266-S318 VanDerWaalsContact OG1-OG 3.08Å
267	C	97.4	Very high	93.2	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	139.7	167.1	-175.6	0	0	0	0	109.9	Y246 I281 W283 S316 I317 C334	Y246-C267 CarbonylContact O-C 3.54Å; Y246-C267 VanDerWaalsContact O-CA 3.29Å; Y246-C267 WeakPolarHBondContact O-CA 3.45Å; C267-I281 HydrophobicContact CB-CD1 4.48Å; C267-W283 HydrophobicContact CB-CH2 4.36Å; C267-W283 HydrophobicContact CB-CZ2 3.51Å; C267-S316 CarbonylContact O-C 3.51Å; C267-S316 WeakPolarHBondContact O-CA 3.35Å; C267-S316 PolarHBondContact O-OG 3.4Å; C267-I317 HydrophobicContact CB-CG2 4.05Å; C267-I317 PolarHBondContact N-O 2.86Å; C267-I317 PolarHBondContact O-N 2.99Å; C267-C334 HydrophobicContact CB-CB 3.61Å; C267-C334 WeakPolarHBondContact CB-SG 3.38Å; C267-C334 WeakPolarHBondContact SG-CB 3.44Å; C267-C334 CovalentContact SG-SG 2.02Å; C267-C334 PolarHBondContact SG-SG 2.94Å
268	R	97.6	Very high	93.4	Very high	101 Å²	101	51 Å²	51	38%	0.381	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	134.2	176.4	-74.8	172.8	63.8	-174.5	2.4	110.4	L245 Y246 T266 L306 E314 V315 S316	L245-R268 HydrophobicContact CB-CB 4.33Å; L245-R268 WeakPolarHBondContact CB-O 3.42Å; L245-R268 PolarHBondContact N-O 3.03Å; Y246-R268 PolarHBondContact N-O 2.95Å; Y246-R268 VanDerWaalsContact N-O 3.17Å; Y246-R268 PolarHBondContact O-N 3.36Å; T266-R268 HydrophobicContact CG2-CG 4.38Å; R268-L306 HydrophobicContact CG-CD1 4.03Å; R268-E314 IonicContact CZ-OE1 2.72Å; R268-E314 IonicContact NE-OE1 3.38Å; R268-E314 PolarHBondContact NE-OE1 2.96Å; R268-E314 IonicContact NH2-OE1 3.82Å; R268-E314 PolarHBondContact NH2-OE1 2.66Å; R268-V315 WeakPolarHBondContact CA-O 3.37Å; R268-S316 WeakPolarHBondContact CG-OG 3.42Å
269	A	97.5	Very high	93.6	Very high	0 Å²	0	49 Å²	49	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	156.3	-178.8	0	0	0	0	0	112.5	K243 F271 I281 E314 V315 V336	K243-A269 WeakPolarHBondContact O-CA 3.31Å; A269-F271 HydrophobicContact CB-CD2 4.45Å; A269-F271 HydrophobicContact CB-CE2 3.91Å; A269-I281 HydrophobicContact CB-CD1 3.99Å; A269-E314 WeakPolarHBondContact O-CA 3.23Å; A269-V315 PolarHBondContact N-O 2.95Å; A269-V315 PolarHBondContact O-N 3.14Å; A269-V336 HydrophobicContact CB-CB 4.44Å; A269-V336 HydrophobicContact CB-CG1 3.49Å; A269-V336 VanDerWaalsContact CB-CG1 3.49Å
270	F	97.3	Very high	93.9	Very high	71 Å²	71	50 Å²	50	31%	0.311	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	125.2	175.6	176.5	-92.1	0	0	0	110.3	P242 K243 L245 E312	P242-F270 WeakPolarHBondContact CA-O 3.2Å; K243-F270 HydrophobicContact CB-CB 4.45Å; K243-F270 PolarHBondContact N-O 3.41Å; K243-F270 PolarHBondContact O-N 2.9Å; L245-F270 HydrophobicContact CD1-CB 4.32Å; F270-E312 HydrophobicContact CE2-CB 4.03Å; F270-E312 HydrophobicContact CZ-CB 3.83Å; F270-E312 HydrophobicContact CZ-CG 4.3Å
271	F	97.4	Very high	94.4	Very high	12 Å²	12	48.3 Å²	48.3	5%	0.053	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	115.8	176.1	-71.9	-103.8	0	0	0	109	P242 A269 P279 L280 I281 E312 Q313 V315 V336	P242-F271 HydrophobicContact CB-CD1 3.77Å; P242-F271 HydrophobicContact CB-CD2 4.32Å; P242-F271 HydrophobicContact CB-CE1 3.73Å; P242-F271 HydrophobicContact CB-CE2 4.28Å; P242-F271 HydrophobicContact CB-CG 4.07Å; P242-F271 HydrophobicContact CB-CZ 3.98Å; P242-F271 HydrophobicContact CG-CD1 3.57Å; P242-F271 HydrophobicContact CG-CE1 3.4Å; P242-F271 HydrophobicContact CG-CG 4.36Å; P242-F271 HydrophobicContact CG-CZ 4.07Å; A269-F271 HydrophobicContact CB-CD2 4.45Å; A269-F271 HydrophobicContact CB-CE2 3.91Å; F271-P279 HydrophobicContact CB-CB 4.35Å; F271-P279 HydrophobicContact CD1-CB 3.64Å; F271-P279 HydrophobicContact CD2-CB 3.7Å; F271-P279 HydrophobicContact CE1-CB 3.75Å; F271-P279 HydrophobicContact CE2-CB 3.81Å; F271-P279 HydrophobicContact CG-CB 3.63Å; F271-P279 HydrophobicContact CZ-CB 3.84Å; F271-L280 WeakPolarHBondContact CZ-O 3.41Å; F271-I281 HydrophobicContact CE2-CB 4.3Å; F271-I281 HydrophobicContact CZ-CB 4.09Å; F271-E312 WeakPolarHBondContact O-CA 3.47Å; F271-Q313 PolarHBondContact N-O 3.44Å; F271-Q313 PolarHBondContact O-N 3.29Å; F271-V315 HydrophobicContact CD2-CG2 3.7Å; F271-V315 HydrophobicContact CE2-CG2 3.5Å; F271-V336 HydrophobicContact CE2-CG1 4.46Å; F271-V336 HydrophobicContact CZ-CB 4.01Å; F271-V336 HydrophobicContact CZ-CG1 4.26Å
272	G	95.3	Very high	94.7	Very high	7 Å²	7	46 Å²	46	7%	0.072	26%	0.263	C	S	.	.			trans	-70.6	153.3	167.4	0	0	0	0	0	110.9	S274	G272-S274 PolarHBondContact O-N 2.99Å; G272-S274 VanDerWaalsContact O-N 3.12Å; G272-S274 PolarHBondContact O-OG 3.08Å
273	Y	95.2	Very high	94.8	Very high	23 Å²	23	42.1 Å²	42.1	9%	0.09	24%	0.235	C	C	.	.			trans	-55.2	118.7	-173.9	-177	-113.4	0	0	0	111.9	T234 A235 L237 T238 D276	T234-Y273 HydrophobicContact CG2-CD2 4.29Å; T234-Y273 HydrophobicContact CG2-CE1 4.26Å; T234-Y273 HydrophobicContact CG2-CE2 3.85Å; T234-Y273 WeakPolarHBondContact OG1-CE1 3.44Å; A235-Y273 WeakPolarHBondContact O-CD1 3.46Å; L237-Y273 WeakPolarHBondContact CA-O 3.3Å; L237-Y273 HydrophobicContact CD2-CD1 4.23Å; L237-Y273 HydrophobicContact CD2-CE1 4.24Å; T238-Y273 WeakPolarHBondContact CG2-O 3.29Å; T238-Y273 PolarHBondContact N-O 3.44Å; Y273-D276 PolarHBondContact OH-OD1 3.35Å
274	S	93.6	Very high	94.9	Very high	47 Å²	47	42.6 Å²	42.6	33%	0.329	24%	0.237	S	C	.	.			trans	-121.6	26.2	-176.6	-57.1	0	0	0	0	111.5	T238 G272 N338	T238-S274 WeakPolarHBondContact CG2-OG 3.32Å; G272-S274 PolarHBondContact O-N 2.99Å; G272-S274 VanDerWaalsContact O-N 3.12Å; G272-S274 PolarHBondContact O-OG 3.08Å; S274-N338 PolarHBondContact OG-ND2 3.11Å
275	G	90.4	Very high	94.7	Very high	22 Å²	22	41.6 Å²	41.6	23%	0.227	23%	0.229	C	C	.	.	S	Bend	trans	85.8	-173.7	-166.7	0	0	0	0	0	112.5	V277	G275-V277 PolarHBondContact O-N 3.49Å
276	D	87.1	Confident	94.4	Very high	119 Å²	119	43.8 Å²	43.8	64%	0.636	25%	0.252	S	S	*	.	S	Bend	trans	-79.7	52.6	179.9	-63.8	-15.7	0	0	0	111.8	K153 Y273	K153-D276 IonicContact NZ-OD1 2.7Å; K153-D276 PolarHBondContact NZ-OD1 2.94Å; K153-D276 IonicContact NZ-OD2 2.77Å; K153-D276 PolarHBondContact NZ-OD2 3.34Å; Y273-D276 PolarHBondContact OH-OD1 3.35Å
277	V	90.9	Very high	94	Very high	108 Å²	108	50.6 Å²	50.6	66%	0.655	28%	0.281	S	S	*	.			trans	-114.1	132.4	-177.6	-176	0	0	0	0	109.1	G275	G275-V277 PolarHBondContact O-N 3.49Å
278	S	91.5	Very high	93.6	Very high	105 Å²	105	56.2 Å²	56.2	73%	0.734	31%	0.305	S	S	*	.			trans	-60.6	137.9	176.1	-57.9	0	0	0	0	111.4	L280	S278-L280 PolarHBondContact O-N 3Å
279	P	94.2	Very high	93.3	Very high	20 Å²	20	56.1 Å²	56.1	13%	0.13	31%	0.308	C	S	.	.			trans	-68	127.5	-177.5	25.3	-32.2	0	0	0	111.3	F271 I281 V315	F271-P279 HydrophobicContact CB-CB 4.35Å; F271-P279 HydrophobicContact CD1-CB 3.64Å; F271-P279 HydrophobicContact CD2-CB 3.7Å; F271-P279 HydrophobicContact CE1-CB 3.75Å; F271-P279 HydrophobicContact CE2-CB 3.81Å; F271-P279 HydrophobicContact CG-CB 3.63Å; F271-P279 HydrophobicContact CZ-CB 3.84Å; P279-I281 PolarHBondContact O-N 3.47Å; P279-V315 HydrophobicContact CB-CG1 4.45Å; P279-V315 HydrophobicContact CB-CG2 4.36Å; P279-V315 HydrophobicContact CG-CG1 3.76Å; P279-V315 HydrophobicContact CG-CG2 4.36Å
280	L	95.7	Very high	92.9	Very high	92 Å²	92	56.3 Å²	56.3	48%	0.482	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	100.6	-179.1	-175.4	59.6	0	0	0	110.4	F271 S278 Y282 V336 E337	F271-L280 WeakPolarHBondContact CZ-O 3.41Å; S278-L280 PolarHBondContact O-N 3Å; L280-Y282 HydrophobicContact CD1-CD1 3.99Å; L280-Y282 HydrophobicContact CD1-CE1 4.22Å; L280-Y282 HydrophobicContact CD2-CE1 4.4Å; L280-Y282 HydrophobicContact CG-CD1 4.11Å; L280-Y282 HydrophobicContact CG-CE1 3.96Å; L280-V336 WeakPolarHBondContact O-CA 3.41Å; L280-E337 HydrophobicContact CD2-CB 4.1Å; L280-E337 HydrophobicContact CD2-CG 4.39Å; L280-E337 HydrophobicContact CG-CB 4.39Å; L280-E337 PolarHBondContact O-N 3.16Å
281	I	96.7	Very high	92.2	Very high	5 Å²	5	60.3 Å²	60.3	3%	0.026	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	130.6	178.4	-174.2	174.9	0	0	0	109.2	C267 A269 F271 P279 I303 V315 I317 Y335 V336	C267-I281 HydrophobicContact CB-CD1 4.48Å; A269-I281 HydrophobicContact CB-CD1 3.99Å; F271-I281 HydrophobicContact CE2-CB 4.3Å; F271-I281 HydrophobicContact CZ-CB 4.09Å; P279-I281 PolarHBondContact O-N 3.47Å; I281-I303 HydrophobicContact CG2-CD1 3.89Å; I281-I303 HydrophobicContact CG2-CG1 3.97Å; I281-I303 HydrophobicContact CG2-CG2 4Å; I281-V315 HydrophobicContact CD1-CG2 4.19Å; I281-V315 HydrophobicContact CG2-CG2 4.05Å; I281-I317 HydrophobicContact CD1-CG2 3.77Å; I281-I317 HydrophobicContact CG1-CG2 3.65Å; I281-I317 HydrophobicContact CG2-CB 4.43Å; I281-I317 HydrophobicContact CG2-CG2 4.32Å; I281-Y335 WeakPolarHBondContact CA-O 3.43Å; I281-V336 HydrophobicContact CB-CG1 4.29Å; I281-V336 HydrophobicContact CD1-CG1 3.98Å; I281-V336 HydrophobicContact CG1-CG1 3.76Å
282	Y	95.9	Very high	91.5	Very high	34 Å²	34	64.6 Å²	64.6	13%	0.133	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	159	-175.2	56.4	-86.2	0	0	0	111.5	L280 M284 F289 Y335 E337 R342	L280-Y282 HydrophobicContact CD1-CD1 3.99Å; L280-Y282 HydrophobicContact CD1-CE1 4.22Å; L280-Y282 HydrophobicContact CD2-CE1 4.4Å; L280-Y282 HydrophobicContact CG-CD1 4.11Å; L280-Y282 HydrophobicContact CG-CE1 3.96Å; Y282-M284 HydrophobicContact CD2-CG 4.13Å; Y282-M284 HydrophobicContact CD2-SD 4.44Å; Y282-M284 HydrophobicContact CE2-CG 4.07Å; Y282-M284 HydrophobicContact CE2-SD 3.78Å; Y282-F289 HydrophobicContact CD2-CD1 4.25Å; Y282-F289 HydrophobicContact CD2-CE1 4.04Å; Y282-F289 HydrophobicContact CE2-CD1 4.41Å; Y282-F289 AromaticContact CE2-CE1 3.79Å; Y282-F289 HydrophobicContact CE2-CE1 3.79Å; Y282-Y335 HydrophobicContact CE2-CD2 4.18Å; Y282-Y335 AromaticContact CE2-CG 3.99Å; Y282-Y335 HydrophobicContact CE2-CG 3.99Å; Y282-Y335 PolarHBondContact N-O 3.28Å; Y282-Y335 VanDerWaalsContact N-O 3.1Å; Y282-Y335 PolarHBondContact O-N 2.9Å; Y282-E337 PolarHBondContact OH-OE2 3.49Å; Y282-R342 PolarHBondContact OH-NE 2.86Å; Y282-R342 PolarHBondContact OH-NH2 3.04Å
283	W	96	Very high	90.7	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	156	174.1	-74.6	94.6	0	0	0	112.3	L265 C267 I290 E300 I317 L319 S333 C334 V347	L265-W283 HydrophobicContact CB-CH2 3.77Å; L265-W283 HydrophobicContact CB-CZ2 3.77Å; L265-W283 HydrophobicContact CB-CZ3 4.41Å; L265-W283 HydrophobicContact CD1-CZ3 4.43Å; L265-W283 WeakPolarHBondContact O-CZ2 3.36Å; C267-W283 HydrophobicContact CB-CH2 4.36Å; C267-W283 HydrophobicContact CB-CZ2 3.51Å; W283-I290 HydrophobicContact CB-CD1 4.19Å; W283-I290 HydrophobicContact CB-CG1 3.7Å; W283-E300 HydrophobicContact CB-CG 4.35Å; W283-E300 WeakPolarHBondContact CB-OE1 3.39Å; W283-E300 VanDerWaalsContact CD1-OE1 3.29Å; W283-E300 PolarHBondContact N-OE1 3.39Å; W283-I317 PolarHBondContact NE1-O 3.35Å; W283-L319 HydrophobicContact CB-CB 4.4Å; W283-L319 HydrophobicContact CB-CD2 4.28Å; W283-L319 HydrophobicContact CD2-CB 3.99Å; W283-L319 HydrophobicContact CD2-CD2 4.42Å; W283-L319 HydrophobicContact CG-CB 3.8Å; W283-L319 HydrophobicContact CG-CD2 4.34Å; W283-S333 VanDerWaalsContact CE3-C 3.47Å; W283-C334 HydrophobicContact CD2-CB 4.03Å; W283-C334 HydrophobicContact CE3-CB 3.94Å; W283-C334 HydrophobicContact CH2-CB 3.98Å; W283-C334 HydrophobicContact CZ2-CB 4.08Å; W283-C334 HydrophobicContact CZ3-CB 3.91Å; W283-V347 HydrophobicContact CH2-CG2 3.64Å; W283-V347 HydrophobicContact CZ3-CG2 3.98Å
284	M	95.1	Very high	89.6	Confident	13 Å²	13	69.3 Å²	69.3	6%	0.064	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	149.6	169.3	-71.4	172.3	36.7	0	0	110	Y282 G286 K288 F289 Y332 S333 Y335 R342	Y282-M284 HydrophobicContact CD2-CG 4.13Å; Y282-M284 HydrophobicContact CD2-SD 4.44Å; Y282-M284 HydrophobicContact CE2-CG 4.07Å; Y282-M284 HydrophobicContact CE2-SD 3.78Å; M284-G286 VanDerWaalsContact CE-O 3.28Å; M284-G286 WeakPolarHBondContact CE-O 3.5Å; M284-K288 CarbonylContact C-O 3.57Å; M284-K288 VanDerWaalsContact CA-O 3.29Å; M284-K288 WeakPolarHBondContact CA-O 3.47Å; M284-K288 WeakPolarHBondContact CB-O 3.4Å; M284-F289 HydrophobicContact CG-CD1 4.13Å; M284-F289 HydrophobicContact CG-CE1 4.33Å; M284-F289 HydrophobicContact SD-CE1 4.25Å; M284-Y332 WeakPolarHBondContact O-CA 3.32Å; M284-S333 PolarHBondContact N-O 2.94Å; M284-S333 PolarHBondContact O-N 2.88Å; M284-Y335 HydrophobicContact CB-CD2 4.07Å; M284-Y335 HydrophobicContact CB-CE2 3.83Å; M284-Y335 HydrophobicContact CE-CD2 4.39Å; M284-Y335 HydrophobicContact CE-CE2 3.63Å; M284-Y335 HydrophobicContact CG-CD2 3.9Å; M284-Y335 HydrophobicContact CG-CE2 3.96Å; M284-Y335 HydrophobicContact SD-CD2 3.51Å; M284-Y335 VanDerWaalsContact SD-CD2 3.51Å; M284-Y335 HydrophobicContact SD-CE2 3.36Å; M284-Y335 WeakPolarHBondContact SD-CE2 3.35Å; M284-Y335 HydrophobicContact SD-CG 4.25Å; M284-R342 PolarHBondContact SD-NH2 2.97Å
285	K	92.9	Very high	88.5	Confident	49 Å²	49	73.3 Å²	73.3	21%	0.213	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	98.6	172.4	-169.1	-176.4	-176.7	-177.8	0	108.8	E287 K288 I290 L293 G327 D328 Y332	K285-E287 PolarHBondContact O-N 3.16Å; K285-K288 PolarHBondContact N-O 2.91Å; K285-K288 PolarHBondContact O-N 3.14Å; K285-I290 HydrophobicContact CB-CD1 4.34Å; K285-L293 HydrophobicContact CB-CD1 4.2Å; K285-L293 HydrophobicContact CD-CD1 3.9Å; K285-G327 PolarHBondContact NZ-O 3.04Å; K285-D328 IonicContact NZ-OD1 2.69Å; K285-D328 PolarHBondContact NZ-OD1 3.49Å; K285-Y332 HydrophobicContact CB-CD1 3.92Å; K285-Y332 HydrophobicContact CB-CE1 3.85Å; K285-Y332 HydrophobicContact CD-CD1 4.41Å; K285-Y332 HydrophobicContact CD-CE1 3.6Å; K285-Y332 WeakPolarHBondContact CE-OH 3.28Å; K285-Y332 HydrophobicContact CG-CD1 3.96Å; K285-Y332 HydrophobicContact CG-CE1 3.65Å; K285-Y332 PolarHBondContact NZ-OH 2.97Å
286	G	87.3	Confident	87.9	Confident	47 Å²	47	79 Å²	79	49%	0.485	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.6	-115.6	-166.8	0	0	0	0	0	111.2	M284	M284-G286 VanDerWaalsContact CE-O 3.28Å; M284-G286 WeakPolarHBondContact CE-O 3.5Å
287	E	88	Confident	88	Confident	188 Å²	188	75.6 Å²	75.6	88%	0.879	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	-6.1	178.6	-62.3	-175.4	163.5	0	0	113.8	K285	K285-E287 PolarHBondContact O-N 3.16Å
288	K	89.6	Confident	88	Confident	118 Å²	118	70.6 Å²	70.6	51%	0.513	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	143.9	-179.5	-67.4	-170.7	171.8	-163.3	0	112.1	M284 K285 D292 L293	M284-K288 CarbonylContact C-O 3.57Å; M284-K288 VanDerWaalsContact CA-O 3.29Å; M284-K288 WeakPolarHBondContact CA-O 3.47Å; M284-K288 WeakPolarHBondContact CB-O 3.4Å; K285-K288 PolarHBondContact N-O 2.91Å; K285-K288 PolarHBondContact O-N 3.14Å; K288-D292 HydrophobicContact CB-CB 4.37Å; K288-L293 HydrophobicContact CD-CD2 4.22Å
289	F	91.7	Very high	88	Confident	98 Å²	98	70.3 Å²	70.3	43%	0.43	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	161.3	164.2	-65.6	-83.8	0	0	0	109.8	Y282 M284 E291 D292	Y282-F289 HydrophobicContact CD2-CD1 4.25Å; Y282-F289 HydrophobicContact CD2-CE1 4.04Å; Y282-F289 HydrophobicContact CE2-CD1 4.41Å; Y282-F289 AromaticContact CE2-CE1 3.79Å; Y282-F289 HydrophobicContact CE2-CE1 3.79Å; M284-F289 HydrophobicContact CG-CD1 4.13Å; M284-F289 HydrophobicContact CG-CE1 4.33Å; M284-F289 HydrophobicContact SD-CE1 4.25Å; F289-E291 VanDerWaalsContact C-N 3.31Å; F289-D292 PolarHBondContact N-OD2 3.43Å; F289-D292 VanDerWaalsContact N-OD2 3.1Å; F289-D292 WeakPolarHBondContact O-CB 3.18Å; F289-D292 PolarHBondContact O-N 3.18Å
290	I	89.3	Confident	88	Confident	4 Å²	4	71.7 Å²	71.7	2%	0.021	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-70	-33.5	178.1	-58.2	-54.8	0	0	0	111.2	W283 K285 D292 L293 V298 E300 L319 Y332	W283-I290 HydrophobicContact CB-CD1 4.19Å; W283-I290 HydrophobicContact CB-CG1 3.7Å; K285-I290 HydrophobicContact CB-CD1 4.34Å; I290-D292 PolarHBondContact O-N 3.22Å; I290-D292 VanDerWaalsContact O-N 3.16Å; I290-L293 HydrophobicContact CD1-CD1 4.02Å; I290-L293 VanDerWaalsContact O-CB 3.28Å; I290-L293 WeakPolarHBondContact O-CB 3.35Å; I290-L293 PolarHBondContact O-N 3.31Å; I290-V298 HydrophobicContact CG2-CG1 3.94Å; I290-E300 HydrophobicContact CB-CG 3.99Å; I290-E300 HydrophobicContact CG1-CG 3.99Å; I290-E300 HydrophobicContact CG2-CG 4.05Å; I290-L319 HydrophobicContact CB-CD1 4.31Å; I290-L319 HydrophobicContact CD1-CD1 3.9Å; I290-L319 HydrophobicContact CD1-CD2 3.79Å; I290-L319 HydrophobicContact CG1-CD1 3.8Å; I290-L319 HydrophobicContact CG1-CD2 4.39Å; I290-L319 HydrophobicContact CG2-CD1 3.59Å; I290-Y332 HydrophobicContact CD1-CD1 4.36Å; I290-Y332 HydrophobicContact CD1-CE1 4.41Å
291	E	82.9	Confident	87.9	Confident	156 Å²	156	68 Å²	68	73%	0.729	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-59.2	-21.3	172.5	-58.1	177.8	177.1	0	0	113.2	F289 L293	F289-E291 VanDerWaalsContact C-N 3.31Å; E291-L293 VanDerWaalsContact C-N 3.27Å; E291-L293 PolarHBondContact O-N 2.78Å
292	D	83	Confident	87.7	Confident	101 Å²	101	74.6 Å²	74.6	54%	0.54	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-83.2	2.5	174.1	-60.5	-52	0	0	0	113.5	K288 F289 I290	K288-D292 HydrophobicContact CB-CB 4.37Å; F289-D292 PolarHBondContact N-OD2 3.43Å; F289-D292 VanDerWaalsContact N-OD2 3.1Å; F289-D292 WeakPolarHBondContact O-CB 3.18Å; F289-D292 PolarHBondContact O-N 3.18Å; I290-D292 PolarHBondContact O-N 3.22Å; I290-D292 VanDerWaalsContact O-N 3.16Å
293	L	77.6	Confident	87.7	Confident	42 Å²	42	76.6 Å²	76.6	22%	0.22	38%	0.38	C	S	.	.	S	Bend	trans	-104.7	-179.4	178.1	-54.8	177.5	0	0	0	110.5	K285 K288 I290 E291 E295 V298	K285-L293 HydrophobicContact CB-CD1 4.2Å; K285-L293 HydrophobicContact CD-CD1 3.9Å; K288-L293 HydrophobicContact CD-CD2 4.22Å; I290-L293 HydrophobicContact CD1-CD1 4.02Å; I290-L293 VanDerWaalsContact O-CB 3.28Å; I290-L293 WeakPolarHBondContact O-CB 3.35Å; I290-L293 PolarHBondContact O-N 3.31Å; E291-L293 VanDerWaalsContact C-N 3.27Å; E291-L293 PolarHBondContact O-N 2.78Å; L293-E295 PolarHBondContact O-N 3.34Å; L293-V298 HydrophobicContact CD1-CG1 4.15Å
294	D	72.3	Confident	87.7	Confident	88 Å²	88	84.6 Å²	84.6	47%	0.471	41%	0.411	S	S	.	.			trans	-73.5	96.3	175.6	-173.5	-2	0	0	0	110.3	N296 R297 V298	D294-N296 PolarHBondContact O-N 2.98Å; D294-N296 WeakPolarHBondContact OD1-CB 3.5Å; D294-N296 PolarHBondContact OD1-N 2.94Å; D294-N296 PolarHBondContact OD1-ND2 3.24Å; D294-R297 PolarHBondContact O-N 2.77Å; D294-V298 PolarHBondContact O-N 3.26Å
295	E	69.5	Low	87.7	Confident	131 Å²	131	88.3 Å²	88.3	61%	0.612	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.5	-29.4	-179.5	-64.1	-178.1	165.5	0	0	113.3	L293 R297	L293-E295 PolarHBondContact O-N 3.34Å; E295-R297 PolarHBondContact O-N 3.24Å
296	N	79.6	Confident	87.8	Confident	142 Å²	142	89.7 Å²	89.7	76%	0.759	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	-15.5	-178.7	-57.1	-77.1	0	0	0	113.4	D294	D294-N296 PolarHBondContact O-N 2.98Å; D294-N296 WeakPolarHBondContact OD1-CB 3.5Å; D294-N296 PolarHBondContact OD1-N 2.94Å; D294-N296 PolarHBondContact OD1-ND2 3.24Å
297	R	88.2	Confident	88.2	Confident	46 Å²	46	94 Å²	94	17%	0.174	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.2	-27.6	-172.4	-160.5	-176.4	59.7	66.2	-1.1	113	D294 E295 V321 D322 S323 E325 D328	D294-R297 PolarHBondContact O-N 2.77Å; E295-R297 PolarHBondContact O-N 3.24Å; R297-V321 WeakPolarHBondContact O-CA 3.36Å; R297-D322 PolarHBondContact O-N 2.88Å; R297-S323 PolarHBondContact NH1-O 2.91Å; R297-E325 IonicContact NE-OE1 2.64Å; R297-E325 IonicContact NH2-OE2 2.66Å; R297-D328 IonicContact CZ-OD1 3.59Å; R297-D328 IonicContact CZ-OD2 2.66Å; R297-D328 VanDerWaalsContact CZ-OD2 3.25Å; R297-D328 IonicContact NH1-OD1 2.7Å; R297-D328 IonicContact NH1-OD2 3.37Å; R297-D328 PolarHBondContact NH1-OD2 2.78Å; R297-D328 IonicContact NH2-OD1 3.17Å; R297-D328 PolarHBondContact NH2-OD1 3.39Å; R297-D328 IonicContact NH2-OD2 3.44Å; R297-D328 PolarHBondContact NH2-OD2 2.85Å; R297-D328 VanDerWaalsContact NH2-OD2 3.14Å
298	V	91.1	Very high	88.5	Confident	3 Å²	3	90.5 Å²	90.5	2%	0.018	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	114.1	178.1	-173.4	0	0	0	0	109.2	I290 L293 D294 L319 I320 V321	I290-V298 HydrophobicContact CG2-CG1 3.94Å; L293-V298 HydrophobicContact CD1-CG1 4.15Å; D294-V298 PolarHBondContact O-N 3.26Å; V298-L319 HydrophobicContact CG1-CD1 3.72Å; V298-L319 HydrophobicContact CG1-CG 4.42Å; V298-I320 WeakPolarHBondContact CA-O 3.29Å; V298-V321 HydrophobicContact CG1-CG2 4.14Å; V298-V321 HydrophobicContact CG2-CG1 4.23Å; V298-V321 HydrophobicContact CG2-CG2 4.19Å
299	W	91.8	Very high	88.7	Confident	100 Å²	100	90 Å²	90	38%	0.379	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	152.1	-174.7	56.1	-86.5	0	0	0	112.7	I320 D322	W299-I320 HydrophobicContact CD2-CB 4.21Å; W299-I320 HydrophobicContact CE3-CD1 4.41Å; W299-I320 HydrophobicContact CH2-CB 4.48Å; W299-I320 HydrophobicContact CH2-CD1 3.39Å; W299-I320 HydrophobicContact CZ2-CB 4.01Å; W299-I320 HydrophobicContact CZ2-CD1 3.69Å; W299-I320 HydrophobicContact CZ2-CG1 4.45Å; W299-I320 HydrophobicContact CZ2-CG2 3.8Å; W299-I320 HydrophobicContact CZ3-CD1 3.79Å; W299-I320 PolarHBondContact N-O 3.36Å; W299-I320 PolarHBondContact O-N 3.15Å; W299-D322 PolarHBondContact NE1-OD2 3.3Å
300	E	93.7	Very high	88.7	Confident	49 Å²	49	86.8 Å²	86.8	23%	0.229	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	137.1	174.3	-62.9	-170.7	74	0	0	110.7	W283 I290 I317 S318 L319	W283-E300 HydrophobicContact CB-CG 4.35Å; W283-E300 WeakPolarHBondContact CB-OE1 3.39Å; W283-E300 VanDerWaalsContact CD1-OE1 3.29Å; W283-E300 PolarHBondContact N-OE1 3.39Å; I290-E300 HydrophobicContact CB-CG 3.99Å; I290-E300 HydrophobicContact CG1-CG 3.99Å; I290-E300 HydrophobicContact CG2-CG 4.05Å; E300-I317 HydrophobicContact CB-CD1 4.15Å; E300-I317 HydrophobicContact CB-CG1 4.46Å; E300-I317 WeakPolarHBondContact OE1-CD1 3.43Å; E300-S318 WeakPolarHBondContact CA-O 3.47Å; E300-L319 HydrophobicContact CG-CD1 4.03Å
301	S	93	Very high	88.8	Confident	13 Å²	13	87.5 Å²	87.5	9%	0.091	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-69.3	157.3	172.2	75	0	0	0	0	111.5	I317 S318	S301-I317 VanDerWaalsContact O-CG1 3.26Å; S301-I317 WeakPolarHBondContact O-CG1 3.29Å; S301-S318 PolarHBondContact N-O 3.02Å; S301-S318 PolarHBondContact OG-N 2.96Å
302	D	93.6	Very high	89.4	Confident	145 Å²	145	83.1 Å²	83.1	78%	0.775	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-50.3	144.4	164.6	-61	-56.2	0	0	0	112.1	R304	D302-R304 PolarHBondContact O-N 3.25Å
303	I	95.5	Very high	90	Very high	76 Å²	76	79.8 Å²	79.8	39%	0.39	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-66.3	117.5	176	-59.7	169.2	0	0	0	109.1	I281 V315 I317	I281-I303 HydrophobicContact CG2-CD1 3.89Å; I281-I303 HydrophobicContact CG2-CG1 3.97Å; I281-I303 HydrophobicContact CG2-CG2 4Å; I303-V315 HydrophobicContact CG2-CB 4.05Å; I303-V315 HydrophobicContact CG2-CG1 4.39Å; I303-V315 HydrophobicContact CG2-CG2 4.43Å; I303-I317 HydrophobicContact CG1-CD1 4Å; I303-I317 HydrophobicContact CG1-CG1 4.49Å
304	R	95.8	Very high	91	Very high	168 Å²	168	78.9 Å²	78.9	63%	0.634	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.1	118.6	179.4	-63.4	-178.1	-178.5	-178.1	0.3	110.7	D302 L306 V315 S316	D302-R304 PolarHBondContact O-N 3.25Å; R304-L306 PolarHBondContact O-N 2.82Å; R304-V315 CarbonylContact O-C 3.55Å; R304-V315 VanDerWaalsContact O-CA 3.31Å; R304-V315 WeakPolarHBondContact O-CA 3.36Å; R304-S316 PolarHBondContact N-O 2.92Å; R304-S316 PolarHBondContact O-N 2.99Å
305	I	95.3	Very high	92.2	Very high	91 Å²	91	74.7 Å²	74.7	47%	0.467	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	111.4	168	-55.9	175.2	0	0	0	107.9	E308 V315	I305-E308 HydrophobicContact CG2-CB 4.11Å; I305-V315 HydrophobicContact CG1-CG1 4.13Å
306	L	95.3	Very high	93.5	Very high	78 Å²	78	69 Å²	69	41%	0.408	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	-38	178	-60	-176.4	0	0	0	111.5	R268 R304 E314	R268-L306 HydrophobicContact CG-CD1 4.03Å; R304-L306 PolarHBondContact O-N 2.82Å; L306-E314 WeakPolarHBondContact CA-O 3.27Å; L306-E314 WeakPolarHBondContact CB-O 3.28Å; L306-E314 PolarHBondContact N-O 3.42Å
307	K	95.1	Very high	94.3	Very high	136 Å²	136	62.6 Å²	62.6	59%	0.591	30%	0.296	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-150.2	145.6	176.5	-60.9	-179.6	-172.1	154.9	0	109.8	Q313 E314	K307-Q313 WeakPolarHBondContact O-CA 3.44Å; K307-E314 HydrophobicContact CB-CB 4.09Å; K307-E314 PolarHBondContact N-O 3.02Å; K307-E314 IonicContact NZ-OE2 2.68Å; K307-E314 PolarHBondContact NZ-OE2 3.46Å; K307-E314 PolarHBondContact O-N 2.85Å
308	E	94	Very high	94.7	Very high	116 Å²	116	61.1 Å²	61.1	54%	0.542	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	134.5	169	178.9	168.3	-139.8	0	0	109	I305 E312 Q313	I305-E308 HydrophobicContact CG2-CB 4.11Å; E308-E312 WeakPolarHBondContact CA-O 3.36Å; E308-Q313 HydrophobicContact CB-CG 4.3Å; E308-Q313 HydrophobicContact CG-CG 3.99Å; E308-Q313 PolarHBondContact OE1-NE2 2.85Å
309	H	93.8	Very high	94.9	Very high	108 Å²	108	61 Å²	61	50%	0.5	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	129.9	176	-179.5	66.6	0	0	0	109	E208 G311 E312	E208-H309 IonicContact OE1-CE1 2.84Å; E208-H309 PolarHBondContact OE1-CE1 3.42Å; E208-H309 VanDerWaalsContact OE1-CE1 3.28Å; E208-H309 IonicContact OE1-NE2 2.76Å; H309-G311 PolarHBondContact O-N 3.4Å; H309-E312 PolarHBondContact N-O 2.64Å; H309-E312 WeakPolarHBondContact O-CB 3.5Å; H309-E312 PolarHBondContact O-N 3.14Å
310	L	92.8	Very high	95	Very high	29 Å²	29	57.4 Å²	57.4	15%	0.152	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.3	29	-176.2	-61.6	162.4	0	0	0	113.5	L156 E208 I211 V233 T234 A235 E312	L156-L310 HydrophobicContact CD1-CD1 3.72Å; L156-L310 HydrophobicContact CD1-CD2 4.16Å; L156-L310 HydrophobicContact CD1-CG 4.48Å; E208-L310 HydrophobicContact CG-CD2 4.35Å; I211-L310 HydrophobicContact CD1-CD2 4.47Å; V233-L310 HydrophobicContact CG1-CD2 4.33Å; T234-L310 CarbonylContact C-O 3.58Å; T234-L310 WeakPolarHBondContact CA-O 3.28Å; T234-L310 WeakPolarHBondContact CB-O 3.49Å; A235-L310 PolarHBondContact N-O 2.93Å; L310-E312 PolarHBondContact O-N 3.46Å
311	G	91.5	Very high	95	Very high	20 Å²	20	55.1 Å²	55.1	21%	0.206	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.2	2	-175.6	0	0	0	0	0	115.3	H309	H309-G311 PolarHBondContact O-N 3.4Å
312	E	95	Very high	95	Very high	63 Å²	63	58.3 Å²	58.3	29%	0.294	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	136.8	164.1	-53.4	-166.4	119.1	0	0	109.3	A235 F270 F271 E308 H309 L310	A235-E312 HydrophobicContact CB-CG 3.62Å; F270-E312 HydrophobicContact CE2-CB 4.03Å; F270-E312 HydrophobicContact CZ-CB 3.83Å; F270-E312 HydrophobicContact CZ-CG 4.3Å; F271-E312 WeakPolarHBondContact O-CA 3.47Å; E308-E312 WeakPolarHBondContact CA-O 3.36Å; H309-E312 PolarHBondContact N-O 2.64Å; H309-E312 WeakPolarHBondContact O-CB 3.5Å; H309-E312 PolarHBondContact O-N 3.14Å; L310-E312 PolarHBondContact O-N 3.46Å
313	Q	96.1	Very high	94.9	Very high	32 Å²	32	53.8 Å²	53.8	15%	0.15	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	128.1	-170.3	-65.6	-179.9	-2.4	0	0	111.6	F271 K307 E308 V315	F271-Q313 PolarHBondContact N-O 3.44Å; F271-Q313 PolarHBondContact O-N 3.29Å; K307-Q313 WeakPolarHBondContact O-CA 3.44Å; E308-Q313 HydrophobicContact CB-CG 4.3Å; E308-Q313 HydrophobicContact CG-CG 3.99Å; E308-Q313 PolarHBondContact OE1-NE2 2.85Å; Q313-V315 HydrophobicContact CB-CG1 4.08Å
314	E	97.3	Very high	94.7	Very high	22 Å²	22	50.3 Å²	50.3	10%	0.103	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	115.6	163.4	-166.3	-170.3	156.1	0	0	107.7	L245 R268 A269 L306 K307	L245-E314 HydrophobicContact CD1-CG 3.92Å; R268-E314 IonicContact CZ-OE1 2.72Å; R268-E314 IonicContact NE-OE1 3.38Å; R268-E314 PolarHBondContact NE-OE1 2.96Å; R268-E314 IonicContact NH2-OE1 3.82Å; R268-E314 PolarHBondContact NH2-OE1 2.66Å; A269-E314 WeakPolarHBondContact O-CA 3.23Å; L306-E314 WeakPolarHBondContact CA-O 3.27Å; L306-E314 WeakPolarHBondContact CB-O 3.28Å; L306-E314 PolarHBondContact N-O 3.42Å; K307-E314 HydrophobicContact CB-CB 4.09Å; K307-E314 PolarHBondContact N-O 3.02Å; K307-E314 IonicContact NZ-OE2 2.68Å; K307-E314 PolarHBondContact NZ-OE2 3.46Å; K307-E314 PolarHBondContact O-N 2.85Å
315	V	97.3	Very high	94.4	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	158.6	-176.1	-57.4	0	0	0	0	112.6	R268 A269 F271 P279 I281 I303 R304 I305 Q313	R268-V315 WeakPolarHBondContact CA-O 3.37Å; A269-V315 PolarHBondContact N-O 2.95Å; A269-V315 PolarHBondContact O-N 3.14Å; F271-V315 HydrophobicContact CD2-CG2 3.7Å; F271-V315 HydrophobicContact CE2-CG2 3.5Å; P279-V315 HydrophobicContact CB-CG1 4.45Å; P279-V315 HydrophobicContact CB-CG2 4.36Å; P279-V315 HydrophobicContact CG-CG1 3.76Å; P279-V315 HydrophobicContact CG-CG2 4.36Å; I281-V315 HydrophobicContact CD1-CG2 4.19Å; I281-V315 HydrophobicContact CG2-CG2 4.05Å; I303-V315 HydrophobicContact CG2-CB 4.05Å; I303-V315 HydrophobicContact CG2-CG1 4.39Å; I303-V315 HydrophobicContact CG2-CG2 4.43Å; R304-V315 CarbonylContact O-C 3.55Å; R304-V315 VanDerWaalsContact O-CA 3.31Å; R304-V315 WeakPolarHBondContact O-CA 3.36Å; I305-V315 HydrophobicContact CG1-CG1 4.13Å; Q313-V315 HydrophobicContact CB-CG1 4.08Å
316	S	97.5	Very high	94.2	Very high	11 Å²	11	50 Å²	50	8%	0.077	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	137.5	179.2	-158.9	0	0	0	0	111.5	T266 C267 R268 R304	T266-S316 VanDerWaalsContact CG2-OG 3.31Å; T266-S316 WeakPolarHBondContact CG2-OG 3.43Å; C267-S316 CarbonylContact O-C 3.51Å; C267-S316 WeakPolarHBondContact O-CA 3.35Å; C267-S316 PolarHBondContact O-OG 3.4Å; R268-S316 WeakPolarHBondContact CG-OG 3.42Å; R304-S316 PolarHBondContact N-O 2.92Å; R304-S316 PolarHBondContact O-N 2.99Å
317	I	97.4	Very high	93.8	Very high	8 Å²	8	49 Å²	49	4%	0.041	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	136	170.1	-164.1	172.4	0	0	0	109.3	C267 I281 W283 E300 S301 I303	C267-I317 HydrophobicContact CB-CG2 4.05Å; C267-I317 PolarHBondContact N-O 2.86Å; C267-I317 PolarHBondContact O-N 2.99Å; I281-I317 HydrophobicContact CD1-CG2 3.77Å; I281-I317 HydrophobicContact CG1-CG2 3.65Å; I281-I317 HydrophobicContact CG2-CB 4.43Å; I281-I317 HydrophobicContact CG2-CG2 4.32Å; W283-I317 PolarHBondContact NE1-O 3.35Å; E300-I317 HydrophobicContact CB-CD1 4.15Å; E300-I317 HydrophobicContact CB-CG1 4.46Å; E300-I317 WeakPolarHBondContact OE1-CD1 3.43Å; S301-I317 VanDerWaalsContact O-CG1 3.26Å; S301-I317 WeakPolarHBondContact O-CG1 3.29Å; I303-I317 HydrophobicContact CG1-CD1 4Å; I303-I317 HydrophobicContact CG1-CG1 4.49Å
318	S	96.1	Very high	93.6	Very high	16 Å²	16	42.6 Å²	42.6	11%	0.112	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	127.3	-179.3	-78.3	0	0	0	0	110.8	N264 L265 T266 E300 S301	N264-S318 VanDerWaalsContact OD1-CB 3.32Å; N264-S318 WeakPolarHBondContact OD1-CB 3.49Å; N264-S318 PolarHBondContact OD1-OG 3.44Å; N264-S318 VanDerWaalsContact OD1-OG 3.07Å; L265-S318 CarbonylContact O-C 3.6Å; L265-S318 WeakPolarHBondContact O-CA 3.46Å; T266-S318 PolarHBondContact OG1-OG 2.92Å; T266-S318 VanDerWaalsContact OG1-OG 3.08Å; E300-S318 WeakPolarHBondContact CA-O 3.47Å; S301-S318 PolarHBondContact N-O 3.02Å; S301-S318 PolarHBondContact OG-N 2.96Å
319	L	95.3	Very high	93.5	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	124.9	164.5	179.7	61.8	0	0	0	108.9	N264 L265 W283 I290 V298 E300 Y332	N264-L319 CarbonylContact C-O 3.58Å; N264-L319 WeakPolarHBondContact CA-O 3.46Å; L265-L319 HydrophobicContact CB-CB 4.25Å; L265-L319 HydrophobicContact CD1-CD2 4.24Å; L265-L319 PolarHBondContact N-O 3.47Å; L265-L319 PolarHBondContact O-N 3Å; W283-L319 HydrophobicContact CB-CB 4.4Å; W283-L319 HydrophobicContact CB-CD2 4.28Å; W283-L319 HydrophobicContact CD2-CB 3.99Å; W283-L319 HydrophobicContact CD2-CD2 4.42Å; W283-L319 HydrophobicContact CG-CB 3.8Å; W283-L319 HydrophobicContact CG-CD2 4.34Å; I290-L319 HydrophobicContact CB-CD1 4.31Å; I290-L319 HydrophobicContact CD1-CD1 3.9Å; I290-L319 HydrophobicContact CD1-CD2 3.79Å; I290-L319 HydrophobicContact CG1-CD1 3.8Å; I290-L319 HydrophobicContact CG1-CD2 4.39Å; I290-L319 HydrophobicContact CG2-CD1 3.59Å; V298-L319 HydrophobicContact CG1-CD1 3.72Å; V298-L319 HydrophobicContact CG1-CG 4.42Å; E300-L319 HydrophobicContact CG-CD1 4.03Å; L319-Y332 HydrophobicContact CD2-CD1 3.18Å; L319-Y332 HydrophobicContact CD2-CE1 3.47Å; L319-Y332 VanDerWaalsContact CD2-CE1 3.47Å; L319-Y332 HydrophobicContact CD2-CG 3.95Å
320	I	94.3	Very high	93.4	Very high	25 Å²	25	35.3 Å²	35.3	13%	0.128	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	129.9	-178.9	-66	165	0	0	0	108.7	A263 N264 V298 W299	A263-I320 WeakPolarHBondContact O-CA 3.39Å; N264-I320 HydrophobicContact CB-CG1 4.39Å; V298-I320 WeakPolarHBondContact CA-O 3.29Å; W299-I320 HydrophobicContact CD2-CB 4.21Å; W299-I320 HydrophobicContact CE3-CD1 4.41Å; W299-I320 HydrophobicContact CH2-CB 4.48Å; W299-I320 HydrophobicContact CH2-CD1 3.39Å; W299-I320 HydrophobicContact CZ2-CB 4.01Å; W299-I320 HydrophobicContact CZ2-CD1 3.69Å; W299-I320 HydrophobicContact CZ2-CG1 4.45Å; W299-I320 HydrophobicContact CZ2-CG2 3.8Å; W299-I320 HydrophobicContact CZ3-CD1 3.79Å; W299-I320 PolarHBondContact N-O 3.36Å; W299-I320 PolarHBondContact O-N 3.15Å
321	V	93.7	Very high	93.4	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	107.4	171.9	-178	0	0	0	0	106.3	S262 A263 R297 V298 S323 V324	S262-V321 CarbonylContact C-O 3.49Å; S262-V321 WeakPolarHBondContact CA-O 3.35Å; S262-V321 WeakPolarHBondContact CB-O 3.42Å; A263-V321 HydrophobicContact CB-CB 4.39Å; A263-V321 PolarHBondContact N-O 3.25Å; A263-V321 PolarHBondContact O-N 3.49Å; R297-V321 WeakPolarHBondContact O-CA 3.36Å; V298-V321 HydrophobicContact CG1-CG2 4.14Å; V298-V321 HydrophobicContact CG2-CG1 4.23Å; V298-V321 HydrophobicContact CG2-CG2 4.19Å; V321-S323 PolarHBondContact O-N 2.84Å; V321-V324 HydrophobicContact CB-CG2 4.1Å; V321-V324 HydrophobicContact CG1-CB 4.39Å; V321-V324 HydrophobicContact CG1-CG2 3.69Å
322	D	91.6	Very high	93.6	Very high	80 Å²	80	37 Å²	37	43%	0.428	21%	0.21	S	C	.	.	S	Bend	trans	-72.8	-28.9	-170	-78.5	-47.3	0	0	0	113.5	S262 R297 W299	S262-D322 WeakPolarHBondContact CB-O 3.41Å; R297-D322 PolarHBondContact O-N 2.88Å; W299-D322 PolarHBondContact NE1-OD2 3.3Å
323	S	91.3	Very high	93.6	Very high	51 Å²	51	34.4 Å²	34.4	36%	0.357	20%	0.2	S	C	.	.	S	Bend	trans	-145	118.8	168.2	-161.1	0	0	0	0	108.9	G260 R297 V321	G260-S323 WeakPolarHBondContact CA-OG 3.46Å; G260-S323 PolarHBondContact O-OG 3.39Å; R297-S323 PolarHBondContact NH1-O 2.91Å; V321-S323 PolarHBondContact O-N 2.84Å
324	V	91.4	Very high	93.6	Very high	3 Å²	3	32.9 Å²	32.9	2%	0.018	19%	0.192	C	C	.	.			trans	-81.6	120.9	-173.3	175.7	0	0	0	0	111	T257 L259 G260 D261 A263 V321 D328 L329 L349	T257-V324 HydrophobicContact CG2-CB 4.23Å; T257-V324 HydrophobicContact CG2-CG1 3.8Å; T257-V324 HydrophobicContact CG2-CG2 4.02Å; L259-V324 WeakPolarHBondContact CA-O 3.17Å; L259-V324 HydrophobicContact CD2-CG1 4.39Å; G260-V324 PolarHBondContact N-O 3.22Å; D261-V324 VanDerWaalsContact O-CG2 3.29Å; D261-V324 WeakPolarHBondContact O-CG2 3.32Å; D261-V324 PolarHBondContact O-N 3.27Å; A263-V324 HydrophobicContact CB-CG2 3.67Å; V321-V324 HydrophobicContact CB-CG2 4.1Å; V321-V324 HydrophobicContact CG1-CB 4.39Å; V321-V324 HydrophobicContact CG1-CG2 3.69Å; V324-D328 HydrophobicContact CG1-CB 4.14Å; V324-L329 HydrophobicContact CG1-CD2 4.18Å; V324-L349 HydrophobicContact CG1-CD2 4.14Å; V324-L349 HydrophobicContact CG2-CD2 4.41Å
325	E	91.2	Very high	93.6	Very high	110 Å²	110	33.3 Å²	33.3	51%	0.514	19%	0.193	S	C	.	.			trans	-97.1	166.1	172.4	-62.4	-176.9	170.3	0	0	111.4	R297 G327 D328	R297-E325 IonicContact NE-OE1 2.64Å; R297-E325 IonicContact NH2-OE2 2.66Å; E325-G327 PolarHBondContact O-N 3.45Å; E325-D328 PolarHBondContact N-OD2 2.9Å; E325-D328 WeakPolarHBondContact O-CB 3.42Å; E325-D328 PolarHBondContact O-N 3.46Å
326	E	89.6	Confident	93.6	Very high	142 Å²	142	33.3 Å²	33.3	66%	0.664	19%	0.193	S	C	*	.	G	3₁₀ helix	trans	-63.1	-28.6	176.8	-172.5	160	-134.6	0	0	112.3	L259 D328 L329	L259-E326 HydrophobicContact CD2-CB 4.43Å; E326-D328 PolarHBondContact O-N 3.12Å; E326-L329 HydrophobicContact CG-CD1 4.44Å; E326-L329 PolarHBondContact O-N 2.77Å
327	G	88.5	Confident	93.5	Very high	57 Å²	57	35.9 Å²	35.9	59%	0.588	20%	0.204	S	C	*	.	G	3₁₀ helix	trans	-71.3	-8.9	172.4	0	0	0	0	0	115	K285 E325	K285-G327 PolarHBondContact NZ-O 3.04Å; E325-G327 PolarHBondContact O-N 3.45Å
328	D	90	Very high	93.4	Very high	2 Å²	2	36.6 Å²	36.6	1%	0.011	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-87.7	-25.1	174.2	-62.1	-45.7	0	0	0	113.9	K285 R297 V324 E325 E326 G330 Y332 L349	K285-D328 IonicContact NZ-OD1 2.69Å; K285-D328 PolarHBondContact NZ-OD1 3.49Å; R297-D328 IonicContact CZ-OD1 3.59Å; R297-D328 IonicContact CZ-OD2 2.66Å; R297-D328 VanDerWaalsContact CZ-OD2 3.25Å; R297-D328 IonicContact NH1-OD1 2.7Å; R297-D328 IonicContact NH1-OD2 3.37Å; R297-D328 PolarHBondContact NH1-OD2 2.78Å; R297-D328 IonicContact NH2-OD1 3.17Å; R297-D328 PolarHBondContact NH2-OD1 3.39Å; R297-D328 IonicContact NH2-OD2 3.44Å; R297-D328 PolarHBondContact NH2-OD2 2.85Å; R297-D328 VanDerWaalsContact NH2-OD2 3.14Å; V324-D328 HydrophobicContact CG1-CB 4.14Å; E325-D328 PolarHBondContact N-OD2 2.9Å; E325-D328 WeakPolarHBondContact O-CB 3.42Å; E325-D328 PolarHBondContact O-N 3.46Å; E326-D328 PolarHBondContact O-N 3.12Å; D328-G330 PolarHBondContact O-N 3.46Å; D328-Y332 WeakPolarHBondContact O-CE2 3.34Å; D328-Y332 PolarHBondContact O-OH 3.06Å; D328-L349 HydrophobicContact CB-CD2 4.28Å
329	L	91.4	Very high	93.3	Very high	47 Å²	47	39.9 Å²	39.9	25%	0.246	25%	0.245	C	C	.	.			trans	-60.5	131.6	179.4	-55	178.7	0	0	0	110.1	V324 E326 L349 K351	V324-L329 HydrophobicContact CG1-CD2 4.18Å; E326-L329 HydrophobicContact CG-CD1 4.44Å; E326-L329 PolarHBondContact O-N 2.77Å; L329-L349 HydrophobicContact CD2-CG 4.29Å; L329-K351 HydrophobicContact CD1-CB 3.89Å; L329-K351 HydrophobicContact CD2-CB 4.43Å
330	G	91.9	Very high	93.2	Very high	23 Å²	23	43.7 Å²	43.7	24%	0.237	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	145.9	-168.6	-174.8	0	0	0	0	0	114.3	D328 L349	D328-G330 PolarHBondContact O-N 3.46Å; G330-L349 PolarHBondContact N-O 2.91Å; G330-L349 VanDerWaalsContact N-O 3.15Å; G330-L349 PolarHBondContact O-N 3.45Å
331	N	93.4	Very high	93.3	Very high	84 Å²	84	43.7 Å²	43.7	45%	0.449	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	113.5	-175	-67.3	-28.5	0	0	0	111.5	V347 L348	N331-V347 WeakPolarHBondContact CA-O 3.46Å; N331-L348 WeakPolarHBondContact OD1-CD1 3.18Å
332	Y	94.6	Very high	93.4	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	134.7	165	-68.2	-89.9	0	0	0	108.7	L265 M284 K285 I290 L319 D328 S346 V347 L349	L265-Y332 HydrophobicContact CD1-CD1 4.39Å; L265-Y332 HydrophobicContact CD1-CD2 3.64Å; L265-Y332 HydrophobicContact CD1-CE2 4.4Å; L265-Y332 HydrophobicContact CD1-CG 3.62Å; M284-Y332 WeakPolarHBondContact O-CA 3.32Å; K285-Y332 HydrophobicContact CB-CD1 3.92Å; K285-Y332 HydrophobicContact CB-CE1 3.85Å; K285-Y332 HydrophobicContact CD-CD1 4.41Å; K285-Y332 HydrophobicContact CD-CE1 3.6Å; K285-Y332 WeakPolarHBondContact CE-OH 3.28Å; K285-Y332 HydrophobicContact CG-CD1 3.96Å; K285-Y332 HydrophobicContact CG-CE1 3.65Å; K285-Y332 PolarHBondContact NZ-OH 2.97Å; I290-Y332 HydrophobicContact CD1-CD1 4.36Å; I290-Y332 HydrophobicContact CD1-CE1 4.41Å; L319-Y332 HydrophobicContact CD2-CD1 3.18Å; L319-Y332 HydrophobicContact CD2-CE1 3.47Å; L319-Y332 VanDerWaalsContact CD2-CE1 3.47Å; L319-Y332 HydrophobicContact CD2-CG 3.95Å; D328-Y332 WeakPolarHBondContact O-CE2 3.34Å; D328-Y332 PolarHBondContact O-OH 3.06Å; Y332-S346 CarbonylContact O-C 3.47Å; Y332-S346 VanDerWaalsContact O-CA 3.28Å; Y332-S346 WeakPolarHBondContact O-CA 3.45Å; Y332-V347 PolarHBondContact N-O 3.3Å; Y332-V347 PolarHBondContact O-N 3.04Å; Y332-L349 HydrophobicContact CD2-CB 4.15Å; Y332-L349 HydrophobicContact CE2-CB 4.04Å; Y332-L349 HydrophobicContact CE2-CD2 3.98Å
333	S	95.9	Very high	93.6	Very high	10 Å²	10	49.5 Å²	49.5	7%	0.07	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	123.3	-179.5	-59.1	0	0	0	0	110.3	W283 M284 Y335 A345 S346	W283-S333 VanDerWaalsContact CE3-C 3.47Å; M284-S333 PolarHBondContact N-O 2.94Å; M284-S333 PolarHBondContact O-N 2.88Å; S333-Y335 WeakPolarHBondContact O-CD2 3.13Å; S333-A345 WeakPolarHBondContact CA-O 3.45Å; S333-S346 PolarHBondContact OG-OG 3.38Å
334	C	96.7	Very high	93.8	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	132.9	169	179.2	0	0	0	0	108.6	C267 W283 H344 A345	C267-C334 HydrophobicContact CB-CB 3.61Å; C267-C334 WeakPolarHBondContact CB-SG 3.38Å; C267-C334 WeakPolarHBondContact SG-CB 3.44Å; C267-C334 CovalentContact SG-SG 2.02Å; C267-C334 PolarHBondContact SG-SG 2.94Å; W283-C334 HydrophobicContact CD2-CB 4.03Å; W283-C334 HydrophobicContact CE3-CB 3.94Å; W283-C334 HydrophobicContact CH2-CB 3.98Å; W283-C334 HydrophobicContact CZ2-CB 4.08Å; W283-C334 HydrophobicContact CZ3-CB 3.91Å; C334-H344 WeakPolarHBondContact O-CA 3.45Å; C334-H344 WeakPolarHBondContact O-CB 3.44Å; C334-A345 PolarHBondContact N-O 3.1Å; C334-A345 PolarHBondContact O-N 2.98Å; C334-A345 VanDerWaalsContact O-N 3.08Å
335	Y	96.4	Very high	94	Very high	31 Å²	31	51.7 Å²	51.7	12%	0.122	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	140.8	176.7	-75.6	-89.4	0	0	0	110.4	I281 Y282 M284 S333 R342 R343 H344	I281-Y335 WeakPolarHBondContact CA-O 3.43Å; Y282-Y335 HydrophobicContact CE2-CD2 4.18Å; Y282-Y335 AromaticContact CE2-CG 3.99Å; Y282-Y335 HydrophobicContact CE2-CG 3.99Å; Y282-Y335 PolarHBondContact N-O 3.28Å; Y282-Y335 VanDerWaalsContact N-O 3.1Å; Y282-Y335 PolarHBondContact O-N 2.9Å; M284-Y335 HydrophobicContact CB-CD2 4.07Å; M284-Y335 HydrophobicContact CB-CE2 3.83Å; M284-Y335 HydrophobicContact CE-CD2 4.39Å; M284-Y335 HydrophobicContact CE-CE2 3.63Å; M284-Y335 HydrophobicContact CG-CD2 3.9Å; M284-Y335 HydrophobicContact CG-CE2 3.96Å; M284-Y335 HydrophobicContact SD-CD2 3.51Å; M284-Y335 VanDerWaalsContact SD-CD2 3.51Å; M284-Y335 HydrophobicContact SD-CE2 3.36Å; M284-Y335 WeakPolarHBondContact SD-CE2 3.35Å; M284-Y335 HydrophobicContact SD-CG 4.25Å; S333-Y335 WeakPolarHBondContact O-CD2 3.13Å; Y335-R342 HydrophobicContact CD1-CG 4.1Å; Y335-R342 VanDerWaalsContact CE1-CZ 3.5Å; Y335-R343 WeakPolarHBondContact CA-O 3.01Å; Y335-H344 HydrophobicContact CD1-CB 3.42Å; Y335-H344 VanDerWaalsContact CD1-CB 3.42Å; Y335-H344 HydrophobicContact CD2-CB 4.43Å; Y335-H344 HydrophobicContact CE1-CB 3.36Å; Y335-H344 AromaticContact CE1-CG 3.71Å; Y335-H344 AromaticContact CE1-ND1 3.89Å; Y335-H344 HydrophobicContact CE2-CB 4.35Å; Y335-H344 HydrophobicContact CG-CB 4Å
336	V	96.7	Very high	94.2	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	137.7	174.7	-61	0	0	0	0	109	P242 L244 A269 F271 L280 I281 R342 R343	P242-V336 HydrophobicContact CB-CB 4Å; P242-V336 HydrophobicContact CB-CG2 3.91Å; P242-V336 HydrophobicContact CG-CB 4.35Å; P242-V336 HydrophobicContact CG-CG2 4.44Å; L244-V336 HydrophobicContact CD1-CG1 4.32Å; L244-V336 HydrophobicContact CD1-CG2 3.96Å; L244-V336 HydrophobicContact CG-CG1 4.16Å; L244-V336 HydrophobicContact CG-CG2 4.16Å; A269-V336 HydrophobicContact CB-CB 4.44Å; A269-V336 HydrophobicContact CB-CG1 3.49Å; A269-V336 VanDerWaalsContact CB-CG1 3.49Å; F271-V336 HydrophobicContact CE2-CG1 4.46Å; F271-V336 HydrophobicContact CZ-CB 4.01Å; F271-V336 HydrophobicContact CZ-CG1 4.26Å; L280-V336 WeakPolarHBondContact O-CA 3.41Å; I281-V336 HydrophobicContact CB-CG1 4.29Å; I281-V336 HydrophobicContact CD1-CG1 3.98Å; I281-V336 HydrophobicContact CG1-CG1 3.76Å; V336-R342 CarbonylContact O-C 3.55Å; V336-R342 WeakPolarHBondContact O-CA 3.29Å; V336-R343 HydrophobicContact CG2-CB 3.68Å; V336-R343 PolarHBondContact N-O 2.99Å; V336-R343 PolarHBondContact O-N 3.29Å
337	E	95.9	Very high	94.5	Very high	65 Å²	65	41.1 Å²	41.1	30%	0.304	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	140.4	-170.6	-171.8	160	-171.1	0	0	112.7	L280 Y282 R342	L280-E337 HydrophobicContact CD2-CB 4.1Å; L280-E337 HydrophobicContact CD2-CG 4.39Å; L280-E337 HydrophobicContact CG-CB 4.39Å; L280-E337 PolarHBondContact O-N 3.16Å; Y282-E337 PolarHBondContact OH-OE2 3.49Å; E337-R342 HydrophobicContact CB-CB 4.4Å; E337-R342 HydrophobicContact CB-CG 4.24Å; E337-R342 HydrophobicContact CG-CB 4.1Å; E337-R342 HydrophobicContact CG-CG 4.32Å; E337-R342 WeakPolarHBondContact OE2-CD 3.33Å; E337-R342 IonicContact OE2-NE 3.98Å
338	N	94.8	Very high	94.8	Very high	22 Å²	22	40.3 Å²	40.3	12%	0.118	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	-178.2	164	73.6	3.8	0	0	0	109.5	K240 P241 P242 S274 N340 G341	K240-N338 PolarHBondContact O-ND2 3.05Å; P241-N338 WeakPolarHBondContact CA-OD1 3.49Å; P242-N338 HydrophobicContact CG-CB 3.98Å; S274-N338 PolarHBondContact OG-ND2 3.11Å; N338-N340 PolarHBondContact O-N 2.85Å; N338-N340 WeakPolarHBondContact OD1-CA 3.36Å; N338-N340 WeakPolarHBondContact OD1-CB 3.32Å; N338-N340 PolarHBondContact OD1-N 2.87Å; N338-G341 PolarHBondContact N-O 3.3Å; N338-G341 PolarHBondContact O-N 2.83Å; N338-G341 PolarHBondContact OD1-N 2.97Å
339	G	93.9	Very high	94.9	Very high	86 Å²	86	40.3 Å²	40.3	89%	0.887	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-14.4	179.9	0	0	0	0	0	115.9
340	N	95	Very high	95	Very high	80 Å²	80	42.1 Å²	42.1	43%	0.428	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95	-10.7	176.5	-56.5	-46.4	0	0	0	113.3	T238 K240 N338	T238-N340 PolarHBondContact O-ND2 3Å; K240-N340 PolarHBondContact N-ND2 3Å; K240-N340 PolarHBondContact O-ND2 2.87Å; N338-N340 PolarHBondContact O-N 2.85Å; N338-N340 WeakPolarHBondContact OD1-CA 3.36Å; N338-N340 WeakPolarHBondContact OD1-CB 3.32Å; N338-N340 PolarHBondContact OD1-N 2.87Å
341	G	94.8	Very high	94.9	Very high	24 Å²	24	45.2 Å²	45.2	25%	0.247	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	144.1	176	170.8	0	0	0	0	0	115.5	N338	N338-G341 PolarHBondContact N-O 3.3Å; N338-G341 PolarHBondContact O-N 2.83Å; N338-G341 PolarHBondContact OD1-N 2.97Å
342	R	96	Very high	94.4	Very high	102 Å²	102	46.5 Å²	46.5	39%	0.385	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	147.2	-177.5	-167.3	173.9	-179.9	-157.9	-3.8	111.3	Y282 M284 Y335 V336 E337	Y282-R342 PolarHBondContact OH-NE 2.86Å; Y282-R342 PolarHBondContact OH-NH2 3.04Å; M284-R342 PolarHBondContact SD-NH2 2.97Å; Y335-R342 HydrophobicContact CD1-CG 4.1Å; Y335-R342 VanDerWaalsContact CE1-CZ 3.5Å; V336-R342 CarbonylContact O-C 3.55Å; V336-R342 WeakPolarHBondContact O-CA 3.29Å; E337-R342 HydrophobicContact CB-CB 4.4Å; E337-R342 HydrophobicContact CB-CG 4.24Å; E337-R342 HydrophobicContact CG-CB 4.1Å; E337-R342 HydrophobicContact CG-CG 4.32Å; E337-R342 WeakPolarHBondContact OE2-CD 3.33Å; E337-R342 IonicContact OE2-NE 3.98Å
343	R	95.8	Very high	93.3	Very high	100 Å²	100	54.5 Å²	54.5	38%	0.377	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	157.9	168.6	-69.4	-65.1	-176.6	-87	2.1	109.8	P241 E249 Y335 V336	P241-R343 HydrophobicContact CB-CG 4.39Å; E249-R343 WeakPolarHBondContact OE1-CB 3.35Å; E249-R343 WeakPolarHBondContact OE1-CG 3.42Å; E249-R343 WeakPolarHBondContact OE2-CD 3.49Å; E249-R343 IonicContact OE2-NE 2.66Å; Y335-R343 WeakPolarHBondContact CA-O 3.01Å; V336-R343 HydrophobicContact CG2-CB 3.68Å; V336-R343 PolarHBondContact N-O 2.99Å; V336-R343 PolarHBondContact O-N 3.29Å
344	H	95.6	Very high	91.7	Very high	98 Å²	98	59.6 Å²	59.6	45%	0.454	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	156.3	176	69	-90	0	0	0	112.2	C334 Y335	C334-H344 WeakPolarHBondContact O-CA 3.45Å; C334-H344 WeakPolarHBondContact O-CB 3.44Å; Y335-H344 HydrophobicContact CD1-CB 3.42Å; Y335-H344 VanDerWaalsContact CD1-CB 3.42Å; Y335-H344 HydrophobicContact CD2-CB 4.43Å; Y335-H344 HydrophobicContact CE1-CB 3.36Å; Y335-H344 AromaticContact CE1-CG 3.71Å; Y335-H344 AromaticContact CE1-ND1 3.89Å; Y335-H344 HydrophobicContact CE2-CB 4.35Å; Y335-H344 HydrophobicContact CG-CB 4Å
345	A	95.9	Very high	90	Very high	2 Å²	2	66 Å²	66	2%	0.017	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	140	174.8	0	0	0	0	0	109.5	L244 P247 S333 C334	L244-A345 HydrophobicContact CD1-CB 3.79Å; L244-A345 HydrophobicContact CD2-CB 4.08Å; L244-A345 HydrophobicContact CG-CB 4.41Å; P247-A345 HydrophobicContact CB-CB 4.14Å; P247-A345 HydrophobicContact CG-CB 3.72Å; S333-A345 WeakPolarHBondContact CA-O 3.45Å; C334-A345 PolarHBondContact N-O 3.1Å; C334-A345 PolarHBondContact O-N 2.98Å; C334-A345 VanDerWaalsContact O-N 3.08Å
346	S	94.8	Very high	88.5	Confident	29 Å²	29	72.6 Å²	72.6	20%	0.203	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	140.4	-171.2	-50.7	0	0	0	0	113.1	T253 Y332 S333	T253-S346 PolarHBondContact N-O 3.42Å; T253-S346 PolarHBondContact OG1-O 2.99Å; Y332-S346 CarbonylContact O-C 3.47Å; Y332-S346 VanDerWaalsContact O-CA 3.28Å; Y332-S346 WeakPolarHBondContact O-CA 3.45Å; S333-S346 PolarHBondContact OG-OG 3.38Å
347	V	95.7	Very high	87	Confident	1 Å²	1	76.2 Å²	76.2	1%	0.006	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	130.2	166.7	-167.6	0	0	0	0	108.4	P247 T253 Q255 L265 W283 N331 Y332	P247-V347 HydrophobicContact CB-CG2 4.03Å; P247-V347 HydrophobicContact CG-CG2 3.71Å; T253-V347 CarbonylContact O-C 3.59Å; T253-V347 VanDerWaalsContact O-CA 3.27Å; T253-V347 WeakPolarHBondContact O-CA 3.37Å; T253-V347 WeakPolarHBondContact O-CG1 3.49Å; Q255-V347 HydrophobicContact CB-CG1 3.85Å; L265-V347 HydrophobicContact CD1-CB 4.43Å; L265-V347 HydrophobicContact CD2-CG1 4.27Å; W283-V347 HydrophobicContact CH2-CG2 3.64Å; W283-V347 HydrophobicContact CZ3-CG2 3.98Å; N331-V347 WeakPolarHBondContact CA-O 3.46Å; Y332-V347 PolarHBondContact N-O 3.3Å; Y332-V347 PolarHBondContact O-N 3.04Å
348	L	94.7	Very high	85.8	Confident	41 Å²	41	77.3 Å²	77.3	22%	0.215	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	112.2	168.5	174.1	61.5	0	0	0	108.7	L252 T253 I254 Q255 N331 H350	L252-L348 HydrophobicContact CD1-CB 4.16Å; L252-L348 HydrophobicContact CD2-CB 4.15Å; L252-L348 HydrophobicContact CD2-CD2 4.3Å; L252-L348 HydrophobicContact CG-CB 4.18Å; T253-L348 PolarHBondContact O-N 3.08Å; I254-L348 HydrophobicContact CG1-CD2 4.41Å; Q255-L348 PolarHBondContact N-O 2.81Å; N331-L348 WeakPolarHBondContact OD1-CD1 3.18Å; L348-H350 HydrophobicContact CG-CB 4.5Å; L348-H350 PolarHBondContact O-N 2.97Å
349	L	93.6	Very high	84.9	Confident	1 Å²	1	83.8 Å²	83.8	1%	0.005	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	114.8	169	-171.8	65.7	0	0	0	108.5	T257 A263 L265 V324 D328 L329 G330 Y332	T257-L349 HydrophobicContact CG2-CD1 3.64Å; T257-L349 HydrophobicContact CG2-CD2 4.44Å; T257-L349 HydrophobicContact CG2-CG 4.04Å; A263-L349 HydrophobicContact CB-CD1 3.94Å; A263-L349 HydrophobicContact CB-CD2 4.48Å; L265-L349 HydrophobicContact CD2-CD1 4.25Å; V324-L349 HydrophobicContact CG1-CD2 4.14Å; V324-L349 HydrophobicContact CG2-CD2 4.41Å; D328-L349 HydrophobicContact CB-CD2 4.28Å; L329-L349 HydrophobicContact CD2-CG 4.29Å; G330-L349 PolarHBondContact N-O 2.91Å; G330-L349 VanDerWaalsContact N-O 3.15Å; G330-L349 PolarHBondContact O-N 3.45Å; Y332-L349 HydrophobicContact CD2-CB 4.15Å; Y332-L349 HydrophobicContact CE2-CB 4.04Å; Y332-L349 HydrophobicContact CE2-CD2 3.98Å
350	H	91.9	Very high	84.2	Confident	86 Å²	86	85.1 Å²	85.1	40%	0.398	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	149.8	-174.7	-165.5	64	0	0	0	111.8	I254 Q255 E256 T257 L348	I254-H350 HydrophobicContact CG2-CB 3.9Å; Q255-H350 PolarHBondContact O-N 3.4Å; E256-H350 WeakPolarHBondContact CA-O 3.48Å; T257-H350 PolarHBondContact N-O 2.77Å; L348-H350 HydrophobicContact CG-CB 4.5Å; L348-H350 PolarHBondContact O-N 2.97Å
351	K	90.2	Very high	83.6	Confident	88 Å²	88	84.3 Å²	84.3	38%	0.383	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	125.1	178.8	-177.5	177.8	179.6	178.4	0	109.8	T257 L259 L329 E353	T257-K351 CarbonylContact O-C 3.51Å; T257-K351 WeakPolarHBondContact O-CA 3.5Å; L259-K351 HydrophobicContact CD1-CD 4.16Å; L259-K351 HydrophobicContact CG-CD 4.37Å; L329-K351 HydrophobicContact CD1-CB 3.89Å; L329-K351 HydrophobicContact CD2-CB 4.43Å; K351-E353 PolarHBondContact O-N 2.81Å
352	R	83.5	Confident	83.1	Confident	111 Å²	111	85.3 Å²	85.3	42%	0.419	42%	0.424	S	S	.	.			trans	-70.9	108.4	174.9	-169.7	174.8	70.1	-170.9	-1.3	110.4	E256 T257 Q258 L354	E256-R352 HydrophobicContact CB-CB 4.22Å; T257-R352 PolarHBondContact O-N 2.88Å; Q258-R352 HydrophobicContact CG-CB 4.45Å; R352-L354 PolarHBondContact O-N 3.12Å
353	E	71.4	Confident	82.7	Confident	168 Å²	168	82.1 Å²	82.1	79%	0.785	42%	0.423	S	S	*	.			trans	-72.9	106.8	170.5	-64.5	-162.2	160.1	0	0	110.3	K351 M355	K351-E353 PolarHBondContact O-N 2.81Å; E353-M355 PolarHBondContact O-N 2.82Å
354	L	62.9	Low	82.5	Confident	117 Å²	117	82.6 Å²	82.6	61%	0.613	43%	0.433	S	S	*	.			trans	-73.7	115.8	175.3	-167.1	74.8	0	0	0	109.1	R352 Y356	R352-L354 PolarHBondContact O-N 3.12Å; L354-Y356 VanDerWaalsContact O-CD1 3.31Å; L354-Y356 WeakPolarHBondContact O-CD1 3.29Å; L354-Y356 PolarHBondContact O-N 3.07Å
355	M	59.6	Low	82.2	Confident	135 Å²	135	79.8 Å²	79.8	67%	0.665	43%	0.43	S	S	*	.			trans	-73.3	63.9	-178.7	-64	-170.4	76.1	0	0	113.3	E353 T357 V358	E353-M355 PolarHBondContact O-N 2.82Å; M355-T357 PolarHBondContact O-N 2.89Å; M355-T357 VanDerWaalsContact O-N 3.08Å; M355-V358 HydrophobicContact CB-CG2 4.33Å; M355-V358 HydrophobicContact CE-CG2 4.08Å; M355-V358 PolarHBondContact O-N 2.72Å
356	Y	64.8	Low	82	Confident	169 Å²	169	82.7 Å²	82.7	66%	0.663	45%	0.454	S	S	*	.	H	α-helix	trans	-57.8	-22.8	177.5	64	-94	0	0	0	113.3	L354 V358 L360	L354-Y356 VanDerWaalsContact O-CD1 3.31Å; L354-Y356 WeakPolarHBondContact O-CD1 3.29Å; L354-Y356 PolarHBondContact O-N 3.07Å; Y356-V358 VanDerWaalsContact C-N 3.34Å; Y356-V358 PolarHBondContact O-N 2.9Å; Y356-L360 WeakPolarHBondContact O-CB 3.31Å; Y356-L360 PolarHBondContact O-N 2.85Å; Y356-L360 VanDerWaalsContact O-N 3.11Å
357	T	67.2	Low	81.9	Confident	75 Å²	75	86.2 Å²	86.2	46%	0.46	47%	0.47	S	S	.	.	H	α-helix	trans	-64.7	-32.7	-178.9	51.1	0	0	0	0	113.5	M355 A361	M355-T357 PolarHBondContact O-N 2.89Å; M355-T357 VanDerWaalsContact O-N 3.08Å; T357-A361 VanDerWaalsContact O-CB 3.23Å; T357-A361 WeakPolarHBondContact O-CB 3.37Å; T357-A361 PolarHBondContact O-N 3.45Å
358	V	70.7	Confident	81.8	Confident	88 Å²	88	91.7 Å²	91.7	53%	0.533	50%	0.498	S	S	.	.	H	α-helix	trans	-73	-46.8	-178.3	-177.9	0	0	0	0	110.7	M355 Y356 L360 A361 G362	M355-V358 HydrophobicContact CB-CG2 4.33Å; M355-V358 HydrophobicContact CE-CG2 4.08Å; M355-V358 PolarHBondContact O-N 2.72Å; Y356-V358 VanDerWaalsContact C-N 3.34Å; Y356-V358 PolarHBondContact O-N 2.9Å; V358-L360 PolarHBondContact O-N 3.08Å; V358-A361 PolarHBondContact O-N 3.47Å; V358-G362 PolarHBondContact O-N 2.94Å
359	E	74.8	Confident	81.7	Confident	158 Å²	158	95.2 Å²	95.2	74%	0.738	52%	0.516	S	S	*	.	H	α-helix	trans	-61.2	-43.6	175	-66.1	-60.7	150	0	0	111.5	A361 G362 G363	E359-A361 PolarHBondContact O-N 3.21Å; E359-G362 PolarHBondContact O-N 2.85Å; E359-G363 PolarHBondContact O-N 2.97Å
360	L	80.1	Confident	81.7	Confident	114 Å²	114	100.2 Å²	100.2	60%	0.597	54%	0.543	S	S	*	.	H	α-helix	trans	-65.1	-40.6	178.4	-136.4	105	0	0	0	112.1	Y356 V358 G363 L364	Y356-L360 WeakPolarHBondContact O-CB 3.31Å; Y356-L360 PolarHBondContact O-N 2.85Å; Y356-L360 VanDerWaalsContact O-N 3.11Å; V358-L360 PolarHBondContact O-N 3.08Å; L360-G363 PolarHBondContact O-N 3.25Å; L360-L364 HydrophobicContact CD2-CD1 4.23Å; L360-L364 WeakPolarHBondContact O-CB 3.39Å; L360-L364 WeakPolarHBondContact O-CG 2.99Å; L360-L364 PolarHBondContact O-N 3.45Å
361	A	82.3	Confident	81.8	Confident	63 Å²	63	100.7 Å²	100.7	52%	0.521	55%	0.548	S	S	.	.	H	α-helix	trans	-66.1	-40.4	176.6	0	0	0	0	0	112	T357 V358 E359 G365	T357-A361 VanDerWaalsContact O-CB 3.23Å; T357-A361 WeakPolarHBondContact O-CB 3.37Å; T357-A361 PolarHBondContact O-N 3.45Å; V358-A361 PolarHBondContact O-N 3.47Å; E359-A361 PolarHBondContact O-N 3.21Å; A361-G365 PolarHBondContact O-N 3.1Å
362	G	84.3	Confident	81.9	Confident	45 Å²	45	100.5 Å²	100.5	46%	0.464	55%	0.554	S	S	.	*	H	α-helix	trans	-60.7	-47.8	173.7	0	0	0	0	0	112.4	V358 E359 G365 A366	V358-G362 PolarHBondContact O-N 2.94Å; E359-G362 PolarHBondContact O-N 2.85Å; G362-G365 PolarHBondContact O-N 3.37Å; G362-A366 PolarHBondContact O-N 3.02Å
363	G	87.6	Confident	82.4	Confident	36 Å²	36	97.9 Å²	97.9	37%	0.371	55%	0.552	S	S	.	*	H	α-helix	trans	-60.4	-47.2	176.9	0	0	0	0	0	113.2	E359 L360 G365 A366 I367	E359-G363 PolarHBondContact O-N 2.97Å; L360-G363 PolarHBondContact O-N 3.25Å; G363-G365 PolarHBondContact O-N 2.02Å; G363-A366 PolarHBondContact O-N 2.98Å; G363-I367 WeakPolarHBondContact O-CG1 3.29Å; G363-I367 PolarHBondContact O-N 3.01Å; G363-I367 VanDerWaalsContact O-N 3.16Å
364	L	90.3	Very high	83.3	Confident	110 Å²	110	94.7 Å²	94.7	58%	0.576	54%	0.54	S	S	*	.	H	α-helix	trans	-64.2	-39.4	177.2	-72.4	170.3	0	0	0	112.4	L360 I367 L368	L360-L364 HydrophobicContact CD2-CD1 4.23Å; L360-L364 WeakPolarHBondContact O-CB 3.39Å; L360-L364 WeakPolarHBondContact O-CG 2.99Å; L360-L364 PolarHBondContact O-N 3.45Å; L364-I367 PolarHBondContact O-N 2.78Å; L364-L368 PolarHBondContact O-N 3.17Å
365	G	89.8	Confident	84.6	Confident	39 Å²	39	93.2 Å²	93.2	40%	0.402	54%	0.535	S	S	.	.	H	α-helix	trans	-62	-42.7	176.1	0	0	0	0	0	113	A361 G362 G363 L368 L369	A361-G365 PolarHBondContact O-N 3.1Å; G362-G365 PolarHBondContact O-N 3.37Å; G363-G365 PolarHBondContact O-N 2.02Å; G365-L368 PolarHBondContact O-N 3.08Å; G365-L369 PolarHBondContact O-N 3.11Å
366	A	91.9	Very high	86.1	Confident	63 Å²	63	90.2 Å²	90.2	52%	0.521	53%	0.525	S	S	.	.	H	α-helix	trans	-64	-42.1	176.8	0	0	0	0	0	112.5	G362 G363 L369 L370	G362-A366 PolarHBondContact O-N 3.02Å; G363-A366 PolarHBondContact O-N 2.98Å; A366-L369 PolarHBondContact O-N 3.03Å; A366-L370 WeakPolarHBondContact O-CB 3.17Å; A366-L370 PolarHBondContact O-N 3.44Å
367	I	92.7	Very high	87.2	Confident	103 Å²	103	86.4 Å²	86.4	53%	0.528	52%	0.515	S	S	.	.	H	α-helix	trans	-63.1	-44.1	177	-66.5	164.9	0	0	0	110.9	G363 L364 L370 L371	G363-I367 WeakPolarHBondContact O-CG1 3.29Å; G363-I367 PolarHBondContact O-N 3.01Å; G363-I367 VanDerWaalsContact O-N 3.16Å; L364-I367 PolarHBondContact O-N 2.78Å; I367-L370 PolarHBondContact O-N 3.03Å; I367-L371 HydrophobicContact CG2-CD1 4.19Å; I367-L371 WeakPolarHBondContact O-CG 3.31Å; I367-L371 PolarHBondContact O-N 2.77Å
368	L	92.8	Very high	88.2	Confident	115 Å²	115	87.9 Å²	87.9	60%	0.602	51%	0.513	S	S	*	.	H	α-helix	trans	-63.2	-43.4	178.9	-173.6	68.1	0	0	0	111.9	L364 G365 L371 V372	L364-L368 PolarHBondContact O-N 3.17Å; G365-L368 PolarHBondContact O-N 3.08Å; L368-L371 PolarHBondContact O-N 2.96Å; L368-V372 WeakPolarHBondContact O-CG2 3.14Å; L368-V372 PolarHBondContact O-N 2.88Å
369	L	92.7	Very high	88.8	Confident	115 Å²	115	91.1 Å²	91.1	60%	0.602	52%	0.52	S	S	*	.	H	α-helix	trans	-60.7	-46.5	177	-167.5	160.6	0	0	0	110.9	G365 A366 L371 V372 C373	G365-L369 PolarHBondContact O-N 3.11Å; A366-L369 PolarHBondContact O-N 3.03Å; L369-L371 VanDerWaalsContact C-N 3.35Å; L369-L371 PolarHBondContact O-N 2.91Å; L369-V372 PolarHBondContact O-N 2.99Å; L369-C373 PolarHBondContact O-N 2.86Å
370	L	94.2	Very high	89.2	Confident	107 Å²	107	88.5 Å²	88.5	56%	0.56	52%	0.517	S	S	*	.	H	α-helix	trans	-61.3	-41.5	178.9	-168.2	150.9	0	0	0	111.9	A366 I367 C373 L374	A366-L370 WeakPolarHBondContact O-CB 3.17Å; A366-L370 PolarHBondContact O-N 3.44Å; I367-L370 PolarHBondContact O-N 3.03Å; L370-C373 PolarHBondContact O-N 2.87Å; L370-L374 HydrophobicContact CD2-CD1 3.62Å; L370-L374 HydrophobicContact CD2-CG 4.14Å; L370-L374 WeakPolarHBondContact O-CG 3.26Å; L370-L374 PolarHBondContact O-N 3.17Å
371	L	94.1	Very high	89.3	Confident	95 Å²	95	88.9 Å²	88.9	50%	0.497	51%	0.512	S	S	.	.	H	α-helix	trans	-61.7	-43.6	173.9	-75.2	169.2	0	0	0	112.4	I367 L368 L369 C373 L374 V375	I367-L371 HydrophobicContact CG2-CD1 4.19Å; I367-L371 WeakPolarHBondContact O-CG 3.31Å; I367-L371 PolarHBondContact O-N 2.77Å; L368-L371 PolarHBondContact O-N 2.96Å; L369-L371 VanDerWaalsContact C-N 3.35Å; L369-L371 PolarHBondContact O-N 2.91Å; L371-C373 PolarHBondContact O-N 3.35Å; L371-L374 PolarHBondContact O-N 2.95Å; L371-V375 WeakPolarHBondContact O-CG2 3.37Å; L371-V375 PolarHBondContact O-N 2.93Å
372	V	93.1	Very high	89.4	Confident	84 Å²	84	90.7 Å²	90.7	51%	0.509	51%	0.508	S	S	.	.	H	α-helix	trans	-63.5	-40.9	176.9	172	0	0	0	0	111.4	L368 L369 V375 T376	L368-V372 WeakPolarHBondContact O-CG2 3.14Å; L368-V372 PolarHBondContact O-N 2.88Å; L369-V372 PolarHBondContact O-N 2.99Å; V372-V375 PolarHBondContact O-N 2.88Å; V372-T376 WeakPolarHBondContact O-CB 3.47Å; V372-T376 WeakPolarHBondContact O-CG2 3.39Å; V372-T376 PolarHBondContact O-N 3.23Å; V372-T376 PolarHBondContact O-OG1 3.48Å
373	C	92.1	Very high	89.1	Confident	57 Å²	57	91.4 Å²	91.4	39%	0.385	50%	0.501	S	S	.	.	H	α-helix	trans	-61.4	-45.6	173.4	-74.3	0	0	0	0	112.4	L369 L370 L371 V375 T376 I377	L369-C373 PolarHBondContact O-N 2.86Å; L370-C373 PolarHBondContact O-N 2.87Å; L371-C373 PolarHBondContact O-N 3.35Å; C373-V375 PolarHBondContact O-N 3.4Å; C373-T376 WeakPolarHBondContact CA-OG1 3.36Å; C373-T376 PolarHBondContact O-N 2.85Å; C373-T376 PolarHBondContact O-OG1 3.41Å; C373-I377 WeakPolarHBondContact O-CB 3.48Å; C373-I377 WeakPolarHBondContact O-CD1 3.27Å; C373-I377 VanDerWaalsContact O-CG1 3.23Å; C373-I377 WeakPolarHBondContact O-CG1 3.48Å; C373-I377 PolarHBondContact O-N 2.9Å
374	L	91.1	Very high	88.7	Confident	101 Å²	101	93.6 Å²	93.6	53%	0.529	50%	0.501	S	S	.	.	H	α-helix	trans	-62.9	-42.7	176.8	-71.2	176.8	0	0	0	112.4	L370 L371 Y378	L370-L374 HydrophobicContact CD2-CD1 3.62Å; L370-L374 HydrophobicContact CD2-CG 4.14Å; L370-L374 WeakPolarHBondContact O-CG 3.26Å; L370-L374 PolarHBondContact O-N 3.17Å; L371-L374 PolarHBondContact O-N 2.95Å; L374-Y378 WeakPolarHBondContact O-CB 3.37Å; L374-Y378 PolarHBondContact O-N 2.99Å
375	V	91	Very high	88.2	Confident	85 Å²	85	91.6 Å²	91.6	52%	0.515	49%	0.491	S	S	.	.	H	α-helix	trans	-65.7	-41.8	178.4	170.8	0	0	0	0	111.5	L371 V372 C373 Y378 K379	L371-V375 WeakPolarHBondContact O-CG2 3.37Å; L371-V375 PolarHBondContact O-N 2.93Å; V372-V375 PolarHBondContact O-N 2.88Å; C373-V375 PolarHBondContact O-N 3.4Å; V375-Y378 PolarHBondContact O-N 2.66Å; V375-K379 HydrophobicContact CG1-CG 4.38Å; V375-K379 WeakPolarHBondContact O-CB 3.37Å; V375-K379 VanDerWaalsContact O-CG 3.25Å; V375-K379 WeakPolarHBondContact O-CG 3.38Å; V375-K379 PolarHBondContact O-N 3.33Å
376	T	89.8	Confident	87.7	Confident	72 Å²	72	93 Å²	93	44%	0.442	49%	0.488	S	S	.	.	H	α-helix	trans	-67.2	-43	177.5	43.9	0	0	0	0	112	V372 C373 Y378 K379 C380	V372-T376 WeakPolarHBondContact O-CB 3.47Å; V372-T376 WeakPolarHBondContact O-CG2 3.39Å; V372-T376 PolarHBondContact O-N 3.23Å; V372-T376 PolarHBondContact O-OG1 3.48Å; C373-T376 WeakPolarHBondContact CA-OG1 3.36Å; C373-T376 PolarHBondContact O-N 2.85Å; C373-T376 PolarHBondContact O-OG1 3.41Å; T376-Y378 PolarHBondContact O-N 2.83Å; T376-K379 PolarHBondContact O-N 3.06Å; T376-C380 WeakPolarHBondContact O-CB 3.43Å; T376-C380 PolarHBondContact O-N 3.47Å; T376-C380 PolarHBondContact O-SG 3.28Å; T376-C380 VanDerWaalsContact O-SG 3.36Å
377	I	89.4	Confident	87	Confident	89 Å²	89	91.3 Å²	91.3	46%	0.456	47%	0.469	S	S	.	.	H	α-helix	trans	-57.9	-50	172.6	-69.3	165.4	0	0	0	110.4	C373 K379 C380 Y381	C373-I377 WeakPolarHBondContact O-CB 3.48Å; C373-I377 WeakPolarHBondContact O-CD1 3.27Å; C373-I377 VanDerWaalsContact O-CG1 3.23Å; C373-I377 WeakPolarHBondContact O-CG1 3.48Å; C373-I377 PolarHBondContact O-N 2.9Å; I377-K379 VanDerWaalsContact C-N 3.35Å; I377-K379 PolarHBondContact O-N 3.49Å; I377-C380 PolarHBondContact O-N 3.43Å; I377-Y381 HydrophobicContact CG2-CD2 4.28Å; I377-Y381 WeakPolarHBondContact O-CB 3.46Å; I377-Y381 WeakPolarHBondContact O-CD2 3.38Å; I377-Y381 PolarHBondContact O-N 3.33Å
378	Y	87.9	Confident	86.5	Confident	106 Å²	106	93.1 Å²	93.1	42%	0.416	47%	0.474	S	S	.	.	H	α-helix	trans	-59.1	-42.4	178.7	176.8	-96	0	0	0	112.7	L374 V375 T376 K382	L374-Y378 WeakPolarHBondContact O-CB 3.37Å; L374-Y378 PolarHBondContact O-N 2.99Å; V375-Y378 PolarHBondContact O-N 2.66Å; T376-Y378 PolarHBondContact O-N 2.83Å; Y378-K382 WeakPolarHBondContact O-CA 3.31Å; Y378-K382 WeakPolarHBondContact O-CB 3.49Å; Y378-K382 PolarHBondContact O-N 3.23Å; Y378-K382 VanDerWaalsContact O-N 3.07Å
379	K	83.3	Confident	85.8	Confident	156 Å²	156	94.3 Å²	94.3	68%	0.678	47%	0.471	S	S	*	.	H	α-helix	trans	-68.6	-44.3	179.2	-72.4	-73	-173.3	174.6	0	112.4	V375 T376 I377	V375-K379 HydrophobicContact CG1-CG 4.38Å; V375-K379 WeakPolarHBondContact O-CB 3.37Å; V375-K379 VanDerWaalsContact O-CG 3.25Å; V375-K379 WeakPolarHBondContact O-CG 3.38Å; V375-K379 PolarHBondContact O-N 3.33Å; T376-K379 PolarHBondContact O-N 3.06Å; I377-K379 VanDerWaalsContact C-N 3.35Å; I377-K379 PolarHBondContact O-N 3.49Å
380	C	83.7	Confident	85.1	Confident	103 Å²	103	91.4 Å²	91.4	70%	0.696	45%	0.452	S	S	*	.	H	α-helix	trans	-69.5	-40.4	-179.1	-71.4	0	0	0	0	112.7	T376 I377	T376-C380 WeakPolarHBondContact O-CB 3.43Å; T376-C380 PolarHBondContact O-N 3.47Å; T376-C380 PolarHBondContact O-SG 3.28Å; T376-C380 VanDerWaalsContact O-SG 3.36Å; I377-C380 PolarHBondContact O-N 3.43Å
381	Y	82.2	Confident	84.1	Confident	123 Å²	123	91.4 Å²	91.4	48%	0.482	45%	0.453	S	S	.	.	H	α-helix	trans	-105.8	13.2	-171.7	-64.1	-82.9	0	0	0	114	I377 I383 E384 I385	I377-Y381 HydrophobicContact CG2-CD2 4.28Å; I377-Y381 WeakPolarHBondContact O-CB 3.46Å; I377-Y381 WeakPolarHBondContact O-CD2 3.38Å; I377-Y381 PolarHBondContact O-N 3.33Å; Y381-I383 VanDerWaalsContact C-N 3.29Å; Y381-I383 PolarHBondContact O-N 3.05Å; Y381-I383 VanDerWaalsContact O-N 3.1Å; Y381-E384 WeakPolarHBondContact CD1-OE2 3.35Å; Y381-E384 PolarHBondContact O-N 3.2Å; Y381-I385 WeakPolarHBondContact O-CG1 3.47Å; Y381-I385 PolarHBondContact O-N 3.19Å
382	K	84.2	Confident	83	Confident	100 Å²	100	93 Å²	93	44%	0.435	46%	0.457	S	S	.	.	H	α-helix	trans	-45.6	-47.4	-175.7	-169.9	-169.9	177	-169.1	0	114	Y378 M386	Y378-K382 WeakPolarHBondContact O-CA 3.31Å; Y378-K382 WeakPolarHBondContact O-CB 3.49Å; Y378-K382 PolarHBondContact O-N 3.23Å; Y378-K382 VanDerWaalsContact O-N 3.07Å; K382-M386 VanDerWaalsContact O-CB 3.29Å; K382-M386 WeakPolarHBondContact O-CB 3.49Å; K382-M386 WeakPolarHBondContact O-CG 3.42Å; K382-M386 PolarHBondContact O-N 2.77Å
383	I	76.6	Confident	81.9	Confident	60 Å²	60	95.3 Å²	95.3	31%	0.308	46%	0.461	S	S	.	.	H	α-helix	trans	-68.8	-40.7	-178.5	-60.6	177.1	0	0	0	110.6	Y381 M386 L387 K553	Y381-I383 VanDerWaalsContact C-N 3.29Å; Y381-I383 PolarHBondContact O-N 3.05Å; Y381-I383 VanDerWaalsContact O-N 3.1Å; I383-M386 PolarHBondContact O-N 3.39Å; I383-L387 HydrophobicContact CG2-CD1 3.88Å; I383-L387 HydrophobicContact CG2-CG 4.33Å; I383-L387 WeakPolarHBondContact O-CB 3.44Å; I383-L387 VanDerWaalsContact O-CG 3.27Å; I383-L387 WeakPolarHBondContact O-CG 3.45Å; I383-L387 PolarHBondContact O-N 2.91Å; I383-K553 HydrophobicContact CG2-CB 4.43Å
384	E	80.5	Confident	80.4	Confident	82 Å²	82	93.1 Å²	93.1	38%	0.383	45%	0.448	S	S	.	.	H	α-helix	trans	-72.3	-41.4	-178	-55.3	-165.6	158.4	0	0	111.7	Y381 M386 L387 F388 K553	Y381-E384 WeakPolarHBondContact CD1-OE2 3.35Å; Y381-E384 PolarHBondContact O-N 3.2Å; E384-M386 VanDerWaalsContact C-N 3.33Å; E384-M386 PolarHBondContact O-N 3.12Å; E384-L387 PolarHBondContact O-N 2.83Å; E384-F388 VanDerWaalsContact O-CB 3.3Å; E384-F388 WeakPolarHBondContact O-CB 3.4Å; E384-F388 PolarHBondContact O-N 2.91Å; E384-K553 IonicContact OE1-NZ 3.69Å; E384-K553 PolarHBondContact OE1-NZ 3.28Å
385	I	79.8	Confident	78.9	Confident	69 Å²	69	92.1 Å²	92.1	35%	0.354	45%	0.454	S	S	.	.	H	α-helix	trans	-60.2	-43.8	172.5	-65.5	166.7	0	0	0	110.4	Y381 F388 Y389	Y381-I385 WeakPolarHBondContact O-CG1 3.47Å; Y381-I385 PolarHBondContact O-N 3.19Å; I385-F388 PolarHBondContact O-N 3.5Å; I385-Y389 VanDerWaalsContact O-CB 3.31Å; I385-Y389 WeakPolarHBondContact O-CB 3.47Å; I385-Y389 PolarHBondContact O-N 2.95Å
386	M	79.3	Confident	77.3	Confident	69 Å²	69	91.5 Å²	91.5	34%	0.34	45%	0.446	S	S	.	.	H	α-helix	trans	-69.6	-38.7	178.4	-75.4	-75.8	158.7	0	0	112.9	K382 I383 E384 R390 Y557	K382-M386 VanDerWaalsContact O-CB 3.29Å; K382-M386 WeakPolarHBondContact O-CB 3.49Å; K382-M386 WeakPolarHBondContact O-CG 3.42Å; K382-M386 PolarHBondContact O-N 2.77Å; I383-M386 PolarHBondContact O-N 3.39Å; E384-M386 VanDerWaalsContact C-N 3.33Å; E384-M386 PolarHBondContact O-N 3.12Å; M386-R390 VanDerWaalsContact O-CB 3.29Å; M386-R390 WeakPolarHBondContact O-CB 3.49Å; M386-R390 PolarHBondContact O-N 2.93Å; M386-Y557 HydrophobicContact CB-CD2 4.32Å; M386-Y557 HydrophobicContact CB-CE2 3.87Å; M386-Y557 HydrophobicContact CG-CE2 4.4Å
387	L	77.4	Confident	75.7	Confident	26 Å²	26	93.2 Å²	93.2	14%	0.136	45%	0.449	C	S	.	.	H	α-helix	trans	-65.6	-41.7	173.5	-74.4	171	0	0	0	111.3	I383 E384 R390 N391 K553 Q556	I383-L387 HydrophobicContact CG2-CD1 3.88Å; I383-L387 HydrophobicContact CG2-CG 4.33Å; I383-L387 WeakPolarHBondContact O-CB 3.44Å; I383-L387 VanDerWaalsContact O-CG 3.27Å; I383-L387 WeakPolarHBondContact O-CG 3.45Å; I383-L387 PolarHBondContact O-N 2.91Å; E384-L387 PolarHBondContact O-N 2.83Å; L387-R390 PolarHBondContact O-N 3.33Å; L387-N391 WeakPolarHBondContact O-CB 3.31Å; L387-N391 PolarHBondContact O-N 3.08Å; L387-K553 HydrophobicContact CD1-CB 4.14Å; L387-K553 HydrophobicContact CD1-CG 4.3Å; L387-Q556 HydrophobicContact CD2-CG 4.3Å
388	F	80.4	Confident	73.9	Confident	141 Å²	141	94.7 Å²	94.7	62%	0.618	46%	0.457	S	S	*	.	H	α-helix	trans	-63.4	-45.9	175.4	-177.4	-94.8	0	0	0	111.7	E384 I385 N391 H392	E384-F388 VanDerWaalsContact O-CB 3.3Å; E384-F388 WeakPolarHBondContact O-CB 3.4Å; E384-F388 PolarHBondContact O-N 2.91Å; I385-F388 PolarHBondContact O-N 3.5Å; F388-N391 PolarHBondContact O-N 3.08Å; F388-H392 WeakPolarHBondContact O-CB 3.15Å; F388-H392 PolarHBondContact O-N 2.86Å
389	Y	79.8	Confident	72	Confident	140 Å²	140	97.8 Å²	97.8	55%	0.549	48%	0.481	S	S	.	.	H	α-helix	trans	-59.6	-46.1	174.1	-178.7	-94.8	0	0	0	111.7	I385 N391 H392 F393	I385-Y389 VanDerWaalsContact O-CB 3.31Å; I385-Y389 WeakPolarHBondContact O-CB 3.47Å; I385-Y389 PolarHBondContact O-N 2.95Å; Y389-N391 VanDerWaalsContact C-N 3.29Å; Y389-N391 PolarHBondContact O-N 3.4Å; Y389-H392 PolarHBondContact O-N 3.22Å; Y389-F393 HydrophobicContact CD2-CB 4.39Å; Y389-F393 AromaticContact CD2-CD2 3.65Å; Y389-F393 HydrophobicContact CD2-CD2 3.65Å; Y389-F393 HydrophobicContact CD2-CE2 4.39Å; Y389-F393 HydrophobicContact CD2-CG 4.38Å; Y389-F393 HydrophobicContact CE1-CB 4.48Å; Y389-F393 HydrophobicContact CE2-CB 4.04Å; Y389-F393 AromaticContact CE2-CD2 3.72Å; Y389-F393 HydrophobicContact CE2-CD2 3.72Å; Y389-F393 HydrophobicContact CE2-CE2 4.49Å; Y389-F393 HydrophobicContact CE2-CG 4.08Å; Y389-F393 HydrophobicContact CG-CD2 4.47Å; Y389-F393 PolarHBondContact O-N 2.77Å
390	R	77.7	Confident	70.6	Confident	54 Å²	54	94.2 Å²	94.2	20%	0.204	49%	0.488	C	S	.	.	H	α-helix	trans	-63.4	-35	177	-157.5	175.1	83.8	156.9	8.1	111.7	M386 L387 G394 Q556 M559 P560 F561	M386-R390 VanDerWaalsContact O-CB 3.29Å; M386-R390 WeakPolarHBondContact O-CB 3.49Å; M386-R390 PolarHBondContact O-N 2.93Å; L387-R390 PolarHBondContact O-N 3.33Å; R390-G394 WeakPolarHBondContact O-CA 3.49Å; R390-G394 PolarHBondContact O-N 2.89Å; R390-Q556 PolarHBondContact NH2-O 2.81Å; R390-M559 PolarHBondContact NH1-O 2.9Å; R390-P560 PolarHBondContact NH2-O 2.96Å; R390-P560 VanDerWaalsContact NH2-O 3.15Å; R390-F561 HydrophobicContact CG-CB 4.27Å; R390-F561 HydrophobicContact CG-CD2 3.6Å; R390-F561 HydrophobicContact CG-CE2 4.07Å; R390-F561 HydrophobicContact CG-CG 3.89Å; R390-F561 VanDerWaalsContact O-CE2 3.25Å; R390-F561 WeakPolarHBondContact O-CE2 3.34Å; R390-F561 WeakPolarHBondContact O-CZ 3.47Å
391	N	72.6	Confident	69.4	Low	107 Å²	107	94 Å²	94	57%	0.572	48%	0.48	S	S	*	.	H	α-helix	trans	-73	-35.7	177.4	-164.7	51.8	0	0	0	113.4	L387 F388 Y389	L387-N391 WeakPolarHBondContact O-CB 3.31Å; L387-N391 PolarHBondContact O-N 3.08Å; F388-N391 PolarHBondContact O-N 3.08Å; Y389-N391 VanDerWaalsContact C-N 3.29Å; Y389-N391 PolarHBondContact O-N 3.4Å
392	H	71.3	Confident	68.6	Low	128 Å²	128	95.8 Å²	95.8	59%	0.593	50%	0.498	S	S	*	.	H	α-helix	trans	-93.3	-33	-174.8	-158.4	84	0	0	0	114	F388 Y389	F388-H392 WeakPolarHBondContact O-CB 3.15Å; F388-H392 PolarHBondContact O-N 2.86Å; Y389-H392 PolarHBondContact O-N 3.22Å
393	F	68.9	Low	68.6	Low	133 Å²	133	93 Å²	93	58%	0.583	49%	0.486	S	S	*	.	H	α-helix	trans	-119.5	2.2	-177.5	-63.1	-75.2	0	0	0	113.5	Y389 A395	Y389-F393 HydrophobicContact CD2-CB 4.39Å; Y389-F393 AromaticContact CD2-CD2 3.65Å; Y389-F393 HydrophobicContact CD2-CD2 3.65Å; Y389-F393 HydrophobicContact CD2-CE2 4.39Å; Y389-F393 HydrophobicContact CD2-CG 4.38Å; Y389-F393 HydrophobicContact CE1-CB 4.48Å; Y389-F393 HydrophobicContact CE2-CB 4.04Å; Y389-F393 AromaticContact CE2-CD2 3.72Å; Y389-F393 HydrophobicContact CE2-CD2 3.72Å; Y389-F393 HydrophobicContact CE2-CE2 4.49Å; Y389-F393 HydrophobicContact CE2-CG 4.08Å; Y389-F393 HydrophobicContact CG-CD2 4.47Å; Y389-F393 PolarHBondContact O-N 2.77Å; F393-A395 PolarHBondContact O-N 3.4Å; F393-A395 VanDerWaalsContact O-N 3.15Å
394	G	61.8	Low	68.9	Low	11 Å²	11	94.1 Å²	94.1	11%	0.113	49%	0.492	C	S	.	.			trans	-64.8	114.4	173.7	0	0	0	0	0	111.3	R390 F561 R563	R390-G394 WeakPolarHBondContact O-CA 3.49Å; R390-G394 PolarHBondContact O-N 2.89Å; G394-F561 WeakPolarHBondContact O-CE1 3.32Å; G394-R563 PolarHBondContact O-NH2 2.68Å
395	A	58.7	Low	69.3	Low	81 Å²	81	92.3 Å²	92.3	67%	0.669	48%	0.482	S	S	*	.			trans	-64.8	131.7	148.5	0	0	0	0	0	107.4	F393 F561	F393-A395 PolarHBondContact O-N 3.4Å; F393-A395 VanDerWaalsContact O-N 3.15Å; A395-F561 VanDerWaalsContact O-CD1 3.23Å; A395-F561 WeakPolarHBondContact O-CD1 3.37Å
396	E	58	Low	69.7	Low	72 Å²	72	89.6 Å²	89.6	34%	0.336	47%	0.469	S	S	.	.			trans	-60.8	145.7	169.9	-166.6	160.4	-163.6	0	0	109.2	L398	E396-L398 HydrophobicContact CB-CD1 3.98Å; E396-L398 HydrophobicContact CB-CG 4.05Å; E396-L398 HydrophobicContact CG-CD1 4.34Å; E396-L398 HydrophobicContact CG-CG 4.04Å; E396-L398 PolarHBondContact O-N 3.01Å
397	E	57.2	Low	70.3	Confident	108 Å²	108	86.3 Å²	86.3	51%	0.505	45%	0.452	S	S	.	.	S	Bend	trans	-73.7	62.4	172.9	-72.8	177.8	156.8	0	0	109.5	R472	E397-R472 IonicContact OE2-NH2 3.62Å
398	L	50.4	Low	71	Confident	120 Å²	120	85.5 Å²	85.5	63%	0.628	45%	0.447	S	S	*	.			trans	-83.3	150.6	164.5	-68.7	162	0	0	0	108.5	E396	E396-L398 HydrophobicContact CB-CD1 3.98Å; E396-L398 HydrophobicContact CB-CG 4.05Å; E396-L398 HydrophobicContact CG-CD1 4.34Å; E396-L398 HydrophobicContact CG-CG 4.04Å; E396-L398 PolarHBondContact O-N 3.01Å
399	D	48.1	Very low	71.6	Confident	171 Å²	171	78.8 Å²	78.8	91%	0.914	42%	0.418	S	S	*	.	S	Bend	trans	64.6	55.9	172.1	-56.2	-17.4	0	0	0	117.5
400	G	53.5	Low	72.1	Confident	80 Å²	80	72.6 Å²	72.6	83%	0.825	40%	0.395	S	S	*	.	S	Bend	trans	-152.1	-36.5	171.2	0	0	0	0	0	118
401	D	58.2	Low	72.6	Confident	98 Å²	98	71.6 Å²	71.6	52%	0.524	39%	0.392	S	S	.	.			trans	-141.5	121.1	-168.7	-136.5	-19.6	0	0	0	110.1	K403	D401-K403 HydrophobicContact CB-CD 4.15Å; D401-K403 HydrophobicContact CB-CG 4.2Å; D401-K403 VanDerWaalsContact CG-CD 3.48Å; D401-K403 PolarHBondContact O-N 2.9Å; D401-K403 WeakPolarHBondContact OD1-CE 3.46Å; D401-K403 IonicContact OD1-NZ 2.92Å; D401-K403 WeakPolarHBondContact OD2-CD 3.14Å; D401-K403 WeakPolarHBondContact OD2-CE 3.44Å; D401-K403 IonicContact OD2-NZ 3.83Å; D401-K403 PolarHBondContact OD2-NZ 2.78Å
402	N	67.5	Low	73.1	Confident	162 Å²	162	67.8 Å²	67.8	87%	0.866	37%	0.372	S	S	*	.			trans	-80.7	52.2	-173.1	-158.2	40.4	0	0	0	111
403	K	83	Confident	73.2	Confident	42 Å²	42	67.8 Å²	67.8	18%	0.183	37%	0.371	C	S	.	.			trans	-106.8	117.9	-167.9	-73.4	-175.9	-179.9	161.2	0	111	D401 Y405 D468 Q469 K471	D401-K403 HydrophobicContact CB-CD 4.15Å; D401-K403 HydrophobicContact CB-CG 4.2Å; D401-K403 VanDerWaalsContact CG-CD 3.48Å; D401-K403 PolarHBondContact O-N 2.9Å; D401-K403 WeakPolarHBondContact OD1-CE 3.46Å; D401-K403 IonicContact OD1-NZ 2.92Å; D401-K403 WeakPolarHBondContact OD2-CD 3.14Å; D401-K403 WeakPolarHBondContact OD2-CE 3.44Å; D401-K403 IonicContact OD2-NZ 3.83Å; D401-K403 PolarHBondContact OD2-NZ 2.78Å; K403-Y405 VanDerWaalsContact C-N 3.28Å; K403-Y405 PolarHBondContact O-N 2.73Å; K403-D468 WeakPolarHBondContact CD-O 3.33Å; K403-D468 WeakPolarHBondContact CE-O 3.22Å; K403-Q469 CarbonylContact C-O 3.59Å; K403-Q469 WeakPolarHBondContact CB-O 3.35Å; K403-K471 HydrophobicContact CB-CG 4.2Å; K403-K471 HydrophobicContact CD-CG 4.42Å
404	D	83.6	Confident	73.1	Confident	83 Å²	83	62 Å²	62	44%	0.444	35%	0.346	S	S	.	.	S	Bend	trans	-70.9	-16.9	-173.8	-70	-62.6	0	0	0	114.7	K445 Q469	D404-K445 VanDerWaalsContact O-CD 3.23Å; D404-K445 WeakPolarHBondContact O-CD 3.28Å; D404-K445 WeakPolarHBondContact O-CE 3.34Å; D404-K445 PolarHBondContact O-NZ 2.97Å; D404-Q469 PolarHBondContact N-O 3.23Å; D404-Q469 VanDerWaalsContact N-O 3.09Å; D404-Q469 PolarHBondContact OD2-NE2 2.85Å
405	Y	88.1	Confident	73.2	Confident	44 Å²	44	66.5 Å²	66.5	17%	0.173	37%	0.368	C	S	.	.	B	Isolated β-bridge	trans	-130.1	141	-171.9	-61.3	-89.5	0	0	0	112.7	K403 K445 L446 F447 Q469 S470 K471	K403-Y405 VanDerWaalsContact C-N 3.28Å; K403-Y405 PolarHBondContact O-N 2.73Å; Y405-K445 HydrophobicContact CD1-CD 4.35Å; Y405-K445 HydrophobicContact CD1-CG 3.94Å; Y405-K445 HydrophobicContact CE1-CG 4.34Å; Y405-L446 WeakPolarHBondContact CD1-O 3.49Å; Y405-F447 HydrophobicContact CD1-CB 3.74Å; Y405-F447 HydrophobicContact CD1-CD2 4.23Å; Y405-F447 HydrophobicContact CD2-CB 4.32Å; Y405-F447 HydrophobicContact CD2-CD2 4.14Å; Y405-F447 HydrophobicContact CE1-CB 4.11Å; Y405-F447 AromaticContact CE1-CD2 3.81Å; Y405-F447 HydrophobicContact CE1-CD2 3.81Å; Y405-F447 HydrophobicContact CE1-CG 4.47Å; Y405-F447 AromaticContact CE2-CD2 3.75Å; Y405-F447 HydrophobicContact CE2-CD2 3.75Å; Y405-F447 HydrophobicContact CE2-CE2 4.48Å; Y405-F447 HydrophobicContact CG-CB 3.85Å; Y405-F447 HydrophobicContact CG-CD2 4.38Å; Y405-F447 AromaticContact CZ-CD2 3.57Å; Y405-Q469 HydrophobicContact CD2-CB 4.29Å; Y405-Q469 PolarHBondContact N-O 3Å; Y405-S470 CarbonylContact O-C 3.56Å; Y405-S470 WeakPolarHBondContact O-CA 3.47Å; Y405-K471 PolarHBondContact O-N 3.41Å
406	D	88.7	Confident	73.3	Confident	12 Å²	12	67.2 Å²	67.2	6%	0.064	37%	0.366	C	S	.	.	S	Bend	trans	-75.2	-30.1	177.9	-70.6	-47.9	0	0	0	111.8	Y444 K445 K471 R472 P560 K562	D406-Y444 HydrophobicContact CB-CD1 3.84Å; D406-Y444 HydrophobicContact CB-CG 4.4Å; D406-Y444 WeakPolarHBondContact OD2-CA 2.89Å; D406-K445 PolarHBondContact N-O 3.32Å; D406-K445 PolarHBondContact OD2-N 2.05Å; D406-K471 IonicContact OD1-NZ 3.28Å; D406-R472 PolarHBondContact O-N 3.44Å; D406-P560 HydrophobicContact CB-CG 4.49Å; D406-P560 WeakPolarHBondContact O-CG 3.45Å; D406-K562 IonicContact OD2-NZ 2.68Å; D406-K562 PolarHBondContact OD2-NZ 2.78Å
407	A	91.5	Very high	73.3	Confident	0 Å²	0	71.2 Å²	71.2	0%	0	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	147.3	168.7	0	0	0	0	0	113.6	L446 F447 R472 I474 M559	A407-L446 HydrophobicContact CB-CD2 3.84Å; A407-L446 CarbonylContact O-C 3.53Å; A407-L446 WeakPolarHBondContact O-CA 3.49Å; A407-F447 PolarHBondContact O-N 3.3Å; A407-R472 CarbonylContact C-O 3.59Å; A407-R472 VanDerWaalsContact CA-O 3.24Å; A407-R472 WeakPolarHBondContact CA-O 3.43Å; A407-R472 HydrophobicContact CB-CB 3.9Å; A407-I474 HydrophobicContact CB-CD1 3.71Å; A407-I474 HydrophobicContact CB-CG1 3.97Å; A407-M559 HydrophobicContact CB-CE 4.04Å; A407-M559 HydrophobicContact CB-SD 4.29Å
408	Y	93	Very high	73.3	Confident	8 Å²	8	72.5 Å²	72.5	3%	0.031	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	135.9	165.5	-177.8	-81.1	0	0	0	110	F447 P449 V463 C466 V467 S470 R472 L473 I474 F490	Y408-F447 HydrophobicContact CD2-CB 4.25Å; Y408-F447 AromaticContact CD2-CD1 3.45Å; Y408-F447 HydrophobicContact CD2-CD1 3.45Å; Y408-F447 VanDerWaalsContact CD2-CD1 3.45Å; Y408-F447 HydrophobicContact CD2-CE1 4.2Å; Y408-F447 HydrophobicContact CD2-CG 4.13Å; Y408-F447 AromaticContact CE2-CD1 3.49Å; Y408-F447 HydrophobicContact CE2-CD1 3.49Å; Y408-F447 VanDerWaalsContact CE2-CD1 3.49Å; Y408-F447 AromaticContact CE2-CE1 3.8Å; Y408-F447 HydrophobicContact CE2-CE1 3.8Å; Y408-F447 HydrophobicContact CG-CD1 4.47Å; Y408-P449 HydrophobicContact CE1-CG 4.24Å; Y408-P449 HydrophobicContact CE2-CG 4.07Å; Y408-P449 VanDerWaalsContact OH-CG 3.26Å; Y408-P449 WeakPolarHBondContact OH-CG 3.28Å; Y408-V463 HydrophobicContact CE2-CG1 4.45Å; Y408-V463 WeakPolarHBondContact OH-CG1 3.15Å; Y408-C466 HydrophobicContact CD2-CB 4.26Å; Y408-C466 HydrophobicContact CE2-CB 4.17Å; Y408-V467 HydrophobicContact CD1-CG2 4.02Å; Y408-V467 HydrophobicContact CD2-CG2 3.61Å; Y408-V467 HydrophobicContact CE1-CG2 4.13Å; Y408-V467 HydrophobicContact CE2-CG2 3.73Å; Y408-V467 HydrophobicContact CG-CG2 3.76Å; Y408-S470 PolarHBondContact N-OG 2.81Å; Y408-R472 PolarHBondContact N-O 3.28Å; Y408-L473 HydrophobicContact CD1-CD1 3.5Å; Y408-L473 HydrophobicContact CE1-CD1 4.27Å; Y408-L473 HydrophobicContact CG-CD1 4.25Å; Y408-I474 PolarHBondContact O-N 3.03Å; Y408-F490 HydrophobicContact CE1-CZ 4.41Å
409	L	92.6	Very high	73.5	Confident	1 Å²	1	73.9 Å²	73.9	1%	0.005	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	113.2	177.6	-173.5	65	0	0	0	111.7	Y411 L434 P435 F447 I448 P449 I474 V476	L409-Y411 HydrophobicContact CD2-CD1 4.17Å; L409-Y411 HydrophobicContact CD2-CE1 4.46Å; L409-Y411 HydrophobicContact CG-CD1 4.01Å; L409-L434 HydrophobicContact CD1-CD2 3.78Å; L409-P435 HydrophobicContact CD2-CG 3.95Å; L409-F447 PolarHBondContact N-O 2.66Å; L409-I448 HydrophobicContact CB-CG1 4.42Å; L409-I448 HydrophobicContact CD2-CD1 4.43Å; L409-I448 HydrophobicContact CD2-CG1 4.28Å; L409-P449 VanDerWaalsContact O-CD 3.23Å; L409-P449 WeakPolarHBondContact O-CD 3.31Å; L409-I474 HydrophobicContact CD1-CB 3.93Å; L409-I474 HydrophobicContact CD1-CG2 3.69Å; L409-V476 HydrophobicContact CD1-CG2 3.77Å
410	S	90.6	Very high	74	Confident	10 Å²	10	71.4 Å²	71.4	7%	0.07	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	122.5	170.7	-169.7	0	0	0	0	110.6	I474 V476 Y481	S410-I474 PolarHBondContact N-O 2.02Å; S410-V476 PolarHBondContact O-N 3.08Å; S410-Y481 PolarHBondContact OG-OH 3.36Å
411	Y	87.8	Confident	74.1	Confident	32 Å²	32	76.3 Å²	76.3	13%	0.125	38%	0.38	C	S	.	.			trans	-145.6	176.5	175.5	63.4	-82.1	0	0	0	108.8	L409 K413 L431 I448 D450	L409-Y411 HydrophobicContact CD2-CD1 4.17Å; L409-Y411 HydrophobicContact CD2-CE1 4.46Å; L409-Y411 HydrophobicContact CG-CD1 4.01Å; Y411-K413 HydrophobicContact CE2-CB 4.45Å; Y411-L431 HydrophobicContact CD2-CD2 3.69Å; Y411-L431 HydrophobicContact CE2-CD2 3.32Å; Y411-I448 HydrophobicContact CE1-CG2 3.85Å; Y411-D450 VanDerWaalsContact OH-CB 3.24Å; Y411-D450 WeakPolarHBondContact OH-CB 3.45Å; Y411-D450 PolarHBondContact OH-OD2 3.06Å
412	T	83.1	Confident	74.2	Confident	27 Å²	27	79.6 Å²	79.6	17%	0.166	39%	0.393	C	S	.	.			trans	-119.4	143.4	168.2	-161.8	0	0	0	0	109.1	N480 Y481	T412-N480 HydrophobicContact CG2-CB 3.93Å; T412-Y481 HydrophobicContact CG2-CD2 4.46Å
413	K	72.8	Confident	74	Confident	129 Å²	129	72.9 Å²	72.9	56%	0.561	36%	0.357	S	S	*	.	P	Polyproline II helix	trans	-99.9	127.3	174.1	-172.7	177.2	-174.9	172.8	0	108.7	Y411 R484	Y411-K413 HydrophobicContact CE2-CB 4.45Å; K413-R484 PolarHBondContact O-NH1 3.03Å
414	V	67.7	Low	73.4	Confident	12 Å²	12	71.2 Å²	71.2	7%	0.073	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-100	144.4	172.3	-178.1	0	0	0	0	108.6	Q418 E427 N480	V414-Q418 HydrophobicContact CG1-CB 4.05Å; V414-E427 WeakPolarHBondContact CB-OE1 3.42Å; V414-E427 WeakPolarHBondContact CG2-OE1 3.37Å; V414-N480 HydrophobicContact CG2-CB 3.64Å
415	D	63.8	Low	73.2	Confident	104 Å²	104	72.1 Å²	72.1	56%	0.556	35%	0.354	S	S	*	.	P	Polyproline II helix	trans	-67.4	143.9	177.1	-58.4	-70.9	0	0	0	109.7	D417 Q418	D415-D417 PolarHBondContact O-N 2.65Å; D415-Q418 PolarHBondContact O-N 3.19Å
416	P	60.9	Low	72.8	Confident	97 Å²	97	70.4 Å²	70.4	63%	0.63	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-55	-19.5	-172.6	-27.7	35.6	0	0	0	115.4	Q418	P416-Q418 VanDerWaalsContact C-N 3.27Å; P416-Q418 PolarHBondContact O-N 3.45Å
417	D	57.5	Low	72.4	Confident	155 Å²	155	70.4 Å²	70.4	83%	0.829	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-75.5	-5.7	-172.8	-54.7	-25.3	0	0	0	114.4	D415	D415-D417 PolarHBondContact O-N 2.65Å
418	Q	56.8	Low	72	Confident	135 Å²	135	77.2 Å²	77.2	63%	0.631	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	-115.3	32.3	-179.9	-63.6	-168.9	10.2	0	0	114.4	V414 D415 P416 N420	V414-Q418 HydrophobicContact CG1-CB 4.05Å; D415-Q418 PolarHBondContact O-N 3.19Å; P416-Q418 VanDerWaalsContact C-N 3.27Å; P416-Q418 PolarHBondContact O-N 3.45Å; Q418-N420 PolarHBondContact O-N 2.88Å
419	W	54.7	Low	71.7	Confident	150 Å²	150	76.8 Å²	76.8	57%	0.568	37%	0.371	S	S	*	.			trans	-77.1	82.2	-172.6	-147.5	-71.5	0	0	0	114.7	G424	W419-G424 VanDerWaalsContact NE1-CA 3.34Å
420	N	57.7	Low	71.4	Confident	119 Å²	119	76.9 Å²	76.9	64%	0.636	37%	0.372	S	S	*	.			trans	-70.4	147.3	159.4	-74.9	-28.9	0	0	0	110.1	Q418 E422 T423 G424	Q418-N420 PolarHBondContact O-N 2.88Å; N420-E422 VanDerWaalsContact C-N 3.29Å; N420-E422 PolarHBondContact O-N 2.93Å; N420-T423 PolarHBondContact O-N 2.85Å; N420-T423 PolarHBondContact O-OG1 3.37Å; N420-G424 PolarHBondContact O-N 3.07Å; N420-G424 VanDerWaalsContact O-N 3.13Å
421	Q	57.6	Low	71	Confident	182 Å²	182	79.9 Å²	79.9	85%	0.85	39%	0.387	S	S	*	.	H	α-helix	trans	-59.7	-36.7	-175.5	-82.3	-176.4	-17.5	0	0	113.4
422	E	59.3	Low	70.8	Confident	168 Å²	168	83 Å²	83	79%	0.785	40%	0.403	S	S	*	.	H	α-helix	trans	-73.1	-46	-178.2	-62.8	-176.5	153.3	0	0	112.4	N420 G424 E425	N420-E422 VanDerWaalsContact C-N 3.29Å; N420-E422 PolarHBondContact O-N 2.93Å; E422-G424 PolarHBondContact O-N 3.08Å; E422-E425 PolarHBondContact O-N 2.86Å
423	T	63.1	Low	71	Confident	20 Å²	20	83.9 Å²	83.9	12%	0.123	41%	0.405	C	S	.	.	H	α-helix	trans	-62.7	-32.7	176.7	47.1	0	0	0	0	111.9	N420 E425 E426 E427	N420-T423 PolarHBondContact O-N 2.85Å; N420-T423 PolarHBondContact O-OG1 3.37Å; T423-E425 VanDerWaalsContact C-N 3.34Å; T423-E425 PolarHBondContact O-N 3.28Å; T423-E426 PolarHBondContact O-N 3.09Å; T423-E427 WeakPolarHBondContact O-CG 3.45Å; T423-E427 PolarHBondContact O-N 3.28Å
424	G	71.2	Confident	71.8	Confident	7 Å²	7	77.7 Å²	77.7	7%	0.072	38%	0.379	C	S	.	.	H	α-helix	trans	-61.9	-33	176.1	0	0	0	0	0	115	W419 N420 E422 R428	W419-G424 VanDerWaalsContact NE1-CA 3.34Å; N420-G424 PolarHBondContact O-N 3.07Å; N420-G424 VanDerWaalsContact O-N 3.13Å; E422-G424 PolarHBondContact O-N 3.08Å; G424-R428 WeakPolarHBondContact O-CB 3.41Å; G424-R428 PolarHBondContact O-N 2.68Å; G424-R428 VanDerWaalsContact O-N 3.12Å
425	E	78.2	Confident	72.8	Confident	102 Å²	102	77.5 Å²	77.5	48%	0.477	38%	0.377	S	S	.	.	H	α-helix	trans	-72.3	-35.7	177	-66.7	-158.7	161.8	0	0	112.2	E422 T423 F429 W539 P542	E422-E425 PolarHBondContact O-N 2.86Å; T423-E425 VanDerWaalsContact C-N 3.34Å; T423-E425 PolarHBondContact O-N 3.28Å; E425-F429 WeakPolarHBondContact O-CB 3.22Å; E425-F429 PolarHBondContact O-N 2.99Å; E425-W539 HydrophobicContact CB-CH2 4.39Å; E425-P542 WeakPolarHBondContact OE2-CD 3.46Å
426	E	80.6	Confident	74	Confident	9 Å²	9	75.8 Å²	75.8	4%	0.042	37%	0.368	C	S	.	.	H	α-helix	trans	-75.5	-41.3	-178.4	-60.5	177.8	121.5	0	0	112	T423 F429 A430 T478 P479 C512 S513 W539	T423-E426 PolarHBondContact O-N 3.09Å; E426-F429 WeakPolarHBondContact O-CB 3.13Å; E426-F429 PolarHBondContact O-N 3.06Å; E426-A430 WeakPolarHBondContact O-CB 3.3Å; E426-A430 PolarHBondContact O-N 2.84Å; E426-T478 HydrophobicContact CB-CG2 4.01Å; E426-P479 VanDerWaalsContact CD-CD 3.44Å; E426-P479 WeakPolarHBondContact OE1-CD 3.4Å; E426-P479 WeakPolarHBondContact OE2-CD 3.41Å; E426-P479 VanDerWaalsContact OE2-CG 3.29Å; E426-P479 WeakPolarHBondContact OE2-CG 3.39Å; E426-C512 HydrophobicContact CB-CB 4.31Å; E426-C512 HydrophobicContact CG-CB 4.06Å; E426-C512 WeakPolarHBondContact OE1-CB 3.23Å; E426-S513 WeakPolarHBondContact OE1-CB 3.05Å; E426-S513 PolarHBondContact OE1-N 2.7Å; E426-S513 PolarHBondContact OE1-OG 3Å; E426-W539 HydrophobicContact CG-CZ3 3.96Å
427	E	79.2	Confident	75.2	Confident	11 Å²	11	71.7 Å²	71.7	5%	0.051	34%	0.341	C	S	.	.	H	α-helix	trans	-67.4	-41.8	175	-72.5	174.1	-168	0	0	111	V414 T423 F429 A430 L431 N480	V414-E427 WeakPolarHBondContact CB-OE1 3.42Å; V414-E427 WeakPolarHBondContact CG2-OE1 3.37Å; T423-E427 WeakPolarHBondContact O-CG 3.45Å; T423-E427 PolarHBondContact O-N 3.28Å; E427-F429 VanDerWaalsContact C-N 3.29Å; E427-F429 PolarHBondContact O-N 2.79Å; E427-A430 PolarHBondContact O-N 2.93Å; E427-A430 VanDerWaalsContact O-N 3.17Å; E427-L431 VanDerWaalsContact O-CB 3.31Å; E427-L431 WeakPolarHBondContact O-CB 3.13Å; E427-L431 WeakPolarHBondContact O-CG 3.37Å; E427-L431 PolarHBondContact O-N 3.24Å; E427-N480 PolarHBondContact OE1-ND2 2.85Å
428	R	83.5	Confident	76.7	Confident	143 Å²	143	64.3 Å²	64.3	54%	0.54	30%	0.302	S	S	.	.	H	α-helix	trans	-60.2	-39.5	171.1	-171.3	179.5	-175.4	-167.7	0.4	112.2	G424 E432 I433	G424-R428 WeakPolarHBondContact O-CB 3.41Å; G424-R428 PolarHBondContact O-N 2.68Å; G424-R428 VanDerWaalsContact O-N 3.12Å; R428-E432 HydrophobicContact CG-CB 4.4Å; R428-E432 HydrophobicContact CG-CG 4.26Å; R428-E432 VanDerWaalsContact CG-OE2 3.27Å; R428-E432 WeakPolarHBondContact CG-OE2 3.36Å; R428-E432 IonicContact CZ-OE2 2.81Å; R428-E432 IonicContact NE-OE2 3.56Å; R428-E432 PolarHBondContact NE-OE2 3.06Å; R428-E432 IonicContact NH2-OE2 3.41Å; R428-E432 PolarHBondContact NH2-OE2 3.26Å; R428-E432 WeakPolarHBondContact O-CB 3.39Å; R428-E432 PolarHBondContact O-N 2.98Å; R428-I433 HydrophobicContact CG-CD1 4.48Å; R428-I433 PolarHBondContact O-N 2.9Å
429	F	87.3	Confident	78.2	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	28%	0.283	C	S	.	.	I	π-helix	trans	-62.5	-45.2	173.6	166.5	-98.9	0	0	0	111.9	E425 E426 E427 I433 L434 V476 I510 W539 F551 W552	E425-F429 WeakPolarHBondContact O-CB 3.22Å; E425-F429 PolarHBondContact O-N 2.99Å; E426-F429 WeakPolarHBondContact O-CB 3.13Å; E426-F429 PolarHBondContact O-N 3.06Å; E427-F429 VanDerWaalsContact C-N 3.29Å; E427-F429 PolarHBondContact O-N 2.79Å; F429-I433 HydrophobicContact CD2-CB 4.25Å; F429-I433 HydrophobicContact CD2-CG2 4.36Å; F429-I433 PolarHBondContact O-N 3.01Å; F429-L434 HydrophobicContact CE1-CB 4.44Å; F429-L434 HydrophobicContact CE1-CD2 4.31Å; F429-L434 HydrophobicContact CE2-CB 4.14Å; F429-L434 HydrophobicContact CZ-CB 4.02Å; F429-L434 HydrophobicContact CZ-CD1 4.17Å; F429-L434 HydrophobicContact CZ-CD2 4.28Å; F429-L434 HydrophobicContact CZ-CG 4.4Å; F429-L434 WeakPolarHBondContact O-CB 3.15Å; F429-L434 PolarHBondContact O-N 2.93Å; F429-V476 HydrophobicContact CD1-CG1 4.41Å; F429-V476 HydrophobicContact CE1-CG1 4.23Å; F429-I510 HydrophobicContact CE1-CG2 3.93Å; F429-I510 HydrophobicContact CZ-CG2 4.29Å; F429-W539 HydrophobicContact CB-CH2 4.06Å; F429-W539 HydrophobicContact CB-CZ2 3.73Å; F429-W539 HydrophobicContact CD1-CD2 4.23Å; F429-W539 HydrophobicContact CD1-CG 4.36Å; F429-W539 AromaticContact CD2-CD1 3.81Å; F429-W539 HydrophobicContact CD2-CD2 4.4Å; F429-W539 AromaticContact CD2-CE2 3.68Å; F429-W539 HydrophobicContact CD2-CG 4.47Å; F429-W539 HydrophobicContact CD2-CZ2 4.08Å; F429-W539 AromaticContact CD2-NE1 3.29Å; F429-W539 VanDerWaalsContact CD2-NE1 3.29Å; F429-W539 HydrophobicContact CE1-CG 4.25Å; F429-W539 AromaticContact CE2-CD1 3.56Å; F429-W539 HydrophobicContact CE2-CG 4.36Å; F429-W539 AromaticContact CE2-NE1 3.49Å; F429-W539 HydrophobicContact CG-CD2 4.15Å; F429-W539 AromaticContact CG-CE2 3.68Å; F429-W539 HydrophobicContact CG-CG 4.49Å; F429-W539 AromaticContact CG-CZ2 3.9Å; F429-W539 HydrophobicContact CG-CZ2 3.9Å; F429-W539 AromaticContact CG-NE1 3.77Å; F429-W539 AromaticContact CZ-CD1 3.78Å; F429-W539 HydrophobicContact CZ-CG 4.25Å; F429-F551 HydrophobicContact CE2-CE1 4.08Å; F429-F551 HydrophobicContact CE2-CZ 4.14Å; F429-F551 HydrophobicContact CZ-CE1 4.07Å; F429-F551 AromaticContact CZ-CZ 3.68Å; F429-F551 HydrophobicContact CZ-CZ 3.68Å; F429-W552 HydrophobicContact CE2-CH2 4.2Å
430	A	85.5	Confident	79.7	Confident	3 Å²	3	59.5 Å²	59.5	3%	0.025	28%	0.283	C	S	.	.	I	π-helix	trans	-68.5	-38.5	-178.6	0	0	0	0	0	113.9	E426 E427 P435 V476	E426-A430 WeakPolarHBondContact O-CB 3.3Å; E426-A430 PolarHBondContact O-N 2.84Å; E427-A430 PolarHBondContact O-N 2.93Å; E427-A430 VanDerWaalsContact O-N 3.17Å; A430-P435 WeakPolarHBondContact O-CD 3.06Å; A430-V476 HydrophobicContact CB-CB 4.35Å; A430-V476 HydrophobicContact CB-CG1 3.89Å
431	L	82.6	Confident	81	Confident	72 Å²	72	58.8 Å²	58.8	38%	0.377	28%	0.276	S	S	.	.	I	π-helix	trans	-93.8	-40.3	-171.5	-66.7	170.7	0	0	0	114	Y411 E427 P435	Y411-L431 HydrophobicContact CD2-CD2 3.69Å; Y411-L431 HydrophobicContact CE2-CD2 3.32Å; E427-L431 VanDerWaalsContact O-CB 3.31Å; E427-L431 WeakPolarHBondContact O-CB 3.13Å; E427-L431 WeakPolarHBondContact O-CG 3.37Å; E427-L431 PolarHBondContact O-N 3.24Å; L431-P435 WeakPolarHBondContact O-CG 3.41Å
432	E	84.2	Confident	82.2	Confident	99 Å²	99	51.4 Å²	51.4	46%	0.463	24%	0.24	S	C	.	.	I	π-helix	trans	-100.9	-60.9	-177.8	-59.4	179.7	176.2	0	0	110.8	R428 D436	R428-E432 HydrophobicContact CG-CB 4.4Å; R428-E432 HydrophobicContact CG-CG 4.26Å; R428-E432 VanDerWaalsContact CG-OE2 3.27Å; R428-E432 WeakPolarHBondContact CG-OE2 3.36Å; R428-E432 IonicContact CZ-OE2 2.81Å; R428-E432 IonicContact NE-OE2 3.56Å; R428-E432 PolarHBondContact NE-OE2 3.06Å; R428-E432 IonicContact NH2-OE2 3.41Å; R428-E432 PolarHBondContact NH2-OE2 3.26Å; R428-E432 WeakPolarHBondContact O-CB 3.39Å; R428-E432 PolarHBondContact O-N 2.98Å; E432-D436 WeakPolarHBondContact O-CB 3.43Å; E432-D436 PolarHBondContact O-N 2.97Å
433	I	86.6	Confident	83.4	Confident	44 Å²	44	45.2 Å²	45.2	23%	0.226	22%	0.222	C	C	.	.	I	π-helix	trans	-74.4	-39.8	-160.8	-53.1	178.3	0	0	0	111.9	R428 F429 M437 N545 W552	R428-I433 HydrophobicContact CG-CD1 4.48Å; R428-I433 PolarHBondContact O-N 2.9Å; F429-I433 HydrophobicContact CD2-CB 4.25Å; F429-I433 HydrophobicContact CD2-CG2 4.36Å; F429-I433 PolarHBondContact O-N 3.01Å; I433-M437 VanDerWaalsContact O-CB 3.24Å; I433-M437 WeakPolarHBondContact O-CB 3.39Å; I433-M437 PolarHBondContact O-N 3.02Å; I433-N545 VanDerWaalsContact CD1-ND2 3.3Å; I433-N545 WeakPolarHBondContact CD1-ND2 3.23Å; I433-N545 HydrophobicContact CG2-CB 4.4Å; I433-W552 HydrophobicContact CG2-CZ2 4.19Å
434	L	89.9	Confident	84.6	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-70.2	-49	-179.2	176.2	66.7	0	0	0	112.2	L409 F429 L438 I474 V476 I510 W552 L555	L409-L434 HydrophobicContact CD1-CD2 3.78Å; F429-L434 HydrophobicContact CE1-CB 4.44Å; F429-L434 HydrophobicContact CE1-CD2 4.31Å; F429-L434 HydrophobicContact CE2-CB 4.14Å; F429-L434 HydrophobicContact CZ-CB 4.02Å; F429-L434 HydrophobicContact CZ-CD1 4.17Å; F429-L434 HydrophobicContact CZ-CD2 4.28Å; F429-L434 HydrophobicContact CZ-CG 4.4Å; F429-L434 WeakPolarHBondContact O-CB 3.15Å; F429-L434 PolarHBondContact O-N 2.93Å; L434-L438 HydrophobicContact CD1-CD1 3.65Å; L434-L438 HydrophobicContact CD1-CG 4.19Å; L434-L438 HydrophobicContact CG-CD1 4.14Å; L434-L438 WeakPolarHBondContact O-CB 3.18Å; L434-L438 WeakPolarHBondContact O-CG 3.5Å; L434-L438 PolarHBondContact O-N 3.26Å; L434-L438 VanDerWaalsContact O-N 3.12Å; L434-I474 HydrophobicContact CD2-CG2 4.33Å; L434-V476 HydrophobicContact CD2-CG2 3.51Å; L434-I510 HydrophobicContact CD1-CD1 4.11Å; L434-I510 HydrophobicContact CD2-CD1 3.84Å; L434-W552 HydrophobicContact CD1-CH2 4.28Å; L434-W552 HydrophobicContact CD1-CZ3 4.01Å; L434-L555 HydrophobicContact CD1-CD2 3.85Å
435	P	89.4	Confident	85.5	Confident	7 Å²	7	48.8 Å²	48.8	5%	0.045	23%	0.234	C	C	.	.	H	α-helix	trans	-58.6	-51	170.1	-28.3	38.3	0	0	0	113	L409 A430 L431 M437 L438 E439 L446 I448	L409-P435 HydrophobicContact CD2-CG 3.95Å; A430-P435 WeakPolarHBondContact O-CD 3.06Å; L431-P435 WeakPolarHBondContact O-CG 3.41Å; P435-M437 VanDerWaalsContact C-N 3.31Å; P435-M437 PolarHBondContact O-N 3.48Å; P435-L438 PolarHBondContact O-N 3.48Å; P435-L438 VanDerWaalsContact O-N 3.17Å; P435-E439 WeakPolarHBondContact O-CB 3.31Å; P435-E439 WeakPolarHBondContact O-CG 3.43Å; P435-E439 PolarHBondContact O-N 2.89Å; P435-L446 HydrophobicContact CB-CD1 4.42Å; P435-I448 HydrophobicContact CB-CD1 3.85Å; P435-I448 HydrophobicContact CG-CD1 3.88Å
436	D	88	Confident	86.1	Confident	68 Å²	68	44 Å²	44	36%	0.364	21%	0.211	S	C	.	.	H	α-helix	trans	-58.3	-42.4	-177.5	-89.8	5	0	0	0	112.3	E432 K440	E432-D436 WeakPolarHBondContact O-CB 3.43Å; E432-D436 PolarHBondContact O-N 2.97Å; D436-K440 HydrophobicContact CB-CD 4.22Å; D436-K440 WeakPolarHBondContact O-CA 3.38Å; D436-K440 WeakPolarHBondContact O-CB 3.25Å; D436-K440 PolarHBondContact O-N 2.88Å; D436-K440 VanDerWaalsContact OD1-CE 3.22Å; D436-K440 WeakPolarHBondContact OD1-CE 3.42Å; D436-K440 IonicContact OD1-NZ 2.94Å; D436-K440 PolarHBondContact OD1-NZ 2.97Å; D436-K440 IonicContact OD2-NZ 3.58Å; D436-K440 PolarHBondContact OD2-NZ 3.32Å
437	M	87	Confident	86.5	Confident	11 Å²	11	43.7 Å²	43.7	5%	0.054	21%	0.21	C	C	.	.	I	π-helix	trans	-69.3	-41.5	179	-169.7	76.8	-167.5	0	0	112	I433 P435 H441 Y442 L547 W552	I433-M437 VanDerWaalsContact O-CB 3.24Å; I433-M437 WeakPolarHBondContact O-CB 3.39Å; I433-M437 PolarHBondContact O-N 3.02Å; P435-M437 VanDerWaalsContact C-N 3.31Å; P435-M437 PolarHBondContact O-N 3.48Å; M437-H441 HydrophobicContact CE-CB 3.91Å; M437-H441 HydrophobicContact CG-CB 4.46Å; M437-H441 WeakPolarHBondContact O-CB 3.26Å; M437-H441 PolarHBondContact O-N 3.32Å; M437-H441 HydrophobicContact SD-CB 3.84Å; M437-H441 PolarHBondContact SD-CD2 3.38Å; M437-Y442 HydrophobicContact CE-CD2 4.21Å; M437-Y442 HydrophobicContact CE-CE2 3.38Å; M437-Y442 WeakPolarHBondContact CE-OH 3.35Å; M437-Y442 HydrophobicContact CG-CD2 4.09Å; M437-Y442 HydrophobicContact CG-CE2 3.78Å; M437-Y442 VanDerWaalsContact O-CD2 3.29Å; M437-Y442 WeakPolarHBondContact O-CD2 3.21Å; M437-Y442 PolarHBondContact O-N 3.03Å; M437-Y442 VanDerWaalsContact O-N 3.11Å; M437-Y442 HydrophobicContact SD-CE2 4.47Å; M437-L547 HydrophobicContact CE-CB 4.41Å; M437-L547 HydrophobicContact CE-CD2 3.91Å; M437-L547 HydrophobicContact CE-CG 3.83Å; M437-L547 HydrophobicContact SD-CG 4.2Å; M437-W552 HydrophobicContact CB-CE3 4.38Å; M437-W552 HydrophobicContact CB-CH2 3.44Å; M437-W552 VanDerWaalsContact CB-CH2 3.44Å; M437-W552 HydrophobicContact CB-CZ2 3.79Å; M437-W552 HydrophobicContact CB-CZ3 3.76Å; M437-W552 HydrophobicContact CE-CD2 4.4Å; M437-W552 HydrophobicContact CE-CG 4.31Å; M437-W552 HydrophobicContact CG-CD2 3.8Å; M437-W552 HydrophobicContact CG-CE3 3.71Å; M437-W552 HydrophobicContact CG-CH2 3.6Å; M437-W552 HydrophobicContact CG-CZ2 3.66Å; M437-W552 HydrophobicContact CG-CZ3 3.61Å; M437-W552 HydrophobicContact SD-CZ2 4.42Å
438	L	88.6	Confident	87	Confident	1 Å²	1	44 Å²	44	1%	0.005	21%	0.211	C	C	.	.	I	π-helix	trans	-72.7	-41.7	-178.8	-72.1	175.4	0	0	0	112.3	L434 P435 Y442 G443 Y444 L446 I474 L555 M559	L434-L438 HydrophobicContact CD1-CD1 3.65Å; L434-L438 HydrophobicContact CD1-CG 4.19Å; L434-L438 HydrophobicContact CG-CD1 4.14Å; L434-L438 WeakPolarHBondContact O-CB 3.18Å; L434-L438 WeakPolarHBondContact O-CG 3.5Å; L434-L438 PolarHBondContact O-N 3.26Å; L434-L438 VanDerWaalsContact O-N 3.12Å; P435-L438 PolarHBondContact O-N 3.48Å; P435-L438 VanDerWaalsContact O-N 3.17Å; L438-Y442 HydrophobicContact CD2-CD2 4.25Å; L438-Y442 CarbonylContact O-C 3.55Å; L438-G443 PolarHBondContact O-N 2.85Å; L438-G443 VanDerWaalsContact O-N 3.15Å; L438-Y444 HydrophobicContact CB-CD2 4.41Å; L438-Y444 HydrophobicContact CD2-CD2 3.85Å; L438-Y444 HydrophobicContact CD2-CE2 4.2Å; L438-Y444 PolarHBondContact O-N 3.41Å; L438-L446 HydrophobicContact CB-CD1 3.97Å; L438-L446 HydrophobicContact CB-CD2 4.39Å; L438-L446 HydrophobicContact CB-CG 4.4Å; L438-L446 HydrophobicContact CD1-CD1 4.06Å; L438-L446 HydrophobicContact CD1-CD2 4.14Å; L438-I474 HydrophobicContact CD1-CD1 3.78Å; L438-L555 HydrophobicContact CD1-CD2 4.43Å; L438-L555 HydrophobicContact CD2-CD2 3.96Å; L438-L555 HydrophobicContact CD2-CG 4.47Å; L438-L555 HydrophobicContact CG-CD2 4.44Å; L438-M559 HydrophobicContact CD2-CE 4.36Å; L438-M559 HydrophobicContact CD2-CG 4.43Å
439	E	89.1	Confident	87.1	Confident	51 Å²	51	38 Å²	38	24%	0.238	19%	0.191	C	C	.	.	I	π-helix	trans	-82	-51.3	-177.8	-59.4	-170.2	142.9	0	0	112.1	P435 G443 Y444 L446 R451	P435-E439 WeakPolarHBondContact O-CB 3.31Å; P435-E439 WeakPolarHBondContact O-CG 3.43Å; P435-E439 PolarHBondContact O-N 2.89Å; E439-G443 VanDerWaalsContact O-CA 3.25Å; E439-G443 WeakPolarHBondContact O-CA 3.38Å; E439-G443 PolarHBondContact O-N 3.37Å; E439-Y444 WeakPolarHBondContact CA-O 3.46Å; E439-L446 HydrophobicContact CG-CB 4.36Å; E439-L446 HydrophobicContact CG-CD1 3.96Å; E439-L446 HydrophobicContact CG-CG 3.87Å; E439-L446 WeakPolarHBondContact OE1-CB 3.24Å; E439-L446 PolarHBondContact OE1-N 3.48Å; E439-R451 VanDerWaalsContact CD-NH1 3.29Å; E439-R451 IonicContact OE1-CZ 2.68Å; E439-R451 IonicContact OE1-NH1 3.64Å; E439-R451 PolarHBondContact OE1-NH1 2.86Å; E439-R451 IonicContact OE1-NH2 2.72Å; E439-R451 PolarHBondContact OE1-NH2 2.83Å; E439-R451 IonicContact OE2-CZ 3.52Å; E439-R451 IonicContact OE2-NH1 3.97Å; E439-R451 PolarHBondContact OE2-NH1 2.97Å; E439-R451 IonicContact OE2-NH2 2.66Å
440	K	85.6	Confident	86.8	Confident	132 Å²	132	42.8 Å²	42.8	57%	0.574	22%	0.217	S	C	*	.	I	π-helix	trans	-84.1	-36.6	-173.9	-56.5	168.5	176.5	160.9	0	113.7	D436	D436-K440 HydrophobicContact CB-CD 4.22Å; D436-K440 WeakPolarHBondContact O-CA 3.38Å; D436-K440 WeakPolarHBondContact O-CB 3.25Å; D436-K440 PolarHBondContact O-N 2.88Å; D436-K440 VanDerWaalsContact OD1-CE 3.22Å; D436-K440 WeakPolarHBondContact OD1-CE 3.42Å; D436-K440 IonicContact OD1-NZ 2.94Å; D436-K440 PolarHBondContact OD1-NZ 2.97Å; D436-K440 IonicContact OD2-NZ 3.58Å; D436-K440 PolarHBondContact OD2-NZ 3.32Å
441	H	83.8	Confident	86.7	Confident	104 Å²	104	48.5 Å²	48.5	48%	0.481	24%	0.238	S	C	.	.	I	π-helix	trans	-95.1	-31	-177.3	-79.9	-60.3	0	0	0	114.4	M437	M437-H441 HydrophobicContact CE-CB 3.91Å; M437-H441 HydrophobicContact CG-CB 4.46Å; M437-H441 WeakPolarHBondContact O-CB 3.26Å; M437-H441 PolarHBondContact O-N 3.32Å; M437-H441 HydrophobicContact SD-CB 3.84Å; M437-H441 PolarHBondContact SD-CD2 3.38Å
442	Y	83.9	Confident	86.8	Confident	27 Å²	27	47.4 Å²	47.4	11%	0.106	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.1	-7.8	178.6	-66.4	-60.6	0	0	0	114.5	M437 L438 Y444 W552 Q556 I564	M437-Y442 HydrophobicContact CE-CD2 4.21Å; M437-Y442 HydrophobicContact CE-CE2 3.38Å; M437-Y442 WeakPolarHBondContact CE-OH 3.35Å; M437-Y442 HydrophobicContact CG-CD2 4.09Å; M437-Y442 HydrophobicContact CG-CE2 3.78Å; M437-Y442 VanDerWaalsContact O-CD2 3.29Å; M437-Y442 WeakPolarHBondContact O-CD2 3.21Å; M437-Y442 PolarHBondContact O-N 3.03Å; M437-Y442 VanDerWaalsContact O-N 3.11Å; M437-Y442 HydrophobicContact SD-CE2 4.47Å; L438-Y442 HydrophobicContact CD2-CD2 4.25Å; L438-Y442 CarbonylContact O-C 3.55Å; Y442-Y444 VanDerWaalsContact C-N 3.31Å; Y442-Y444 HydrophobicContact CG-CE2 4.21Å; Y442-Y444 PolarHBondContact O-N 2.83Å; Y442-W552 HydrophobicContact CE2-CB 4.48Å; Y442-W552 HydrophobicContact CE2-CE3 4.32Å; Y442-W552 WeakPolarHBondContact OH-CB 3.39Å; Y442-Q556 HydrophobicContact CD1-CG 4.38Å; Y442-Q556 HydrophobicContact CE1-CG 4.22Å; Y442-I564 HydrophobicContact CD1-CD1 4.23Å
443	G	84	Confident	86.8	Confident	39 Å²	39	43.9 Å²	43.9	40%	0.402	22%	0.216	S	C	.	.			trans	73.1	13.7	175.4	0	0	0	0	0	115.3	L438 E439 K562	L438-G443 PolarHBondContact O-N 2.85Å; L438-G443 VanDerWaalsContact O-N 3.15Å; E439-G443 VanDerWaalsContact O-CA 3.25Å; E439-G443 WeakPolarHBondContact O-CA 3.38Å; E439-G443 PolarHBondContact O-N 3.37Å; G443-K562 WeakPolarHBondContact O-CD 3.37Å; G443-K562 VanDerWaalsContact O-CE 3.24Å; G443-K562 WeakPolarHBondContact O-CE 3.28Å; G443-K562 PolarHBondContact O-NZ 2.83Å
444	Y	88.6	Confident	86.5	Confident	7 Å²	7	49 Å²	49	3%	0.027	24%	0.243	C	C	.	.			trans	-72.7	146.4	177.7	-66.5	-67.5	0	0	0	111.5	D406 L438 E439 Y442 M559 P560 K562	D406-Y444 HydrophobicContact CB-CD1 3.84Å; D406-Y444 HydrophobicContact CB-CG 4.4Å; D406-Y444 WeakPolarHBondContact OD2-CA 2.89Å; L438-Y444 HydrophobicContact CB-CD2 4.41Å; L438-Y444 HydrophobicContact CD2-CD2 3.85Å; L438-Y444 HydrophobicContact CD2-CE2 4.2Å; L438-Y444 PolarHBondContact O-N 3.41Å; E439-Y444 WeakPolarHBondContact CA-O 3.46Å; Y442-Y444 VanDerWaalsContact C-N 3.31Å; Y442-Y444 HydrophobicContact CG-CE2 4.21Å; Y442-Y444 PolarHBondContact O-N 2.83Å; Y444-M559 HydrophobicContact CD1-CE 3.73Å; Y444-M559 HydrophobicContact CD2-CE 3.69Å; Y444-M559 HydrophobicContact CE1-CB 4.15Å; Y444-M559 HydrophobicContact CE1-CE 4.04Å; Y444-M559 HydrophobicContact CE2-CB 4.04Å; Y444-M559 HydrophobicContact CE2-CE 4Å; Y444-M559 HydrophobicContact CE2-CG 4.17Å; Y444-M559 HydrophobicContact CG-CE 3.54Å; Y444-M559 WeakPolarHBondContact OH-CB 3.47Å; Y444-P560 WeakPolarHBondContact CE1-O 3.37Å; Y444-P560 PolarHBondContact OH-O 3.47Å; Y444-K562 HydrophobicContact CD1-CB 4.34Å; Y444-K562 HydrophobicContact CD1-CD 4.06Å; Y444-K562 HydrophobicContact CE1-CB 3.85Å; Y444-K562 HydrophobicContact CE1-CD 4.42Å
445	K	89.6	Confident	85.5	Confident	95 Å²	95	53.4 Å²	53.4	41%	0.413	27%	0.271	S	S	.	.			trans	-96.4	105.7	172.7	-178.1	178.3	166.3	-155.9	0	109.4	D404 Y405 D406	D404-K445 VanDerWaalsContact O-CD 3.23Å; D404-K445 WeakPolarHBondContact O-CD 3.28Å; D404-K445 WeakPolarHBondContact O-CE 3.34Å; D404-K445 PolarHBondContact O-NZ 2.97Å; Y405-K445 HydrophobicContact CD1-CD 4.35Å; Y405-K445 HydrophobicContact CD1-CG 3.94Å; Y405-K445 HydrophobicContact CE1-CG 4.34Å; D406-K445 PolarHBondContact N-O 3.32Å; D406-K445 PolarHBondContact OD2-N 2.05Å
446	L	90.3	Very high	84.7	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	151.4	179	-56.6	-179.1	0	0	0	111.8	Y405 A407 P435 L438 E439 I448 R451 I474	Y405-L446 WeakPolarHBondContact CD1-O 3.49Å; A407-L446 HydrophobicContact CB-CD2 3.84Å; A407-L446 CarbonylContact O-C 3.53Å; A407-L446 WeakPolarHBondContact O-CA 3.49Å; P435-L446 HydrophobicContact CB-CD1 4.42Å; L438-L446 HydrophobicContact CB-CD1 3.97Å; L438-L446 HydrophobicContact CB-CD2 4.39Å; L438-L446 HydrophobicContact CB-CG 4.4Å; L438-L446 HydrophobicContact CD1-CD1 4.06Å; L438-L446 HydrophobicContact CD1-CD2 4.14Å; E439-L446 HydrophobicContact CG-CB 4.36Å; E439-L446 HydrophobicContact CG-CD1 3.96Å; E439-L446 HydrophobicContact CG-CG 3.87Å; E439-L446 WeakPolarHBondContact OE1-CB 3.24Å; E439-L446 PolarHBondContact OE1-N 3.48Å; L446-I448 HydrophobicContact CB-CG1 4.16Å; L446-R451 PolarHBondContact O-NH2 2.72Å; L446-R451 VanDerWaalsContact O-NH2 3.12Å; L446-I474 HydrophobicContact CD2-CD1 4.47Å
447	F	90.6	Very high	84.2	Confident	4 Å²	4	57.8 Å²	57.8	2%	0.018	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	117.5	160.9	-171.3	-84.8	0	0	0	109.1	Y405 A407 Y408 L409 P449 D452 L453 C466	Y405-F447 HydrophobicContact CD1-CB 3.74Å; Y405-F447 HydrophobicContact CD1-CD2 4.23Å; Y405-F447 HydrophobicContact CD2-CB 4.32Å; Y405-F447 HydrophobicContact CD2-CD2 4.14Å; Y405-F447 HydrophobicContact CE1-CB 4.11Å; Y405-F447 AromaticContact CE1-CD2 3.81Å; Y405-F447 HydrophobicContact CE1-CD2 3.81Å; Y405-F447 HydrophobicContact CE1-CG 4.47Å; Y405-F447 AromaticContact CE2-CD2 3.75Å; Y405-F447 HydrophobicContact CE2-CD2 3.75Å; Y405-F447 HydrophobicContact CE2-CE2 4.48Å; Y405-F447 HydrophobicContact CG-CB 3.85Å; Y405-F447 HydrophobicContact CG-CD2 4.38Å; Y405-F447 AromaticContact CZ-CD2 3.57Å; A407-F447 PolarHBondContact O-N 3.3Å; Y408-F447 HydrophobicContact CD2-CB 4.25Å; Y408-F447 AromaticContact CD2-CD1 3.45Å; Y408-F447 HydrophobicContact CD2-CD1 3.45Å; Y408-F447 VanDerWaalsContact CD2-CD1 3.45Å; Y408-F447 HydrophobicContact CD2-CE1 4.2Å; Y408-F447 HydrophobicContact CD2-CG 4.13Å; Y408-F447 AromaticContact CE2-CD1 3.49Å; Y408-F447 HydrophobicContact CE2-CD1 3.49Å; Y408-F447 VanDerWaalsContact CE2-CD1 3.49Å; Y408-F447 AromaticContact CE2-CE1 3.8Å; Y408-F447 HydrophobicContact CE2-CE1 3.8Å; Y408-F447 HydrophobicContact CG-CD1 4.47Å; L409-F447 PolarHBondContact N-O 2.66Å; F447-P449 HydrophobicContact CD1-CG 4.42Å; F447-P449 HydrophobicContact CE1-CG 4.24Å; F447-D452 HydrophobicContact CD2-CB 3.78Å; F447-D452 HydrophobicContact CE2-CB 3.57Å; F447-D452 HydrophobicContact CG-CB 4.35Å; F447-D452 HydrophobicContact CZ-CB 3.99Å; F447-L453 HydrophobicContact CE1-CB 4.22Å; F447-L453 HydrophobicContact CE1-CD1 4.45Å; F447-L453 HydrophobicContact CZ-CB 3.84Å; F447-L453 HydrophobicContact CZ-CD1 3.92Å; F447-L453 HydrophobicContact CZ-CG 4.49Å; F447-C466 HydrophobicContact CD1-CB 3.97Å; F447-C466 HydrophobicContact CD2-CB 4.13Å; F447-C466 HydrophobicContact CE1-CB 3.69Å; F447-C466 HydrophobicContact CE2-CB 3.88Å; F447-C466 VanDerWaalsContact CE2-SG 3.51Å; F447-C466 HydrophobicContact CG-CB 4.18Å; F447-C466 HydrophobicContact CZ-CB 3.66Å; F447-C466 WeakPolarHBondContact CZ-SG 3.36Å
448	I	89.1	Confident	83.9	Confident	16 Å²	16	60.2 Å²	60.2	8%	0.082	33%	0.333	C	S	.	.			trans	-117.1	112.8	-180	-57.5	-177.2	0	0	0	107.6	L409 Y411 P435 L446 D450 R451 D452	L409-I448 HydrophobicContact CB-CG1 4.42Å; L409-I448 HydrophobicContact CD2-CD1 4.43Å; L409-I448 HydrophobicContact CD2-CG1 4.28Å; Y411-I448 HydrophobicContact CE1-CG2 3.85Å; P435-I448 HydrophobicContact CB-CD1 3.85Å; P435-I448 HydrophobicContact CG-CD1 3.88Å; L446-I448 HydrophobicContact CB-CG1 4.16Å; I448-D450 PolarHBondContact O-N 3.43Å; I448-R451 HydrophobicContact CB-CB 4.16Å; I448-R451 HydrophobicContact CG2-CB 4.3Å; I448-R451 PolarHBondContact O-N 2.81Å; I448-D452 PolarHBondContact N-OD2 3.36Å; I448-D452 PolarHBondContact O-N 2.89Å
449	P	85.3	Confident	83.7	Confident	18 Å²	18	65.7 Å²	65.7	12%	0.117	35%	0.354	C	S	.	.	H	α-helix	trans	-53.3	-43.4	-172.5	-31.6	37.5	0	0	0	115.2	Y408 L409 F447 R451 L453	Y408-P449 HydrophobicContact CE1-CG 4.24Å; Y408-P449 HydrophobicContact CE2-CG 4.07Å; Y408-P449 VanDerWaalsContact OH-CG 3.26Å; Y408-P449 WeakPolarHBondContact OH-CG 3.28Å; L409-P449 VanDerWaalsContact O-CD 3.23Å; L409-P449 WeakPolarHBondContact O-CD 3.31Å; F447-P449 HydrophobicContact CD1-CG 4.42Å; F447-P449 HydrophobicContact CE1-CG 4.24Å; P449-R451 PolarHBondContact O-N 3.41Å; P449-R451 VanDerWaalsContact O-N 3.17Å; P449-L453 WeakPolarHBondContact O-CB 3.46Å; P449-L453 PolarHBondContact O-N 2.88Å
450	D	80.6	Confident	83.4	Confident	100 Å²	100	67.6 Å²	67.6	54%	0.535	37%	0.365	S	S	.	.	H	α-helix	trans	-68.9	-13.3	179.9	-64.7	-14.7	0	0	0	114.1	Y411 I448	Y411-D450 VanDerWaalsContact OH-CB 3.24Å; Y411-D450 WeakPolarHBondContact OH-CB 3.45Å; Y411-D450 PolarHBondContact OH-OD2 3.06Å; I448-D450 PolarHBondContact O-N 3.43Å
451	R	84.1	Confident	83.4	Confident	124 Å²	124	67.3 Å²	67.3	47%	0.468	37%	0.365	S	S	.	.	H	α-helix	trans	-108.3	-43.8	-176.8	-173.2	-173.4	68.8	-169.1	-4.2	112.5	E439 L446 I448 P449	E439-R451 VanDerWaalsContact CD-NH1 3.29Å; E439-R451 IonicContact OE1-CZ 2.68Å; E439-R451 IonicContact OE1-NH1 3.64Å; E439-R451 PolarHBondContact OE1-NH1 2.86Å; E439-R451 IonicContact OE1-NH2 2.72Å; E439-R451 PolarHBondContact OE1-NH2 2.83Å; E439-R451 IonicContact OE2-CZ 3.52Å; E439-R451 IonicContact OE2-NH1 3.97Å; E439-R451 PolarHBondContact OE2-NH1 2.97Å; E439-R451 IonicContact OE2-NH2 2.66Å; L446-R451 PolarHBondContact O-NH2 2.72Å; L446-R451 VanDerWaalsContact O-NH2 3.12Å; I448-R451 HydrophobicContact CB-CB 4.16Å; I448-R451 HydrophobicContact CG2-CB 4.3Å; I448-R451 PolarHBondContact O-N 2.81Å; P449-R451 PolarHBondContact O-N 3.41Å; P449-R451 VanDerWaalsContact O-N 3.17Å
452	D	84.8	Confident	83.5	Confident	48 Å²	48	62.7 Å²	62.7	26%	0.257	34%	0.344	S	S	.	.	H	α-helix	trans	-108.7	-14.6	-163.9	-55.7	-39.3	0	0	0	113	F447 I448	F447-D452 HydrophobicContact CD2-CB 3.78Å; F447-D452 HydrophobicContact CE2-CB 3.57Å; F447-D452 HydrophobicContact CG-CB 4.35Å; F447-D452 HydrophobicContact CZ-CB 3.99Å; I448-D452 PolarHBondContact N-OD2 3.36Å; I448-D452 PolarHBondContact O-N 2.89Å
453	L	84.1	Confident	83.7	Confident	25 Å²	25	61.4 Å²	61.4	13%	0.131	34%	0.339	C	S	.	.			trans	-90.8	114.3	179.3	-168.8	68.6	0	0	0	110.9	F447 P449 P455 Y459 D462 V463	F447-L453 HydrophobicContact CE1-CB 4.22Å; F447-L453 HydrophobicContact CE1-CD1 4.45Å; F447-L453 HydrophobicContact CZ-CB 3.84Å; F447-L453 HydrophobicContact CZ-CD1 3.92Å; F447-L453 HydrophobicContact CZ-CG 4.49Å; P449-L453 WeakPolarHBondContact O-CB 3.46Å; P449-L453 PolarHBondContact O-N 2.88Å; L453-P455 WeakPolarHBondContact O-CD 3.18Å; L453-Y459 HydrophobicContact CD2-CD2 3.92Å; L453-Y459 HydrophobicContact CD2-CE2 3.51Å; L453-D462 HydrophobicContact CD1-CB 3.83Å; L453-V463 HydrophobicContact CD2-CG2 4.18Å
454	I	79.8	Confident	83.9	Confident	152 Å²	152	59.7 Å²	59.7	78%	0.779	32%	0.322	S	S	*	.			trans	-90.8	106.9	164.6	-57.8	174.3	0	0	0	106.4	T456	I454-T456 PolarHBondContact O-N 2.98Å
455	P	70.2	Confident	83.9	Confident	93 Å²	93	65.3 Å²	65.3	60%	0.604	34%	0.343	S	S	*	.			trans	-68.7	116.3	-171.7	26.3	-34.1	0	0	0	111.1	L453	L453-P455 WeakPolarHBondContact O-CD 3.18Å
456	T	72.6	Confident	83.9	Confident	83 Å²	83	61.1 Å²	61.1	51%	0.509	33%	0.326	S	S	.	.			trans	-80.7	176.4	166.9	-23	0	0	0	0	109.4	I454 T458 D462	I454-T456 PolarHBondContact O-N 2.98Å; T456-T458 PolarHBondContact O-N 2.79Å; T456-D462 WeakPolarHBondContact CB-OD2 3.21Å; T456-D462 PolarHBondContact N-OD2 2.84Å; T456-D462 VanDerWaalsContact OG1-CG 3.31Å; T456-D462 PolarHBondContact OG1-OD1 2.71Å; T456-D462 PolarHBondContact OG1-OD2 2.82Å
457	G	76.5	Confident	83.9	Confident	83 Å²	83	61.2 Å²	61.2	86%	0.856	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-5.6	176.2	0	0	0	0	0	115.2
458	T	81.6	Confident	83.8	Confident	62 Å²	62	63.6 Å²	63.6	38%	0.38	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.3	57.3	-178.9	54.5	0	0	0	0	112.3	T456 I460 E461 D462	T456-T458 PolarHBondContact O-N 2.79Å; T458-I460 PolarHBondContact O-N 3.32Å; T458-E461 WeakPolarHBondContact CB-OE2 3.35Å; T458-E461 WeakPolarHBondContact CG2-OE2 3.17Å; T458-E461 WeakPolarHBondContact O-CA 3.46Å; T458-E461 WeakPolarHBondContact O-CB 3.45Å; T458-E461 PolarHBondContact O-N 2.66Å; T458-E461 PolarHBondContact OG1-OE2 2.97Å; T458-D462 PolarHBondContact O-N 3.02Å; T458-D462 VanDerWaalsContact O-N 3.11Å
459	Y	83.2	Confident	83.8	Confident	117 Å²	117	65.3 Å²	65.3	46%	0.459	35%	0.346	S	S	.	.	H	α-helix	trans	-39.1	-43.5	179.5	177.3	-94.5	0	0	0	115.6	L453 D462 V463 I489	L453-Y459 HydrophobicContact CD2-CD2 3.92Å; L453-Y459 HydrophobicContact CD2-CE2 3.51Å; Y459-D462 PolarHBondContact O-N 3Å; Y459-V463 HydrophobicContact CD1-CG2 4.43Å; Y459-V463 HydrophobicContact CE1-CG2 3.99Å; Y459-V463 HydrophobicContact CE2-CG2 4.36Å; Y459-V463 WeakPolarHBondContact O-CG2 3.45Å; Y459-V463 PolarHBondContact O-N 2.64Å; Y459-I489 HydrophobicContact CE1-CD1 4.06Å
460	I	83.4	Confident	84.1	Confident	90 Å²	90	64.4 Å²	64.4	46%	0.462	34%	0.341	S	S	.	.	H	α-helix	trans	-66.7	-39.2	-179.5	-63.2	174.8	0	0	0	111.7	T458 A464 E493	T458-I460 PolarHBondContact O-N 3.32Å; I460-A464 WeakPolarHBondContact O-CB 3.04Å; I460-A464 PolarHBondContact O-N 3.02Å; I460-E493 HydrophobicContact CG2-CB 3.92Å; I460-E493 HydrophobicContact CG2-CG 3.48Å; I460-E493 VanDerWaalsContact CG2-CG 3.48Å
461	E	84.9	Confident	84.5	Confident	126 Å²	126	61.9 Å²	61.9	59%	0.589	33%	0.325	S	S	*	.	H	α-helix	trans	-69.8	-37.7	176.8	-59.8	177.7	165.7	0	0	111.2	T458 A464 R465	T458-E461 WeakPolarHBondContact CB-OE2 3.35Å; T458-E461 WeakPolarHBondContact CG2-OE2 3.17Å; T458-E461 WeakPolarHBondContact O-CA 3.46Å; T458-E461 WeakPolarHBondContact O-CB 3.45Å; T458-E461 PolarHBondContact O-N 2.66Å; T458-E461 PolarHBondContact OG1-OE2 2.97Å; E461-A464 PolarHBondContact O-N 2.87Å; E461-R465 WeakPolarHBondContact O-CB 3.25Å; E461-R465 PolarHBondContact O-N 3.22Å
462	D	86.8	Confident	84.8	Confident	7 Å²	7	57.7 Å²	57.7	4%	0.037	31%	0.309	C	S	.	.	H	α-helix	trans	-62.5	-46.5	174.3	-71.4	-40.5	0	0	0	111.3	L453 T456 T458 Y459 A464 R465 C466	L453-D462 HydrophobicContact CD1-CB 3.83Å; T456-D462 WeakPolarHBondContact CB-OD2 3.21Å; T456-D462 PolarHBondContact N-OD2 2.84Å; T456-D462 VanDerWaalsContact OG1-CG 3.31Å; T456-D462 PolarHBondContact OG1-OD1 2.71Å; T456-D462 PolarHBondContact OG1-OD2 2.82Å; T458-D462 PolarHBondContact O-N 3.02Å; T458-D462 VanDerWaalsContact O-N 3.11Å; Y459-D462 PolarHBondContact O-N 3Å; D462-A464 PolarHBondContact O-N 2.75Å; D462-R465 WeakPolarHBondContact O-CB 3.08Å; D462-R465 PolarHBondContact O-N 2.95Å; D462-R465 IonicContact OD1-CZ 3.33Å; D462-R465 IonicContact OD1-NE 2.68Å; D462-R465 IonicContact OD1-NH2 3.4Å; D462-R465 PolarHBondContact OD1-NH2 3.07Å; D462-C466 PolarHBondContact O-N 3.02Å; D462-C466 PolarHBondContact O-SG 3.36Å
463	V	88.4	Confident	85.2	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-59.7	-45.9	174.5	170.5	0	0	0	0	111.2	Y408 L453 Y459 R465 C466 V467 I489 L496	Y408-V463 HydrophobicContact CE2-CG1 4.45Å; Y408-V463 WeakPolarHBondContact OH-CG1 3.15Å; L453-V463 HydrophobicContact CD2-CG2 4.18Å; Y459-V463 HydrophobicContact CD1-CG2 4.43Å; Y459-V463 HydrophobicContact CE1-CG2 3.99Å; Y459-V463 HydrophobicContact CE2-CG2 4.36Å; Y459-V463 WeakPolarHBondContact O-CG2 3.45Å; Y459-V463 PolarHBondContact O-N 2.64Å; V463-R465 VanDerWaalsContact C-N 3.29Å; V463-R465 PolarHBondContact O-N 2.9Å; V463-C466 PolarHBondContact O-N 2.66Å; V463-V467 HydrophobicContact CG1-CG2 4.28Å; V463-V467 VanDerWaalsContact O-CG2 3.32Å; V463-V467 WeakPolarHBondContact O-CG2 3.42Å; V463-V467 PolarHBondContact O-N 3.44Å; V463-I489 HydrophobicContact CB-CD1 4.02Å; V463-I489 HydrophobicContact CG1-CD1 3.81Å; V463-I489 HydrophobicContact CG1-CG1 4.43Å; V463-I489 HydrophobicContact CG2-CD1 4.09Å; V463-L496 HydrophobicContact CG1-CD1 4.31Å
464	A	88.4	Confident	85.7	Confident	4 Å²	4	54.3 Å²	54.3	3%	0.033	29%	0.291	C	S	.	.	H	α-helix	trans	-59.9	-38.9	177.8	0	0	0	0	0	112.3	I460 E461 D462 D468 L496	I460-A464 WeakPolarHBondContact O-CB 3.04Å; I460-A464 PolarHBondContact O-N 3.02Å; E461-A464 PolarHBondContact O-N 2.87Å; D462-A464 PolarHBondContact O-N 2.75Å; A464-D468 VanDerWaalsContact O-CB 3.32Å; A464-D468 WeakPolarHBondContact O-CB 3.45Å; A464-D468 PolarHBondContact O-N 3.25Å; A464-D468 VanDerWaalsContact O-N 3.08Å; A464-L496 HydrophobicContact CB-CD1 4.46Å; A464-L496 HydrophobicContact CB-CD2 4.45Å; A464-L496 HydrophobicContact CB-CG 4.14Å
465	R	88	Confident	86.3	Confident	124 Å²	124	47.1 Å²	47.1	47%	0.468	25%	0.254	S	S	.	.	H	α-helix	trans	-66.1	-43.1	173.4	173.6	173.2	60.2	144.3	-4.7	112.7	E461 D462 V463 D468 Q469	E461-R465 WeakPolarHBondContact O-CB 3.25Å; E461-R465 PolarHBondContact O-N 3.22Å; D462-R465 WeakPolarHBondContact O-CB 3.08Å; D462-R465 PolarHBondContact O-N 2.95Å; D462-R465 IonicContact OD1-CZ 3.33Å; D462-R465 IonicContact OD1-NE 2.68Å; D462-R465 IonicContact OD1-NH2 3.4Å; D462-R465 PolarHBondContact OD1-NH2 3.07Å; V463-R465 VanDerWaalsContact C-N 3.29Å; V463-R465 PolarHBondContact O-N 2.9Å; R465-D468 WeakPolarHBondContact O-CB 3.31Å; R465-D468 PolarHBondContact O-N 3.43Å; R465-Q469 WeakPolarHBondContact O-CG 3.31Å; R465-Q469 PolarHBondContact O-N 3.44Å
466	C	89.3	Confident	87.3	Confident	8 Å²	8	42.7 Å²	42.7	5%	0.054	23%	0.225	C	C	.	.	H	α-helix	trans	-71	-32.9	-179.1	-64.7	0	0	0	0	112.8	Y408 F447 D462 V463 Q469 S470	Y408-C466 HydrophobicContact CD2-CB 4.26Å; Y408-C466 HydrophobicContact CE2-CB 4.17Å; F447-C466 HydrophobicContact CD1-CB 3.97Å; F447-C466 HydrophobicContact CD2-CB 4.13Å; F447-C466 HydrophobicContact CE1-CB 3.69Å; F447-C466 HydrophobicContact CE2-CB 3.88Å; F447-C466 VanDerWaalsContact CE2-SG 3.51Å; F447-C466 HydrophobicContact CG-CB 4.18Å; F447-C466 HydrophobicContact CZ-CB 3.66Å; F447-C466 WeakPolarHBondContact CZ-SG 3.36Å; D462-C466 PolarHBondContact O-N 3.02Å; D462-C466 PolarHBondContact O-SG 3.36Å; V463-C466 PolarHBondContact O-N 2.66Å; C466-Q469 PolarHBondContact O-N 3.47Å; C466-S470 PolarHBondContact O-N 3.25Å; C466-S470 PolarHBondContact O-OG 2.97Å
467	V	90	Very high	88	Confident	1 Å²	1	38.8 Å²	38.8	1%	0.006	20%	0.201	C	C	.	.	H	α-helix	trans	-68.4	-39.5	170.9	176.8	0	0	0	0	110.8	Y408 V463 S470 F490 L496 M499 I505	Y408-V467 HydrophobicContact CD1-CG2 4.02Å; Y408-V467 HydrophobicContact CD2-CG2 3.61Å; Y408-V467 HydrophobicContact CE1-CG2 4.13Å; Y408-V467 HydrophobicContact CE2-CG2 3.73Å; Y408-V467 HydrophobicContact CG-CG2 3.76Å; V463-V467 HydrophobicContact CG1-CG2 4.28Å; V463-V467 VanDerWaalsContact O-CG2 3.32Å; V463-V467 WeakPolarHBondContact O-CG2 3.42Å; V463-V467 PolarHBondContact O-N 3.44Å; V467-S470 WeakPolarHBondContact O-CB 3.36Å; V467-S470 PolarHBondContact O-N 2.92Å; V467-S470 VanDerWaalsContact O-N 3.09Å; V467-F490 HydrophobicContact CG2-CE1 4.21Å; V467-L496 HydrophobicContact CB-CD2 3.65Å; V467-L496 HydrophobicContact CG1-CD2 3.64Å; V467-L496 HydrophobicContact CG2-CD2 3.88Å; V467-M499 HydrophobicContact CG1-CE 4.15Å; V467-M499 HydrophobicContact CG1-SD 4.44Å; V467-I505 HydrophobicContact CG1-CD1 3.72Å; V467-I505 WeakPolarHBondContact O-CD1 3.49Å
468	D	89	Confident	88.5	Confident	55 Å²	55	35 Å²	35	29%	0.294	16%	0.162	S	C	.	.	H	α-helix	trans	-63	-39.1	173.3	-170	84.1	0	0	0	112.7	K403 A464 R465 S470 R495 M499	K403-D468 WeakPolarHBondContact CD-O 3.33Å; K403-D468 WeakPolarHBondContact CE-O 3.22Å; A464-D468 VanDerWaalsContact O-CB 3.32Å; A464-D468 WeakPolarHBondContact O-CB 3.45Å; A464-D468 PolarHBondContact O-N 3.25Å; A464-D468 VanDerWaalsContact O-N 3.08Å; R465-D468 WeakPolarHBondContact O-CB 3.31Å; R465-D468 PolarHBondContact O-N 3.43Å; D468-S470 PolarHBondContact O-N 3.15Å; D468-S470 VanDerWaalsContact O-N 3.15Å; D468-R495 IonicContact OD1-CZ 3.19Å; D468-R495 IonicContact OD1-NE 3.79Å; D468-R495 IonicContact OD1-NH2 2.73Å; D468-R495 PolarHBondContact OD1-NH2 2.77Å; D468-R495 IonicContact OD2-NH2 3.08Å; D468-R495 PolarHBondContact OD2-NH2 3.2Å; D468-M499 HydrophobicContact CB-CE 4.36Å
469	Q	89	Confident	88.5	Confident	51 Å²	51	33.1 Å²	33.1	24%	0.238	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	4.2	172.3	-72	177.1	-63.7	0	0	114.2	K403 D404 Y405 R465 C466	K403-Q469 CarbonylContact C-O 3.59Å; K403-Q469 WeakPolarHBondContact CB-O 3.35Å; D404-Q469 PolarHBondContact N-O 3.23Å; D404-Q469 VanDerWaalsContact N-O 3.09Å; D404-Q469 PolarHBondContact OD2-NE2 2.85Å; Y405-Q469 HydrophobicContact CD2-CB 4.29Å; Y405-Q469 PolarHBondContact N-O 3Å; R465-Q469 WeakPolarHBondContact O-CG 3.31Å; R465-Q469 PolarHBondContact O-N 3.44Å; C466-Q469 PolarHBondContact O-N 3.47Å
470	S	90.5	Very high	88.4	Confident	0 Å²	0	29 Å²	29	0%	0	14%	0.136	C	C	.	.	B	Isolated β-bridge	trans	-113.4	132	-175.9	-65.4	0	0	0	0	113.2	Y405 Y408 C466 V467 D468 R472 I505	Y405-S470 CarbonylContact O-C 3.56Å; Y405-S470 WeakPolarHBondContact O-CA 3.47Å; Y408-S470 PolarHBondContact N-OG 2.81Å; C466-S470 PolarHBondContact O-N 3.25Å; C466-S470 PolarHBondContact O-OG 2.97Å; V467-S470 WeakPolarHBondContact O-CB 3.36Å; V467-S470 PolarHBondContact O-N 2.92Å; V467-S470 VanDerWaalsContact O-N 3.09Å; D468-S470 PolarHBondContact O-N 3.15Å; D468-S470 VanDerWaalsContact O-N 3.15Å; S470-R472 VanDerWaalsContact C-N 3.31Å; S470-R472 PolarHBondContact O-N 3.04Å; S470-I505 WeakPolarHBondContact O-CD1 3.38Å
471	K	89.3	Confident	88.6	Confident	46 Å²	46	24.7 Å²	24.7	20%	0.2	12%	0.115	C	C	.	.	S	Bend	trans	-69.5	-23.9	179.6	-64.8	178.4	-176.9	175.6	0	113.7	K403 Y405 D406 P560	K403-K471 HydrophobicContact CB-CG 4.2Å; K403-K471 HydrophobicContact CD-CG 4.42Å; Y405-K471 PolarHBondContact O-N 3.41Å; D406-K471 IonicContact OD1-NZ 3.28Å; K471-P560 HydrophobicContact CB-CG 3.89Å; K471-P560 HydrophobicContact CD-CB 4.25Å; K471-P560 HydrophobicContact CD-CG 4.17Å
472	R	91.8	Very high	88.5	Confident	37 Å²	37	18.7 Å²	18.7	14%	0.14	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	158.9	177.3	-55.8	-65.5	178	-97.4	-1.9	110.4	E397 D406 A407 Y408 S470 K506 I508 E558 P560	E397-R472 IonicContact OE2-NH2 3.62Å; D406-R472 PolarHBondContact O-N 3.44Å; A407-R472 CarbonylContact C-O 3.59Å; A407-R472 VanDerWaalsContact CA-O 3.24Å; A407-R472 WeakPolarHBondContact CA-O 3.43Å; A407-R472 HydrophobicContact CB-CB 3.9Å; Y408-R472 PolarHBondContact N-O 3.28Å; S470-R472 VanDerWaalsContact C-N 3.31Å; S470-R472 PolarHBondContact O-N 3.04Å; R472-K506 WeakPolarHBondContact CA-O 3.49Å; R472-I508 HydrophobicContact CB-CD1 4.45Å; R472-I508 HydrophobicContact CG-CD1 4.43Å; R472-E558 PolarHBondContact NE-O 3.34Å; R472-P560 HydrophobicContact CG-CG 3.85Å
473	L	93.2	Very high	88.3	Confident	1 Å²	1	21.8 Å²	21.8	1%	0.005	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	115.6	168.9	171.2	57.3	0	0	0	108.8	Y408 I475 F490 L500 I505 K506 V507 I508	Y408-L473 HydrophobicContact CD1-CD1 3.5Å; Y408-L473 HydrophobicContact CE1-CD1 4.27Å; Y408-L473 HydrophobicContact CG-CD1 4.25Å; L473-I475 HydrophobicContact CD1-CG1 4.18Å; L473-I475 HydrophobicContact CD2-CD1 4.14Å; L473-I475 HydrophobicContact CD2-CG1 4.36Å; L473-I475 HydrophobicContact CG-CD1 4.27Å; L473-I475 HydrophobicContact CG-CG1 3.98Å; L473-F490 HydrophobicContact CD1-CE1 4.05Å; L473-F490 HydrophobicContact CD1-CZ 3.84Å; L473-F490 HydrophobicContact CD2-CD1 4.1Å; L473-F490 HydrophobicContact CD2-CE1 3.74Å; L473-F490 HydrophobicContact CD2-CZ 4.02Å; L473-L500 HydrophobicContact CD2-CD2 4.09Å; L473-I505 HydrophobicContact CB-CD1 3.85Å; L473-I505 HydrophobicContact CB-CG1 4.18Å; L473-K506 PolarHBondContact N-O 2.94Å; L473-V507 HydrophobicContact CB-CG2 4.36Å; L473-V507 HydrophobicContact CD2-CG2 4.23Å; L473-V507 HydrophobicContact CG-CG1 4.42Å; L473-V507 CarbonylContact O-C 3.54Å; L473-V507 VanDerWaalsContact O-CA 3.3Å; L473-V507 WeakPolarHBondContact O-CA 3.42Å; L473-I508 PolarHBondContact O-N 3.02Å
474	I	93.8	Very high	88.1	Confident	0 Å²	0	27 Å²	27	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	123.4	173.5	-57.5	171.3	0	0	0	107.9	A407 Y408 L409 S410 L434 L438 L446 V476 I508 I510 M559	A407-I474 HydrophobicContact CB-CD1 3.71Å; A407-I474 HydrophobicContact CB-CG1 3.97Å; Y408-I474 PolarHBondContact O-N 3.03Å; L409-I474 HydrophobicContact CD1-CB 3.93Å; L409-I474 HydrophobicContact CD1-CG2 3.69Å; S410-I474 PolarHBondContact N-O 2.02Å; L434-I474 HydrophobicContact CD2-CG2 4.33Å; L438-I474 HydrophobicContact CD1-CD1 3.78Å; L446-I474 HydrophobicContact CD2-CD1 4.47Å; I474-V476 HydrophobicContact CG2-CG2 4.32Å; I474-I508 CarbonylContact C-O 3.41Å; I474-I508 WeakPolarHBondContact CA-O 3.46Å; I474-I508 HydrophobicContact CG1-CB 4.24Å; I474-I508 HydrophobicContact CG1-CD1 4.36Å; I474-I510 HydrophobicContact CG2-CD1 3.78Å; I474-I510 HydrophobicContact CG2-CG1 4.34Å; I474-M559 HydrophobicContact CD1-SD 4.03Å
475	I	92.4	Very high	87.9	Confident	1 Å²	1	31.9 Å²	31.9	1%	0.005	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	116.1	175.3	-61.3	175.8	0	0	0	107.8	L473 M477 Y481 F490 V507 I508 L509 I510	L473-I475 HydrophobicContact CD1-CG1 4.18Å; L473-I475 HydrophobicContact CD2-CD1 4.14Å; L473-I475 HydrophobicContact CD2-CG1 4.36Å; L473-I475 HydrophobicContact CG-CD1 4.27Å; L473-I475 HydrophobicContact CG-CG1 3.98Å; I475-M477 HydrophobicContact CG2-CG 4.08Å; I475-Y481 HydrophobicContact CG2-CD1 4.46Å; I475-Y481 HydrophobicContact CG2-CE1 3.57Å; I475-Y481 WeakPolarHBondContact CG2-OH 3.39Å; I475-F490 HydrophobicContact CD1-CD2 4.41Å; I475-F490 HydrophobicContact CD1-CE2 4.15Å; I475-F490 HydrophobicContact CG1-CE2 4.45Å; I475-V507 HydrophobicContact CD1-CG1 3.88Å; I475-V507 HydrophobicContact CG1-CG1 4.25Å; I475-I508 PolarHBondContact N-O 3.32Å; I475-L509 HydrophobicContact CB-CD1 3.64Å; I475-L509 HydrophobicContact CD1-CD1 4.38Å; I475-L509 HydrophobicContact CG2-CD1 3.63Å; I475-I510 PolarHBondContact O-N 3.24Å
476	V	91	Very high	87.7	Confident	0 Å²	0	27 Å²	27	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	102.9	176.9	-169.5	0	0	0	0	109.1	L409 S410 F429 A430 L434 I474 T478	L409-V476 HydrophobicContact CD1-CG2 3.77Å; S410-V476 PolarHBondContact O-N 3.08Å; F429-V476 HydrophobicContact CD1-CG1 4.41Å; F429-V476 HydrophobicContact CE1-CG1 4.23Å; A430-V476 HydrophobicContact CB-CB 4.35Å; A430-V476 HydrophobicContact CB-CG1 3.89Å; L434-V476 HydrophobicContact CD2-CG2 3.51Å; I474-V476 HydrophobicContact CG2-CG2 4.32Å; V476-T478 HydrophobicContact CG1-CG2 4.16Å; V476-T478 PolarHBondContact O-N 2.95Å; V476-T478 VanDerWaalsContact O-N 3.11Å
477	M	87.7	Confident	87.6	Confident	1 Å²	1	26.7 Å²	26.7	1%	0.005	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	87.2	178.4	-60.4	-164	-52.6	0	0	109.9	I475 Y481 L509 I510 E511 C512 L515 V524	I475-M477 HydrophobicContact CG2-CG 4.08Å; M477-Y481 HydrophobicContact CG-CD1 4.46Å; M477-L509 HydrophobicContact CE-CD1 4.07Å; M477-L509 HydrophobicContact CE-CD2 3.62Å; M477-L509 HydrophobicContact CE-CG 3.63Å; M477-L509 HydrophobicContact CG-CD1 3.63Å; M477-L509 HydrophobicContact CG-CG 4.16Å; M477-L509 HydrophobicContact SD-CD1 3.49Å; M477-L509 WeakPolarHBondContact SD-CD1 3.47Å; M477-L509 HydrophobicContact SD-CD2 3.81Å; M477-L509 HydrophobicContact SD-CG 3.74Å; M477-I510 PolarHBondContact N-O 3.32Å; M477-E511 HydrophobicContact CE-CB 4.46Å; M477-E511 HydrophobicContact CE-CG 3.36Å; M477-C512 WeakPolarHBondContact O-CB 3.32Å; M477-C512 PolarHBondContact O-N 2.86Å; M477-C512 VanDerWaalsContact O-N 3.15Å; M477-L515 HydrophobicContact CB-CD1 3.88Å; M477-L515 HydrophobicContact CE-CD1 3.77Å; M477-V524 HydrophobicContact CE-CG1 3.9Å; M477-V524 HydrophobicContact SD-CG1 3.41Å; M477-V524 WeakPolarHBondContact SD-CG1 3.34Å
478	T	85.9	Confident	87.4	Confident	4 Å²	4	28.8 Å²	28.8	3%	0.025	14%	0.143	C	C	.	.			trans	-81.2	159.4	161	67.8	0	0	0	0	110	E426 V476 N480 Y481 V482	E426-T478 HydrophobicContact CB-CG2 4.01Å; V476-T478 HydrophobicContact CG1-CG2 4.16Å; V476-T478 PolarHBondContact O-N 2.95Å; V476-T478 VanDerWaalsContact O-N 3.11Å; T478-N480 PolarHBondContact O-N 2.99Å; T478-Y481 WeakPolarHBondContact O-CB 3.39Å; T478-Y481 PolarHBondContact O-N 2.87Å; T478-Y481 PolarHBondContact OG1-N 2.84Å; T478-Y481 VanDerWaalsContact OG1-N 3.15Å; T478-V482 PolarHBondContact O-N 3Å; T478-V482 VanDerWaalsContact O-N 3.13Å
479	P	83	Confident	87.3	Confident	22 Å²	22	28 Å²	28	14%	0.143	14%	0.138	C	C	.	.	H	α-helix	trans	-49.2	-43.6	170.8	-30.9	38.4	0	0	0	112.9	E426 Y481 V482 V483 L515 I518	E426-P479 VanDerWaalsContact CD-CD 3.44Å; E426-P479 WeakPolarHBondContact OE1-CD 3.4Å; E426-P479 WeakPolarHBondContact OE2-CD 3.41Å; E426-P479 VanDerWaalsContact OE2-CG 3.29Å; E426-P479 WeakPolarHBondContact OE2-CG 3.39Å; P479-Y481 VanDerWaalsContact C-N 3.35Å; P479-Y481 PolarHBondContact O-N 2.85Å; P479-V482 PolarHBondContact O-N 3.24Å; P479-V482 VanDerWaalsContact O-N 3.14Å; P479-V483 WeakPolarHBondContact O-CG2 3.49Å; P479-V483 PolarHBondContact O-N 2.88Å; P479-L515 HydrophobicContact CG-CD2 4.35Å; P479-I518 HydrophobicContact CB-CD1 3.65Å; P479-I518 HydrophobicContact CG-CD1 3.88Å
480	N	81.1	Confident	87.2	Confident	30 Å²	30	25.6 Å²	25.6	16%	0.16	13%	0.127	C	C	.	.	H	α-helix	trans	-66.3	-35.2	179	-67.6	-32	0	0	0	112.3	T412 V414 E427 T478 V482 R484	T412-N480 HydrophobicContact CG2-CB 3.93Å; V414-N480 HydrophobicContact CG2-CB 3.64Å; E427-N480 PolarHBondContact OE1-ND2 2.85Å; T478-N480 PolarHBondContact O-N 2.99Å; N480-V482 VanDerWaalsContact C-N 3.3Å; N480-V482 PolarHBondContact O-N 2.82Å; N480-R484 WeakPolarHBondContact O-CB 3.38Å; N480-R484 WeakPolarHBondContact O-CG 3.27Å; N480-R484 PolarHBondContact O-N 2.77Å
481	Y	86.3	Confident	86.9	Confident	1 Å²	1	29.4 Å²	29.4	0%	0.004	15%	0.145	C	C	.	.	H	α-helix	trans	-63.5	-37.1	173	-169.7	-93.2	0	0	0	111.6	S410 T412 I475 M477 T478 P479 R485 G486 W487	S410-Y481 PolarHBondContact OG-OH 3.36Å; T412-Y481 HydrophobicContact CG2-CD2 4.46Å; I475-Y481 HydrophobicContact CG2-CD1 4.46Å; I475-Y481 HydrophobicContact CG2-CE1 3.57Å; I475-Y481 WeakPolarHBondContact CG2-OH 3.39Å; M477-Y481 HydrophobicContact CG-CD1 4.46Å; T478-Y481 WeakPolarHBondContact O-CB 3.39Å; T478-Y481 PolarHBondContact O-N 2.87Å; T478-Y481 PolarHBondContact OG1-N 2.84Å; T478-Y481 VanDerWaalsContact OG1-N 3.15Å; P479-Y481 VanDerWaalsContact C-N 3.35Å; P479-Y481 PolarHBondContact O-N 2.85Å; Y481-R485 PolarHBondContact O-N 3.17Å; Y481-G486 PolarHBondContact O-N 2.84Å; Y481-G486 PolarHBondContact OH-O 2.68Å; Y481-W487 HydrophobicContact CD1-CE3 4.14Å; Y481-W487 HydrophobicContact CE1-CB 4.13Å; Y481-W487 AromaticContact CE1-CE3 3.96Å; Y481-W487 HydrophobicContact CE1-CE3 3.96Å; Y481-W487 WeakPolarHBondContact OH-CA 3.34Å; Y481-W487 PolarHBondContact OH-N 3.47Å
482	V	84.5	Confident	86.7	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-74	-44.4	178.7	-178.8	0	0	0	0	112.5	T478 P479 N480 R484 R485 W487 L515 I518 N520 V524	T478-V482 PolarHBondContact O-N 3Å; T478-V482 VanDerWaalsContact O-N 3.13Å; P479-V482 PolarHBondContact O-N 3.24Å; P479-V482 VanDerWaalsContact O-N 3.14Å; N480-V482 VanDerWaalsContact C-N 3.3Å; N480-V482 PolarHBondContact O-N 2.82Å; V482-R484 VanDerWaalsContact C-N 3.32Å; V482-R484 PolarHBondContact O-N 2.86Å; V482-R485 PolarHBondContact O-N 2.82Å; V482-W487 HydrophobicContact CB-CZ3 4.31Å; V482-W487 HydrophobicContact CG1-CH2 4.25Å; V482-W487 HydrophobicContact CG1-CZ3 4.22Å; V482-W487 HydrophobicContact CG2-CZ3 4.31Å; V482-L515 HydrophobicContact CG2-CD2 4.3Å; V482-I518 HydrophobicContact CB-CG2 4.32Å; V482-I518 HydrophobicContact CG1-CG2 4.1Å; V482-N520 HydrophobicContact CG1-CB 4.48Å; V482-V524 HydrophobicContact CG1-CG2 3.98Å; V482-V524 HydrophobicContact CG2-CG2 4.16Å
483	V	82.5	Confident	86.5	Confident	71 Å²	71	33.5 Å²	33.5	43%	0.43	17%	0.17	S	C	.	.	H	α-helix	trans	-61	-41.3	176	172.2	0	0	0	0	111.4	P479 R485 I518	P479-V483 WeakPolarHBondContact O-CG2 3.49Å; P479-V483 PolarHBondContact O-N 2.88Å; V483-R485 VanDerWaalsContact C-N 3.34Å; V483-R485 PolarHBondContact O-N 2.9Å; V483-I518 HydrophobicContact CG2-CG2 3.86Å
484	R	82.6	Confident	86.2	Confident	109 Å²	109	37.4 Å²	37.4	41%	0.411	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	2.9	-179.1	-64.7	179.7	174.2	-160.9	-3.4	114.7	K413 N480 V482 G486	K413-R484 PolarHBondContact O-NH1 3.03Å; N480-R484 WeakPolarHBondContact O-CB 3.38Å; N480-R484 WeakPolarHBondContact O-CG 3.27Å; N480-R484 PolarHBondContact O-N 2.77Å; V482-R484 VanDerWaalsContact C-N 3.32Å; V482-R484 PolarHBondContact O-N 2.86Å; R484-G486 VanDerWaalsContact C-N 3.32Å; R484-G486 PolarHBondContact O-N 3.03Å
485	R	85.2	Confident	86	Confident	108 Å²	108	42.5 Å²	42.5	41%	0.408	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.4	50.3	-173.5	-64.7	-177	171.3	165.3	3.2	112.8	Y481 V482 V483 W487 S488 E523	Y481-R485 PolarHBondContact O-N 3.17Å; V482-R485 PolarHBondContact O-N 2.82Å; V483-R485 VanDerWaalsContact C-N 3.34Å; V483-R485 PolarHBondContact O-N 2.9Å; R485-W487 HydrophobicContact CB-CZ2 4.27Å; R485-W487 HydrophobicContact CG-CH2 4.28Å; R485-W487 HydrophobicContact CG-CZ2 4.02Å; R485-W487 PolarHBondContact O-N 2.7Å; R485-S488 VanDerWaalsContact O-CB 3.23Å; R485-S488 WeakPolarHBondContact O-CB 3.3Å; R485-S488 PolarHBondContact O-N 2.76Å; R485-S488 PolarHBondContact O-OG 3.45Å; R485-E523 IonicContact CZ-OE1 3.79Å; R485-E523 VanDerWaalsContact CZ-OE1 3.28Å; R485-E523 IonicContact CZ-OE2 3.28Å; R485-E523 IonicContact NE-OE1 2.66Å; R485-E523 IonicContact NE-OE2 3.67Å; R485-E523 PolarHBondContact NE-OE2 2.82Å; R485-E523 IonicContact NH2-OE1 3.4Å; R485-E523 PolarHBondContact NH2-OE1 3.23Å; R485-E523 IonicContact NH2-OE2 2.65Å; R485-E523 PolarHBondContact NH2-OE2 2.84Å; R485-E523 VanDerWaalsContact NH2-OE2 3.08Å
486	G	83.9	Confident	85.9	Confident	22 Å²	22	42.6 Å²	42.6	23%	0.227	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-19	-174.3	0	0	0	0	0	115	Y481 R484	Y481-G486 PolarHBondContact O-N 2.84Å; Y481-G486 PolarHBondContact OH-O 2.68Å; R484-G486 VanDerWaalsContact C-N 3.32Å; R484-G486 PolarHBondContact O-N 3.03Å
487	W	86.8	Confident	85.8	Confident	1 Å²	1	47.7 Å²	47.7	0%	0.004	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-10.6	175.1	66	84.2	0	0	0	114.2	Y481 V482 R485 I489 F490 E491 E523 V524 L527	Y481-W487 HydrophobicContact CD1-CE3 4.14Å; Y481-W487 HydrophobicContact CE1-CB 4.13Å; Y481-W487 AromaticContact CE1-CE3 3.96Å; Y481-W487 HydrophobicContact CE1-CE3 3.96Å; Y481-W487 WeakPolarHBondContact OH-CA 3.34Å; Y481-W487 PolarHBondContact OH-N 3.47Å; V482-W487 HydrophobicContact CB-CZ3 4.31Å; V482-W487 HydrophobicContact CG1-CH2 4.25Å; V482-W487 HydrophobicContact CG1-CZ3 4.22Å; V482-W487 HydrophobicContact CG2-CZ3 4.31Å; R485-W487 HydrophobicContact CB-CZ2 4.27Å; R485-W487 HydrophobicContact CG-CH2 4.28Å; R485-W487 HydrophobicContact CG-CZ2 4.02Å; R485-W487 PolarHBondContact O-N 2.7Å; W487-I489 PolarHBondContact O-N 2.88Å; W487-F490 HydrophobicContact CB-CD2 4.17Å; W487-F490 WeakPolarHBondContact O-CB 3.36Å; W487-F490 VanDerWaalsContact O-CD2 3.27Å; W487-F490 WeakPolarHBondContact O-CD2 3.31Å; W487-F490 PolarHBondContact O-N 3.12Å; W487-E491 PolarHBondContact NE1-OE1 2.83Å; W487-E491 PolarHBondContact NE1-OE2 3.23Å; W487-E523 HydrophobicContact CH2-CB 4.47Å; W487-E523 HydrophobicContact CZ2-CB 3.81Å; W487-V524 HydrophobicContact CE3-CG2 4.31Å; W487-V524 HydrophobicContact CH2-CG2 3.57Å; W487-V524 HydrophobicContact CZ2-CG2 4.38Å; W487-V524 HydrophobicContact CZ3-CG2 3.48Å; W487-V524 VanDerWaalsContact CZ3-CG2 3.48Å; W487-L527 HydrophobicContact CB-CD2 3.65Å; W487-L527 HydrophobicContact CD2-CD2 4.1Å; W487-L527 HydrophobicContact CG-CD2 3.6Å
488	S	86	Confident	85.9	Confident	44 Å²	44	51.3 Å²	51.3	31%	0.308	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-31.7	-170.8	53.2	0	0	0	0	113.3	R485 F490 E491 L492	R485-S488 VanDerWaalsContact O-CB 3.23Å; R485-S488 WeakPolarHBondContact O-CB 3.3Å; R485-S488 PolarHBondContact O-N 2.76Å; R485-S488 PolarHBondContact O-OG 3.45Å; S488-F490 PolarHBondContact O-N 2.84Å; S488-E491 PolarHBondContact O-N 2.83Å; S488-L492 WeakPolarHBondContact O-CD1 3.32Å; S488-L492 PolarHBondContact O-N 2.97Å
489	I	85.9	Confident	86.1	Confident	38 Å²	38	51.2 Å²	51.2	20%	0.195	25%	0.252	C	S	.	.	H	α-helix	trans	-55.5	-33.6	173.5	-170.1	158.3	0	0	0	113.5	Y459 V463 W487 E491 E493 L496	Y459-I489 HydrophobicContact CE1-CD1 4.06Å; V463-I489 HydrophobicContact CB-CD1 4.02Å; V463-I489 HydrophobicContact CG1-CD1 3.81Å; V463-I489 HydrophobicContact CG1-CG1 4.43Å; V463-I489 HydrophobicContact CG2-CD1 4.09Å; W487-I489 PolarHBondContact O-N 2.88Å; I489-E491 VanDerWaalsContact C-N 3.32Å; I489-E493 WeakPolarHBondContact O-CB 3.46Å; I489-E493 PolarHBondContact O-N 2.76Å; I489-L496 HydrophobicContact CG1-CD1 4.25Å
490	F	86.8	Confident	86.4	Confident	1 Å²	1	50.3 Å²	50.3	0%	0.004	25%	0.246	C	C	.	.	H	α-helix	trans	-78.4	-14.6	177.2	-51	-70.5	0	0	0	113.7	Y408 V467 L473 I475 W487 S488 L496 R497 L500	Y408-F490 HydrophobicContact CE1-CZ 4.41Å; V467-F490 HydrophobicContact CG2-CE1 4.21Å; L473-F490 HydrophobicContact CD1-CE1 4.05Å; L473-F490 HydrophobicContact CD1-CZ 3.84Å; L473-F490 HydrophobicContact CD2-CD1 4.1Å; L473-F490 HydrophobicContact CD2-CE1 3.74Å; L473-F490 HydrophobicContact CD2-CZ 4.02Å; I475-F490 HydrophobicContact CD1-CD2 4.41Å; I475-F490 HydrophobicContact CD1-CE2 4.15Å; I475-F490 HydrophobicContact CG1-CE2 4.45Å; W487-F490 HydrophobicContact CB-CD2 4.17Å; W487-F490 WeakPolarHBondContact O-CB 3.36Å; W487-F490 VanDerWaalsContact O-CD2 3.27Å; W487-F490 WeakPolarHBondContact O-CD2 3.31Å; W487-F490 PolarHBondContact O-N 3.12Å; S488-F490 PolarHBondContact O-N 2.84Å; F490-L496 HydrophobicContact CD1-CB 4.26Å; F490-L496 HydrophobicContact CD1-CD1 3.86Å; F490-L496 HydrophobicContact CD1-CD2 4.15Å; F490-L496 HydrophobicContact CD1-CG 4.33Å; F490-L496 HydrophobicContact CE1-CD1 4.37Å; F490-L496 HydrophobicContact CE1-CD2 4.47Å; F490-R497 WeakPolarHBondContact O-CA 3.37Å; F490-R497 WeakPolarHBondContact O-CB 3.46Å; F490-R497 PolarHBondContact O-N 2.88Å; F490-L500 HydrophobicContact CB-CD1 3.81Å
491	E	84	Confident	86.9	Confident	81 Å²	81	52.3 Å²	52.3	38%	0.379	26%	0.259	S	S	.	.	H	α-helix	trans	-96.4	-39.8	175.9	-66.1	178.7	163.6	0	0	111.7	W487 S488 I489 L527	W487-E491 PolarHBondContact NE1-OE1 2.83Å; W487-E491 PolarHBondContact NE1-OE2 3.23Å; S488-E491 PolarHBondContact O-N 2.83Å; I489-E491 VanDerWaalsContact C-N 3.32Å; E491-L527 HydrophobicContact CG-CD1 4.47Å
492	L	85.6	Confident	87	Confident	136 Å²	136	55 Å²	55	71%	0.712	28%	0.276	S	S	*	.	H	α-helix	trans	-69.8	-40.2	178.9	-87.1	84.7	0	0	0	112.5	S488	S488-L492 WeakPolarHBondContact O-CD1 3.32Å; S488-L492 PolarHBondContact O-N 2.97Å
493	E	87.6	Confident	87	Confident	32 Å²	32	55.8 Å²	55.8	15%	0.15	28%	0.284	C	S	.	.	S	Bend	trans	-88.2	124.8	-177.7	-157.5	-66.5	109.3	0	0	110.7	I460 I489 R495 L496 R497	I460-E493 HydrophobicContact CG2-CB 3.92Å; I460-E493 HydrophobicContact CG2-CG 3.48Å; I460-E493 VanDerWaalsContact CG2-CG 3.48Å; I489-E493 WeakPolarHBondContact O-CB 3.46Å; I489-E493 PolarHBondContact O-N 2.76Å; E493-R495 PolarHBondContact O-N 3.43Å; E493-R495 PolarHBondContact OE1-N 2.96Å; E493-R495 WeakPolarHBondContact OE2-CA 3.34Å; E493-R495 VanDerWaalsContact OE2-CB 3.23Å; E493-R495 WeakPolarHBondContact OE2-CB 3.36Å; E493-R495 PolarHBondContact OE2-N 2.7Å; E493-L496 HydrophobicContact CB-CB 4.37Å; E493-L496 HydrophobicContact CB-CD1 4.09Å; E493-L496 HydrophobicContact CB-CG 4.4Å; E493-L496 WeakPolarHBondContact OE2-CG 3.41Å; E493-L496 PolarHBondContact OE2-N 3.41Å; E493-R497 WeakPolarHBondContact O-CB 3.16Å; E493-R497 PolarHBondContact O-N 3.24Å
494	T	87.7	Confident	87.2	Confident	84 Å²	84	57.8 Å²	57.8	52%	0.515	29%	0.288	S	S	.	.	H	α-helix	trans	-65.3	-36.3	-172.6	50.3	0	0	0	0	115.4	N498	T494-N498 WeakPolarHBondContact O-CB 3.44Å; T494-N498 PolarHBondContact O-N 2.83Å; T494-N498 PolarHBondContact O-ND2 2.75Å
495	R	89.2	Confident	87.5	Confident	107 Å²	107	52.7 Å²	52.7	40%	0.404	27%	0.269	S	S	.	.	H	α-helix	trans	-72	-47.4	179.4	169.6	-173.5	-177.3	172.2	7.5	110.3	D468 E493 R497 N498 M499	D468-R495 IonicContact OD1-CZ 3.19Å; D468-R495 IonicContact OD1-NE 3.79Å; D468-R495 IonicContact OD1-NH2 2.73Å; D468-R495 PolarHBondContact OD1-NH2 2.77Å; D468-R495 IonicContact OD2-NH2 3.08Å; D468-R495 PolarHBondContact OD2-NH2 3.2Å; E493-R495 PolarHBondContact O-N 3.43Å; E493-R495 PolarHBondContact OE1-N 2.96Å; E493-R495 WeakPolarHBondContact OE2-CA 3.34Å; E493-R495 VanDerWaalsContact OE2-CB 3.23Å; E493-R495 WeakPolarHBondContact OE2-CB 3.36Å; E493-R495 PolarHBondContact OE2-N 2.7Å; R495-R497 PolarHBondContact O-N 2.89Å; R495-N498 WeakPolarHBondContact O-CB 3.46Å; R495-N498 PolarHBondContact O-N 3.12Å; R495-N498 VanDerWaalsContact O-N 3.17Å; R495-M499 HydrophobicContact CG-SD 4.45Å; R495-M499 WeakPolarHBondContact O-CG 3.38Å; R495-M499 PolarHBondContact O-N 2.59Å
496	L	90.1	Very high	87.7	Confident	2 Å²	2	49.7 Å²	49.7	1%	0.01	26%	0.259	C	S	.	.	H	α-helix	trans	-56.3	-48.4	172	-70.4	177.4	0	0	0	111.3	V463 A464 V467 I489 F490 E493 N498 M499 L500	V463-L496 HydrophobicContact CG1-CD1 4.31Å; A464-L496 HydrophobicContact CB-CD1 4.46Å; A464-L496 HydrophobicContact CB-CD2 4.45Å; A464-L496 HydrophobicContact CB-CG 4.14Å; V467-L496 HydrophobicContact CB-CD2 3.65Å; V467-L496 HydrophobicContact CG1-CD2 3.64Å; V467-L496 HydrophobicContact CG2-CD2 3.88Å; I489-L496 HydrophobicContact CG1-CD1 4.25Å; F490-L496 HydrophobicContact CD1-CB 4.26Å; F490-L496 HydrophobicContact CD1-CD1 3.86Å; F490-L496 HydrophobicContact CD1-CD2 4.15Å; F490-L496 HydrophobicContact CD1-CG 4.33Å; F490-L496 HydrophobicContact CE1-CD1 4.37Å; F490-L496 HydrophobicContact CE1-CD2 4.47Å; E493-L496 HydrophobicContact CB-CB 4.37Å; E493-L496 HydrophobicContact CB-CD1 4.09Å; E493-L496 HydrophobicContact CB-CG 4.4Å; E493-L496 WeakPolarHBondContact OE2-CG 3.41Å; E493-L496 PolarHBondContact OE2-N 3.41Å; L496-N498 VanDerWaalsContact C-N 3.28Å; L496-N498 PolarHBondContact O-N 2.92Å; L496-M499 HydrophobicContact CD2-SD 4.35Å; L496-M499 PolarHBondContact O-N 3.48Å; L496-L500 WeakPolarHBondContact O-CG 3.12Å; L496-L500 PolarHBondContact O-N 2.95Å; L496-L500 VanDerWaalsContact O-N 3.13Å
497	R	88.9	Confident	88.2	Confident	107 Å²	107	48.6 Å²	48.6	40%	0.404	25%	0.248	S	C	.	.	H	α-helix	trans	-59.7	-40.3	177.1	-157.9	-169.7	81.8	-120	-1.1	111.8	F490 E493 R495 V501	F490-R497 WeakPolarHBondContact O-CA 3.37Å; F490-R497 WeakPolarHBondContact O-CB 3.46Å; F490-R497 PolarHBondContact O-N 2.88Å; E493-R497 WeakPolarHBondContact O-CB 3.16Å; E493-R497 PolarHBondContact O-N 3.24Å; R495-R497 PolarHBondContact O-N 2.89Å; R497-V501 VanDerWaalsContact O-CG2 3.31Å; R497-V501 WeakPolarHBondContact O-CG2 3.41Å; R497-V501 PolarHBondContact O-N 3.22Å
498	N	90	Very high	88.5	Confident	77 Å²	77	48.6 Å²	48.6	41%	0.412	25%	0.248	S	C	.	.	H	α-helix	trans	-64.2	-48.9	175.1	-74	-15.9	0	0	0	111.3	T494 R495 L496 L500 V501 T502	T494-N498 WeakPolarHBondContact O-CB 3.44Å; T494-N498 PolarHBondContact O-N 2.83Å; T494-N498 PolarHBondContact O-ND2 2.75Å; R495-N498 WeakPolarHBondContact O-CB 3.46Å; R495-N498 PolarHBondContact O-N 3.12Å; R495-N498 VanDerWaalsContact O-N 3.17Å; L496-N498 VanDerWaalsContact C-N 3.28Å; L496-N498 PolarHBondContact O-N 2.92Å; N498-L500 PolarHBondContact O-N 2.96Å; N498-V501 PolarHBondContact O-N 2.85Å; N498-T502 WeakPolarHBondContact O-CG2 3.45Å; N498-T502 PolarHBondContact O-N 2.96Å; N498-T502 PolarHBondContact O-OG1 2.85Å
499	M	89.8	Confident	88.8	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.01	23%	0.233	C	C	.	.	H	α-helix	trans	-54.4	-37.9	179.1	-68.7	172.8	78.2	0	0	112.9	V467 D468 R495 L496 G503 E504 I505	V467-M499 HydrophobicContact CG1-CE 4.15Å; V467-M499 HydrophobicContact CG1-SD 4.44Å; D468-M499 HydrophobicContact CB-CE 4.36Å; R495-M499 HydrophobicContact CG-SD 4.45Å; R495-M499 WeakPolarHBondContact O-CG 3.38Å; R495-M499 PolarHBondContact O-N 2.59Å; L496-M499 HydrophobicContact CD2-SD 4.35Å; L496-M499 PolarHBondContact O-N 3.48Å; M499-G503 PolarHBondContact O-N 3.38Å; M499-G503 VanDerWaalsContact O-N 3.14Å; M499-E504 HydrophobicContact CB-CB 4.37Å; M499-E504 HydrophobicContact CG-CB 4.41Å; M499-E504 PolarHBondContact O-N 3Å; M499-E504 VanDerWaalsContact O-N 3.16Å; M499-I505 HydrophobicContact CB-CG2 4.05Å; M499-I505 HydrophobicContact CE-CB 4.13Å; M499-I505 HydrophobicContact CE-CD1 4.35Å; M499-I505 HydrophobicContact CE-CG2 4.26Å
500	L	90.7	Very high	89	Confident	4 Å²	4	44.7 Å²	44.7	2%	0.021	22%	0.224	C	C	.	.	H	α-helix	trans	-67.9	-40.5	176.2	-66.5	-174.4	0	0	0	113.2	L473 F490 L496 N498 I505 V507 I531 K532	L473-L500 HydrophobicContact CD2-CD2 4.09Å; F490-L500 HydrophobicContact CB-CD1 3.81Å; L496-L500 WeakPolarHBondContact O-CG 3.12Å; L496-L500 PolarHBondContact O-N 2.95Å; L496-L500 VanDerWaalsContact O-N 3.13Å; N498-L500 PolarHBondContact O-N 2.96Å; L500-I505 HydrophobicContact CD2-CG2 4.29Å; L500-V507 HydrophobicContact CD2-CG2 3.49Å; L500-V507 VanDerWaalsContact CD2-CG2 3.49Å; L500-I531 HydrophobicContact CB-CG1 4.26Å; L500-I531 HydrophobicContact CD1-CG1 4.11Å; L500-I531 HydrophobicContact CD2-CG1 4.19Å; L500-I531 HydrophobicContact CD2-CG2 4.49Å; L500-I531 HydrophobicContact CG-CG1 4.43Å; L500-K532 PolarHBondContact O-N 2.92Å
501	V	90	Very high	89.1	Confident	71 Å²	71	45.2 Å²	45.2	43%	0.43	23%	0.227	S	C	.	.	H	α-helix	trans	-81.7	-39.6	-176.3	173.1	0	0	0	0	112	R497 N498 G503 T530 K532	R497-V501 VanDerWaalsContact O-CG2 3.31Å; R497-V501 WeakPolarHBondContact O-CG2 3.41Å; R497-V501 PolarHBondContact O-N 3.22Å; N498-V501 PolarHBondContact O-N 2.85Å; V501-G503 VanDerWaalsContact C-N 3.31Å; V501-T530 HydrophobicContact CG2-CG2 3.73Å; V501-K532 WeakPolarHBondContact O-CB 3.45Å; V501-K532 VanDerWaalsContact O-CD 3.29Å; V501-K532 WeakPolarHBondContact O-CD 3.42Å
502	T	89	Confident	89	Confident	59 Å²	59	41.4 Å²	41.4	36%	0.362	21%	0.209	S	C	.	.	H	α-helix	trans	-72.9	-27.2	176.4	59.5	0	0	0	0	111.9	N498 E504 K532	N498-T502 WeakPolarHBondContact O-CG2 3.45Å; N498-T502 PolarHBondContact O-N 2.96Å; N498-T502 PolarHBondContact O-OG1 2.85Å; T502-E504 VanDerWaalsContact CB-OE1 3.24Å; T502-E504 WeakPolarHBondContact CB-OE1 3.27Å; T502-E504 WeakPolarHBondContact CG2-OE1 3.46Å; T502-E504 WeakPolarHBondContact OG1-CG 3.45Å; T502-E504 PolarHBondContact OG1-N 2.99Å; T502-E504 PolarHBondContact OG1-OE1 2.83Å; T502-K532 WeakPolarHBondContact O-CD 3.49Å; T502-K532 WeakPolarHBondContact O-CE 3.48Å; T502-K532 PolarHBondContact O-NZ 3.48Å
503	G	85.5	Confident	88.5	Confident	16 Å²	16	37.8 Å²	37.8	17%	0.165	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.8	27.6	-175.6	0	0	0	0	0	113.1	M499 V501 I505 L533	M499-G503 PolarHBondContact O-N 3.38Å; M499-G503 VanDerWaalsContact O-N 3.14Å; V501-G503 VanDerWaalsContact C-N 3.31Å; G503-I505 PolarHBondContact O-N 2.74Å; G503-L533 WeakPolarHBondContact O-CD1 3.21Å
504	E	86.4	Confident	87.6	Confident	113 Å²	113	44.5 Å²	44.5	53%	0.528	23%	0.227	S	C	.	.	S	Bend	trans	-64.8	-29.2	172.1	-77	153.2	-133.7	0	0	112.2	M499 T502	M499-E504 HydrophobicContact CB-CB 4.37Å; M499-E504 HydrophobicContact CG-CB 4.41Å; M499-E504 PolarHBondContact O-N 3Å; M499-E504 VanDerWaalsContact O-N 3.16Å; T502-E504 VanDerWaalsContact CB-OE1 3.24Å; T502-E504 WeakPolarHBondContact CB-OE1 3.27Å; T502-E504 WeakPolarHBondContact CG2-OE1 3.46Å; T502-E504 WeakPolarHBondContact OG1-CG 3.45Å; T502-E504 PolarHBondContact OG1-N 2.99Å; T502-E504 PolarHBondContact OG1-OE1 2.83Å
505	I	87.6	Confident	86.7	Confident	2 Å²	2	40.8 Å²	40.8	1%	0.01	20%	0.203	C	C	.	.	S	Bend	trans	-122.5	138.4	173.4	-162.7	163.1	0	0	0	111	V467 S470 L473 M499 L500 G503	V467-I505 HydrophobicContact CG1-CD1 3.72Å; V467-I505 WeakPolarHBondContact O-CD1 3.49Å; S470-I505 WeakPolarHBondContact O-CD1 3.38Å; L473-I505 HydrophobicContact CB-CD1 3.85Å; L473-I505 HydrophobicContact CB-CG1 4.18Å; M499-I505 HydrophobicContact CB-CG2 4.05Å; M499-I505 HydrophobicContact CE-CB 4.13Å; M499-I505 HydrophobicContact CE-CD1 4.35Å; M499-I505 HydrophobicContact CE-CG2 4.26Å; L500-I505 HydrophobicContact CD2-CG2 4.29Å; G503-I505 PolarHBondContact O-N 2.74Å
506	K	91.1	Very high	85.4	Confident	44 Å²	44	45 Å²	45	19%	0.191	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	128.9	174.6	178.4	-177	177.7	-167.9	0	109.9	R472 L473 L533 E558	R472-K506 WeakPolarHBondContact CA-O 3.49Å; L473-K506 PolarHBondContact N-O 2.94Å; K506-L533 HydrophobicContact CB-CB 4.19Å; K506-L533 HydrophobicContact CB-CD1 4.43Å; K506-L533 HydrophobicContact CG-CB 4.28Å; K506-E558 VanDerWaalsContact CE-OE2 3.29Å; K506-E558 WeakPolarHBondContact CE-OE2 3.48Å; K506-E558 PolarHBondContact NZ-O 3.43Å; K506-E558 IonicContact NZ-OE2 2.65Å; K506-E558 PolarHBondContact NZ-OE2 3.14Å
507	V	92.6	Very high	84.1	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	133	-176.5	-172	0	0	0	0	111	L473 I475 L500 I531 L533 L534 T535	L473-V507 HydrophobicContact CB-CG2 4.36Å; L473-V507 HydrophobicContact CD2-CG2 4.23Å; L473-V507 HydrophobicContact CG-CG1 4.42Å; L473-V507 CarbonylContact O-C 3.54Å; L473-V507 VanDerWaalsContact O-CA 3.3Å; L473-V507 WeakPolarHBondContact O-CA 3.42Å; I475-V507 HydrophobicContact CD1-CG1 3.88Å; I475-V507 HydrophobicContact CG1-CG1 4.25Å; L500-V507 HydrophobicContact CD2-CG2 3.49Å; L500-V507 VanDerWaalsContact CD2-CG2 3.49Å; V507-I531 HydrophobicContact CB-CG2 3.89Å; V507-I531 HydrophobicContact CG1-CD1 4.31Å; V507-I531 HydrophobicContact CG2-CD1 4.38Å; V507-I531 HydrophobicContact CG2-CG2 3.52Å; V507-L533 PolarHBondContact N-O 3.1Å; V507-L534 HydrophobicContact CB-CD1 4.31Å; V507-L534 HydrophobicContact CG1-CD1 4.27Å; V507-T535 PolarHBondContact O-N 3.33Å; V507-T535 PolarHBondContact O-OG1 2.93Å
508	I	93.5	Very high	83.2	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	104.4	173.8	-54.5	177.3	0	0	0	107.3	R472 L473 I474 I475 I510 I537 L555 E558 M559	R472-I508 HydrophobicContact CB-CD1 4.45Å; R472-I508 HydrophobicContact CG-CD1 4.43Å; L473-I508 PolarHBondContact O-N 3.02Å; I474-I508 CarbonylContact C-O 3.41Å; I474-I508 WeakPolarHBondContact CA-O 3.46Å; I474-I508 HydrophobicContact CG1-CB 4.24Å; I474-I508 HydrophobicContact CG1-CD1 4.36Å; I475-I508 PolarHBondContact N-O 3.32Å; I508-I510 HydrophobicContact CG2-CG1 4.37Å; I508-I537 HydrophobicContact CG2-CD1 3.79Å; I508-I537 HydrophobicContact CG2-CG1 4.42Å; I508-L555 HydrophobicContact CD1-CD1 4.49Å; I508-L555 HydrophobicContact CG2-CD1 3.67Å; I508-E558 HydrophobicContact CD1-CB 4.12Å; I508-E558 HydrophobicContact CG1-CB 4.37Å; I508-M559 HydrophobicContact CD1-CG 4.26Å; I508-M559 HydrophobicContact CD1-SD 3.81Å
509	L	92	Very high	81.8	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	111.2	-177	-165.4	66.9	0	0	0	109.1	I475 M477 K528 L534 T535 V536 I537	I475-L509 HydrophobicContact CB-CD1 3.64Å; I475-L509 HydrophobicContact CD1-CD1 4.38Å; I475-L509 HydrophobicContact CG2-CD1 3.63Å; M477-L509 HydrophobicContact CE-CD1 4.07Å; M477-L509 HydrophobicContact CE-CD2 3.62Å; M477-L509 HydrophobicContact CE-CG 3.63Å; M477-L509 HydrophobicContact CG-CD1 3.63Å; M477-L509 HydrophobicContact CG-CG 4.16Å; M477-L509 HydrophobicContact SD-CD1 3.49Å; M477-L509 WeakPolarHBondContact SD-CD1 3.47Å; M477-L509 HydrophobicContact SD-CD2 3.81Å; M477-L509 HydrophobicContact SD-CG 3.74Å; L509-K528 HydrophobicContact CD2-CD 4.28Å; L509-K528 HydrophobicContact CD2-CG 3.75Å; L509-L534 HydrophobicContact CB-CD1 3.79Å; L509-L534 HydrophobicContact CD2-CD1 4.08Å; L509-T535 PolarHBondContact N-O 3.1Å; L509-V536 HydrophobicContact CB-CG2 4.41Å; L509-V536 HydrophobicContact CD2-CG2 4.26Å; L509-V536 WeakPolarHBondContact O-CA 3.34Å; L509-I537 PolarHBondContact O-N 3.44Å
510	I	91.5	Very high	80.8	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	110.1	-179.7	-56.6	177.3	0	0	0	108.5	F429 L434 I474 I475 M477 I508 C512 I537 W539 F551 L555	F429-I510 HydrophobicContact CE1-CG2 3.93Å; F429-I510 HydrophobicContact CZ-CG2 4.29Å; L434-I510 HydrophobicContact CD1-CD1 4.11Å; L434-I510 HydrophobicContact CD2-CD1 3.84Å; I474-I510 HydrophobicContact CG2-CD1 3.78Å; I474-I510 HydrophobicContact CG2-CG1 4.34Å; I475-I510 PolarHBondContact O-N 3.24Å; M477-I510 PolarHBondContact N-O 3.32Å; I508-I510 HydrophobicContact CG2-CG1 4.37Å; I510-C512 PolarHBondContact O-N 2.82Å; I510-I537 CarbonylContact C-O 3.53Å; I510-I537 WeakPolarHBondContact CA-O 3.14Å; I510-W539 HydrophobicContact CG2-CB 4.09Å; I510-F551 HydrophobicContact CD1-CZ 4.49Å; I510-F551 HydrophobicContact CG2-CE2 4.21Å; I510-F551 HydrophobicContact CG2-CZ 4.3Å; I510-L555 HydrophobicContact CD1-CD1 4.35Å
511	E	88.4	Confident	80.2	Confident	13 Å²	13	51.8 Å²	51.8	6%	0.061	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	106.2	173	-76.4	-177	164.7	0	0	109.1	M477 L515 K528 V536 I537 K538 W539	M477-E511 HydrophobicContact CE-CB 4.46Å; M477-E511 HydrophobicContact CE-CG 3.36Å; E511-L515 HydrophobicContact CB-CD1 4.4Å; E511-L515 HydrophobicContact CG-CD1 4.14Å; E511-K528 IonicContact OE1-NZ 2.83Å; E511-K528 PolarHBondContact OE1-NZ 3.02Å; E511-V536 HydrophobicContact CG-CG1 3.92Å; E511-I537 PolarHBondContact N-O 2.88Å; E511-K538 HydrophobicContact CB-CG 4.26Å; E511-K538 WeakPolarHBondContact OE2-CE 3.39Å; E511-K538 WeakPolarHBondContact OE2-CG 3.06Å; E511-K538 IonicContact OE2-NZ 2.67Å; E511-W539 PolarHBondContact O-N 2.87Å
512	C	82.8	Confident	79.8	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	136.3	166.1	-66.2	0	0	0	0	109.2	E426 M477 I510 L515 W539	E426-C512 HydrophobicContact CB-CB 4.31Å; E426-C512 HydrophobicContact CG-CB 4.06Å; E426-C512 WeakPolarHBondContact OE1-CB 3.23Å; M477-C512 WeakPolarHBondContact O-CB 3.32Å; M477-C512 PolarHBondContact O-N 2.86Å; M477-C512 VanDerWaalsContact O-N 3.15Å; I510-C512 PolarHBondContact O-N 2.82Å; C512-L515 WeakPolarHBondContact O-CD2 3.39Å; C512-L515 WeakPolarHBondContact O-CG 3.28Å; C512-W539 HydrophobicContact CB-CE3 4.15Å
513	S	73.5	Confident	79.5	Confident	61 Å²	61	56.9 Å²	56.9	43%	0.427	29%	0.291	S	S	.	.	S	Bend	trans	50.9	-177.2	-176.9	68	0	0	0	0	116.1	E426 L515	E426-S513 WeakPolarHBondContact OE1-CB 3.05Å; E426-S513 PolarHBondContact OE1-N 2.7Å; E426-S513 PolarHBondContact OE1-OG 3Å; S513-L515 PolarHBondContact O-N 2.95Å
514	E	69.8	Low	79.4	Confident	173 Å²	173	56.1 Å²	56.1	81%	0.808	28%	0.283	S	S	*	.			trans	-84.4	83.5	175	-67.5	-161.8	166.9	0	0	110.1	R516	E514-R516 PolarHBondContact O-N 2.94Å
515	L	68.5	Low	79.3	Confident	5 Å²	5	53.9 Å²	53.9	3%	0.026	27%	0.272	C	S	.	.			trans	-56.9	-3.9	176.6	-57.5	170.3	0	0	0	114.9	M477 P479 V482 E511 C512 S513 G517 I518 Y521	M477-L515 HydrophobicContact CB-CD1 3.88Å; M477-L515 HydrophobicContact CE-CD1 3.77Å; P479-L515 HydrophobicContact CG-CD2 4.35Å; V482-L515 HydrophobicContact CG2-CD2 4.3Å; E511-L515 HydrophobicContact CB-CD1 4.4Å; E511-L515 HydrophobicContact CG-CD1 4.14Å; C512-L515 WeakPolarHBondContact O-CD2 3.39Å; C512-L515 WeakPolarHBondContact O-CG 3.28Å; S513-L515 PolarHBondContact O-N 2.95Å; L515-G517 PolarHBondContact O-N 2.87Å; L515-I518 HydrophobicContact CB-CD1 4.22Å; L515-I518 HydrophobicContact CD2-CD1 3.56Å; L515-I518 HydrophobicContact CG-CD1 4.49Å; L515-I518 PolarHBondContact O-N 2.94Å; L515-Y521 HydrophobicContact CB-CD2 3.76Å; L515-Y521 HydrophobicContact CB-CE2 3.61Å; L515-Y521 HydrophobicContact CD1-CE2 4.42Å; L515-Y521 WeakPolarHBondContact O-CD2 3.42Å
516	R	60.8	Low	79.1	Confident	197 Å²	197	56.3 Å²	56.3	74%	0.743	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	81.7	178.5	-72.7	-176.8	168.4	-166.4	-5.7	111.4	E514 Y521	E514-R516 PolarHBondContact O-N 2.94Å; R516-Y521 HydrophobicContact CG-CE1 4.38Å
517	G	63.9	Low	78.9	Confident	78 Å²	78	54.4 Å²	54.4	80%	0.804	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	153.9	-10.8	179	0	0	0	0	0	113.2	L515	L515-G517 PolarHBondContact O-N 2.87Å
518	I	69.1	Low	78.6	Confident	39 Å²	39	55.7 Å²	55.7	20%	0.2	29%	0.29	C	S	.	.	S	Bend	trans	-82.2	139.5	-178.6	-52.4	174.8	0	0	0	109.8	P479 V482 V483 L515 Y521	P479-I518 HydrophobicContact CB-CD1 3.65Å; P479-I518 HydrophobicContact CG-CD1 3.88Å; V482-I518 HydrophobicContact CB-CG2 4.32Å; V482-I518 HydrophobicContact CG1-CG2 4.1Å; V483-I518 HydrophobicContact CG2-CG2 3.86Å; L515-I518 HydrophobicContact CB-CD1 4.22Å; L515-I518 HydrophobicContact CD2-CD1 3.56Å; L515-I518 HydrophobicContact CG-CD1 4.49Å; L515-I518 PolarHBondContact O-N 2.94Å; I518-Y521 WeakPolarHBondContact O-CB 3.47Å; I518-Y521 PolarHBondContact O-N 2.84Å
519	M	60.3	Low	78.3	Confident	133 Å²	133	63.5 Å²	63.5	66%	0.655	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	141.7	171.5	-168.2	171.1	68.2	0	0	110.3	Y521	M519-Y521 PolarHBondContact O-N 3.07Å
520	N	70.9	Confident	78.1	Confident	38 Å²	38	66.5 Å²	66.5	20%	0.203	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.1	5.8	-175	-52.9	-29	0	0	0	117.6	V482 Q522 E523 V524	V482-N520 HydrophobicContact CG1-CB 4.48Å; N520-Q522 PolarHBondContact O-N 3.38Å; N520-Q522 VanDerWaalsContact O-N 3.08Å; N520-E523 HydrophobicContact CB-CG 4.45Å; N520-E523 WeakPolarHBondContact CB-OE2 3.29Å; N520-E523 WeakPolarHBondContact O-CB 3.45Å; N520-E523 PolarHBondContact O-N 3.36Å; N520-V524 PolarHBondContact O-N 2.04Å
521	Y	77.6	Confident	77.9	Confident	45 Å²	45	66.9 Å²	66.9	18%	0.176	35%	0.347	C	S	.	.	H	α-helix	trans	-57.4	-27.5	176.9	-172.2	-102.5	0	0	0	114.2	L515 R516 I518 M519 E523 V524 E525	L515-Y521 HydrophobicContact CB-CD2 3.76Å; L515-Y521 HydrophobicContact CB-CE2 3.61Å; L515-Y521 HydrophobicContact CD1-CE2 4.42Å; L515-Y521 WeakPolarHBondContact O-CD2 3.42Å; R516-Y521 HydrophobicContact CG-CE1 4.38Å; I518-Y521 WeakPolarHBondContact O-CB 3.47Å; I518-Y521 PolarHBondContact O-N 2.84Å; M519-Y521 PolarHBondContact O-N 3.07Å; Y521-E523 VanDerWaalsContact C-N 3.29Å; Y521-E523 PolarHBondContact O-N 2.88Å; Y521-V524 WeakPolarHBondContact O-CB 3.47Å; Y521-V524 PolarHBondContact O-N 3.39Å; Y521-E525 HydrophobicContact CD1-CG 4.41Å; Y521-E525 HydrophobicContact CE1-CG 4.06Å; Y521-E525 PolarHBondContact O-N 2.93Å; Y521-E525 PolarHBondContact OH-OE1 2.78Å
522	Q	81	Confident	77.9	Confident	173 Å²	173	73 Å²	73	81%	0.808	37%	0.373	S	S	*	.	H	α-helix	trans	-64.1	-32.2	174.1	-69.4	-179.4	-25.6	0	0	113.1	N520 V524 E525 A526	N520-Q522 PolarHBondContact O-N 3.38Å; N520-Q522 VanDerWaalsContact O-N 3.08Å; Q522-V524 VanDerWaalsContact C-N 3.35Å; Q522-E525 PolarHBondContact O-N 3.08Å; Q522-A526 PolarHBondContact O-N 3.24Å
523	E	82.4	Confident	78.2	Confident	64 Å²	64	76.7 Å²	76.7	30%	0.299	39%	0.393	S	S	.	.	H	α-helix	trans	-71.3	-34.5	176.3	-57.4	-178.6	151.5	0	0	110.5	R485 W487 N520 Y521 E525 A526 L527	R485-E523 IonicContact CZ-OE1 3.79Å; R485-E523 VanDerWaalsContact CZ-OE1 3.28Å; R485-E523 IonicContact CZ-OE2 3.28Å; R485-E523 IonicContact NE-OE1 2.66Å; R485-E523 IonicContact NE-OE2 3.67Å; R485-E523 PolarHBondContact NE-OE2 2.82Å; R485-E523 IonicContact NH2-OE1 3.4Å; R485-E523 PolarHBondContact NH2-OE1 3.23Å; R485-E523 IonicContact NH2-OE2 2.65Å; R485-E523 PolarHBondContact NH2-OE2 2.84Å; R485-E523 VanDerWaalsContact NH2-OE2 3.08Å; W487-E523 HydrophobicContact CH2-CB 4.47Å; W487-E523 HydrophobicContact CZ2-CB 3.81Å; N520-E523 HydrophobicContact CB-CG 4.45Å; N520-E523 WeakPolarHBondContact CB-OE2 3.29Å; N520-E523 WeakPolarHBondContact O-CB 3.45Å; N520-E523 PolarHBondContact O-N 3.36Å; Y521-E523 VanDerWaalsContact C-N 3.29Å; Y521-E523 PolarHBondContact O-N 2.88Å; E523-E525 VanDerWaalsContact C-N 3.35Å; E523-E525 PolarHBondContact O-N 3.42Å; E523-A526 WeakPolarHBondContact O-CB 3.17Å; E523-A526 PolarHBondContact O-N 3.28Å; E523-L527 PolarHBondContact O-N 2.84Å
524	V	83.5	Confident	79.1	Confident	0 Å²	0	76 Å²	76	0%	0	38%	0.384	C	S	.	.	H	α-helix	trans	-62.6	-39.9	173	-179.4	0	0	0	0	111.7	M477 V482 W487 N520 Y521 Q522 L527 K528	M477-V524 HydrophobicContact CE-CG1 3.9Å; M477-V524 HydrophobicContact SD-CG1 3.41Å; M477-V524 WeakPolarHBondContact SD-CG1 3.34Å; V482-V524 HydrophobicContact CG1-CG2 3.98Å; V482-V524 HydrophobicContact CG2-CG2 4.16Å; W487-V524 HydrophobicContact CE3-CG2 4.31Å; W487-V524 HydrophobicContact CH2-CG2 3.57Å; W487-V524 HydrophobicContact CZ2-CG2 4.38Å; W487-V524 HydrophobicContact CZ3-CG2 3.48Å; W487-V524 VanDerWaalsContact CZ3-CG2 3.48Å; N520-V524 PolarHBondContact O-N 2.04Å; Y521-V524 WeakPolarHBondContact O-CB 3.47Å; Y521-V524 PolarHBondContact O-N 3.39Å; Q522-V524 VanDerWaalsContact C-N 3.35Å; V524-L527 PolarHBondContact O-N 2.69Å; V524-K528 VanDerWaalsContact O-CG 3.27Å; V524-K528 WeakPolarHBondContact O-CG 3.29Å; V524-K528 PolarHBondContact O-N 2.77Å
525	E	83.8	Confident	80	Confident	66 Å²	66	68.7 Å²	68.7	31%	0.308	35%	0.351	S	S	.	.	H	α-helix	trans	-66.5	-37.1	173.9	-65.5	-61.1	126.9	0	0	111.9	Y521 Q522 E523 K528 H529	Y521-E525 HydrophobicContact CD1-CG 4.41Å; Y521-E525 HydrophobicContact CE1-CG 4.06Å; Y521-E525 PolarHBondContact O-N 2.93Å; Y521-E525 PolarHBondContact OH-OE1 2.78Å; Q522-E525 PolarHBondContact O-N 3.08Å; E523-E525 VanDerWaalsContact C-N 3.35Å; E523-E525 PolarHBondContact O-N 3.42Å; E525-K528 WeakPolarHBondContact O-CB 2.99Å; E525-K528 PolarHBondContact O-N 2.04Å; E525-K528 WeakPolarHBondContact OE1-CD 3.07Å; E525-K528 IonicContact OE1-NZ 3.88Å; E525-K528 PolarHBondContact OE1-NZ 2.97Å; E525-H529 PolarHBondContact O-CD2 3.11Å; E525-H529 PolarHBondContact O-N 3.38Å
526	A	85	Confident	81	Confident	54 Å²	54	71.2 Å²	71.2	45%	0.446	37%	0.367	S	S	.	.	H	α-helix	trans	-64.6	-41.1	173.2	0	0	0	0	0	112.5	Q522 E523 H529 T530	Q522-A526 PolarHBondContact O-N 3.24Å; E523-A526 WeakPolarHBondContact O-CB 3.17Å; E523-A526 PolarHBondContact O-N 3.28Å; A526-H529 PolarHBondContact O-N 2.92Å; A526-T530 PolarHBondContact O-N 3.06Å; A526-T530 VanDerWaalsContact O-N 3.14Å; A526-T530 PolarHBondContact O-OG1 3.08Å
527	L	85.9	Confident	82.4	Confident	3 Å²	3	62.2 Å²	62.2	2%	0.016	33%	0.333	C	S	.	.	H	α-helix	trans	-59.6	-46.6	172.1	178	69.2	0	0	0	111	W487 E491 E523 V524 H529 T530 I531	W487-L527 HydrophobicContact CB-CD2 3.65Å; W487-L527 HydrophobicContact CD2-CD2 4.1Å; W487-L527 HydrophobicContact CG-CD2 3.6Å; E491-L527 HydrophobicContact CG-CD1 4.47Å; E523-L527 PolarHBondContact O-N 2.84Å; V524-L527 PolarHBondContact O-N 2.69Å; L527-H529 VanDerWaalsContact C-N 3.25Å; L527-H529 PolarHBondContact O-N 2.79Å; L527-T530 WeakPolarHBondContact O-CB 3.47Å; L527-T530 PolarHBondContact O-N 2.9Å; L527-I531 HydrophobicContact CD1-CD1 4.19Å; L527-I531 HydrophobicContact CG-CD1 4Å; L527-I531 WeakPolarHBondContact O-CG1 3.43Å; L527-I531 PolarHBondContact O-N 2.79Å
528	K	87.4	Confident	83.6	Confident	27 Å²	27	63.9 Å²	63.9	12%	0.117	32%	0.319	C	S	.	.	H	α-helix	trans	-57.7	-37.2	176.9	-73.1	170.4	177.6	174.8	0	112.6	L509 E511 V524 E525 T530 L534	L509-K528 HydrophobicContact CD2-CD 4.28Å; L509-K528 HydrophobicContact CD2-CG 3.75Å; E511-K528 IonicContact OE1-NZ 2.83Å; E511-K528 PolarHBondContact OE1-NZ 3.02Å; V524-K528 VanDerWaalsContact O-CG 3.27Å; V524-K528 WeakPolarHBondContact O-CG 3.29Å; V524-K528 PolarHBondContact O-N 2.77Å; E525-K528 WeakPolarHBondContact O-CB 2.99Å; E525-K528 PolarHBondContact O-N 2.04Å; E525-K528 WeakPolarHBondContact OE1-CD 3.07Å; E525-K528 IonicContact OE1-NZ 3.88Å; E525-K528 PolarHBondContact OE1-NZ 2.97Å; K528-T530 VanDerWaalsContact C-N 3.32Å; K528-L534 HydrophobicContact CB-CD2 3.69Å; K528-L534 HydrophobicContact CG-CD2 3.8Å
529	H	86.6	Confident	84.4	Confident	165 Å²	165	62.5 Å²	62.5	76%	0.764	31%	0.311	S	S	*	.	H	α-helix	trans	-73.1	-21.2	175.5	-75.2	-58.2	0	0	0	114.2	E525 A526 L527	E525-H529 PolarHBondContact O-CD2 3.11Å; E525-H529 PolarHBondContact O-N 3.38Å; A526-H529 PolarHBondContact O-N 2.92Å; L527-H529 VanDerWaalsContact C-N 3.25Å; L527-H529 PolarHBondContact O-N 2.79Å
530	T	86.6	Confident	85.5	Confident	62 Å²	62	62.5 Å²	62.5	38%	0.38	31%	0.309	S	S	.	.	H	α-helix	trans	-82.1	-26.6	179.9	-57.2	0	0	0	0	112.3	V501 A526 L527 K528	V501-T530 HydrophobicContact CG2-CG2 3.73Å; A526-T530 PolarHBondContact O-N 3.06Å; A526-T530 VanDerWaalsContact O-N 3.14Å; A526-T530 PolarHBondContact O-OG1 3.08Å; L527-T530 WeakPolarHBondContact O-CB 3.47Å; L527-T530 PolarHBondContact O-N 2.9Å; K528-T530 VanDerWaalsContact C-N 3.32Å
531	I	89.2	Confident	86	Confident	9 Å²	9	61.5 Å²	61.5	5%	0.046	31%	0.307	C	S	.	.			trans	-87.1	116.8	-175.5	-59.7	164.9	0	0	0	111	L500 V507 L527 L534	L500-I531 HydrophobicContact CB-CG1 4.26Å; L500-I531 HydrophobicContact CD1-CG1 4.11Å; L500-I531 HydrophobicContact CD2-CG1 4.19Å; L500-I531 HydrophobicContact CD2-CG2 4.49Å; L500-I531 HydrophobicContact CG-CG1 4.43Å; V507-I531 HydrophobicContact CB-CG2 3.89Å; V507-I531 HydrophobicContact CG1-CD1 4.31Å; V507-I531 HydrophobicContact CG2-CD1 4.38Å; V507-I531 HydrophobicContact CG2-CG2 3.52Å; L527-I531 HydrophobicContact CD1-CD1 4.19Å; L527-I531 HydrophobicContact CG-CD1 4Å; L527-I531 WeakPolarHBondContact O-CG1 3.43Å; L527-I531 PolarHBondContact O-N 2.79Å; I531-L534 HydrophobicContact CB-CB 4.12Å; I531-L534 HydrophobicContact CD1-CD1 4.16Å; I531-L534 HydrophobicContact CG2-CB 3.81Å; I531-L534 HydrophobicContact CG2-CD1 4.34Å
532	K	87.8	Confident	86.1	Confident	140 Å²	140	62.5 Å²	62.5	61%	0.609	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-38.8	-177.6	-179.8	177.1	165.6	-166.7	0	114.2	L500 V501 T502	L500-K532 PolarHBondContact O-N 2.92Å; V501-K532 WeakPolarHBondContact O-CB 3.45Å; V501-K532 VanDerWaalsContact O-CD 3.29Å; V501-K532 WeakPolarHBondContact O-CD 3.42Å; T502-K532 WeakPolarHBondContact O-CD 3.49Å; T502-K532 WeakPolarHBondContact O-CE 3.48Å; T502-K532 PolarHBondContact O-NZ 3.48Å
533	L	89	Confident	85.8	Confident	78 Å²	78	62.8 Å²	62.8	41%	0.408	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.1	59	179.3	-67	-172.3	0	0	0	111.5	G503 K506 V507	G503-L533 WeakPolarHBondContact O-CD1 3.21Å; K506-L533 HydrophobicContact CB-CB 4.19Å; K506-L533 HydrophobicContact CB-CD1 4.43Å; K506-L533 HydrophobicContact CG-CB 4.28Å; V507-L533 PolarHBondContact N-O 3.1Å
534	L	91.2	Very high	85.6	Confident	48 Å²	48	60.6 Å²	60.6	25%	0.251	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	138	179.9	-178.6	65.4	0	0	0	112.7	V507 L509 K528 I531 V536	V507-L534 HydrophobicContact CB-CD1 4.31Å; V507-L534 HydrophobicContact CG1-CD1 4.27Å; L509-L534 HydrophobicContact CB-CD1 3.79Å; L509-L534 HydrophobicContact CD2-CD1 4.08Å; K528-L534 HydrophobicContact CB-CD2 3.69Å; K528-L534 HydrophobicContact CG-CD2 3.8Å; I531-L534 HydrophobicContact CB-CB 4.12Å; I531-L534 HydrophobicContact CD1-CD1 4.16Å; I531-L534 HydrophobicContact CG2-CB 3.81Å; I531-L534 HydrophobicContact CG2-CD1 4.34Å; L534-V536 HydrophobicContact CD1-CG2 4.41Å; L534-V536 HydrophobicContact CD2-CG2 3.96Å; L534-V536 HydrophobicContact CG-CG2 4.04Å
535	T	90.2	Very high	85.4	Confident	19 Å²	19	62.4 Å²	62.4	12%	0.117	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	126.3	166.3	57.6	0	0	0	0	109.9	V507 L509 E558	V507-T535 PolarHBondContact O-N 3.33Å; V507-T535 PolarHBondContact O-OG1 2.93Å; L509-T535 PolarHBondContact N-O 3.1Å; T535-E558 HydrophobicContact CG2-CG 4.25Å
536	V	89.3	Confident	85.2	Confident	58 Å²	58	66.8 Å²	66.8	35%	0.352	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	129.4	-179.1	-171.9	0	0	0	0	110	L509 E511 L534	L509-V536 HydrophobicContact CB-CG2 4.41Å; L509-V536 HydrophobicContact CD2-CG2 4.26Å; L509-V536 WeakPolarHBondContact O-CA 3.34Å; E511-V536 HydrophobicContact CG-CG1 3.92Å; L534-V536 HydrophobicContact CD1-CG2 4.41Å; L534-V536 HydrophobicContact CD2-CG2 3.96Å; L534-V536 HydrophobicContact CG-CG2 4.04Å
537	I	89.8	Confident	84.6	Confident	7 Å²	7	68.7 Å²	68.7	4%	0.036	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	124.3	-179.5	-52.9	-178.1	0	0	0	108.6	I508 L509 I510 E511 F551 R554 L555 E558	I508-I537 HydrophobicContact CG2-CD1 3.79Å; I508-I537 HydrophobicContact CG2-CG1 4.42Å; L509-I537 PolarHBondContact O-N 3.44Å; I510-I537 CarbonylContact C-O 3.53Å; I510-I537 WeakPolarHBondContact CA-O 3.14Å; E511-I537 PolarHBondContact N-O 2.88Å; I537-F551 HydrophobicContact CG2-CE2 3.54Å; I537-F551 HydrophobicContact CG2-CD2 3.61Å; I537-R554 HydrophobicContact CG1-CG 4.33Å; I537-R554 HydrophobicContact CD1-CG 4.27Å; I537-L555 HydrophobicContact CD1-CB 4.21Å; I537-L555 HydrophobicContact CD1-CD1 3.79Å; I537-E558 HydrophobicContact CD1-CG 4.43Å
538	K	88.1	Confident	84	Confident	114 Å²	114	75.2 Å²	75.2	50%	0.496	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	122.9	-178.2	-63.7	-167.9	178.5	-146.9	0	112.4	E511 H540	E511-K538 HydrophobicContact CB-CG 4.26Å; E511-K538 WeakPolarHBondContact OE2-CE 3.39Å; E511-K538 WeakPolarHBondContact OE2-CG 3.06Å; E511-K538 IonicContact OE2-NZ 2.67Å; K538-H540 WeakPolarHBondContact CB-CE1 3.42Å; K538-H540 PolarHBondContact O-ND1 3.28Å; K538-H540 VanDerWaalsContact O-ND1 3.17Å
539	W	87.9	Confident	83.8	Confident	9 Å²	9	74.9 Å²	74.9	3%	0.034	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	108.3	173.7	-175.9	85.2	0	0	0	110.1	E425 E426 F429 I510 E511 C512 G541 N545 F551	E425-W539 HydrophobicContact CB-CH2 4.39Å; E426-W539 HydrophobicContact CG-CZ3 3.96Å; F429-W539 HydrophobicContact CB-CH2 4.06Å; F429-W539 HydrophobicContact CB-CZ2 3.73Å; F429-W539 HydrophobicContact CD1-CD2 4.23Å; F429-W539 HydrophobicContact CD1-CG 4.36Å; F429-W539 AromaticContact CD2-CD1 3.81Å; F429-W539 HydrophobicContact CD2-CD2 4.4Å; F429-W539 AromaticContact CD2-CE2 3.68Å; F429-W539 HydrophobicContact CD2-CG 4.47Å; F429-W539 HydrophobicContact CD2-CZ2 4.08Å; F429-W539 AromaticContact CD2-NE1 3.29Å; F429-W539 VanDerWaalsContact CD2-NE1 3.29Å; F429-W539 HydrophobicContact CE1-CG 4.25Å; F429-W539 AromaticContact CE2-CD1 3.56Å; F429-W539 HydrophobicContact CE2-CG 4.36Å; F429-W539 AromaticContact CE2-NE1 3.49Å; F429-W539 HydrophobicContact CG-CD2 4.15Å; F429-W539 AromaticContact CG-CE2 3.68Å; F429-W539 HydrophobicContact CG-CG 4.49Å; F429-W539 AromaticContact CG-CZ2 3.9Å; F429-W539 HydrophobicContact CG-CZ2 3.9Å; F429-W539 AromaticContact CG-NE1 3.77Å; F429-W539 AromaticContact CZ-CD1 3.78Å; F429-W539 HydrophobicContact CZ-CG 4.25Å; I510-W539 HydrophobicContact CG2-CB 4.09Å; E511-W539 PolarHBondContact O-N 2.87Å; C512-W539 HydrophobicContact CB-CE3 4.15Å; W539-G541 VanDerWaalsContact C-N 3.35Å; W539-G541 VanDerWaalsContact CZ2-C 3.45Å; W539-G541 PolarHBondContact O-N 2.83Å; W539-N545 PolarHBondContact NE1-OD1 2.91Å; W539-F551 HydrophobicContact CB-CD2 4.45Å; W539-F551 HydrophobicContact CB-CE2 3.93Å; W539-F551 HydrophobicContact CB-CZ 4.49Å; W539-F551 AromaticContact CD1-CZ 3.97Å; W539-F551 HydrophobicContact CG-CE2 4.41Å
540	H	83.3	Confident	83.7	Confident	134 Å²	134	76 Å²	76	62%	0.62	38%	0.378	S	S	*	.			trans	-97.1	50.8	-175	-56.8	79.3	0	0	0	111.5	K538 C544	K538-H540 WeakPolarHBondContact CB-CE1 3.42Å; K538-H540 PolarHBondContact O-ND1 3.28Å; K538-H540 VanDerWaalsContact O-ND1 3.17Å; H540-C544 PolarHBondContact N-SG 2.97Å
541	G	80.4	Confident	83.7	Confident	16 Å²	16	73.7 Å²	73.7	17%	0.165	36%	0.362	C	S	.	.	S	Bend	trans	73.5	-173.4	-179.6	0	0	0	0	0	114.8	W539 K543 C544	W539-G541 VanDerWaalsContact C-N 3.35Å; W539-G541 VanDerWaalsContact CZ2-C 3.45Å; W539-G541 PolarHBondContact O-N 2.83Å; G541-K543 PolarHBondContact O-N 3.46Å; G541-C544 WeakPolarHBondContact O-CB 3.49Å; G541-C544 PolarHBondContact O-N 2.78Å
542	P	79.4	Confident	83.6	Confident	67 Å²	67	73.3 Å²	73.3	44%	0.435	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-62.5	-14.9	-168.4	20.7	-33.1	0	0	0	115.2	E425 C544 N545	E425-P542 WeakPolarHBondContact OE2-CD 3.46Å; P542-C544 PolarHBondContact O-N 2.68Å; P542-N545 PolarHBondContact O-N 2.77Å; P542-N545 VanDerWaalsContact O-N 3.08Å; P542-N545 WeakPolarHBondContact O-CB 3.29Å
543	K	76	Confident	83.5	Confident	179 Å²	179	69.4 Å²	69.4	78%	0.778	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-60.2	-26.5	170.8	-66.9	176.8	-175.4	168.9	0	112.5	G541 N545	G541-K543 PolarHBondContact O-N 3.46Å; K543-N545 VanDerWaalsContact C-N 3.31Å
544	C	78	Confident	83.3	Confident	18 Å²	18	69.7 Å²	69.7	12%	0.122	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-74.1	-19.9	176.6	-65.3	0	0	0	0	113.3	H540 G541 P542 K546 S549 F551 W552	H540-C544 PolarHBondContact N-SG 2.97Å; G541-C544 WeakPolarHBondContact O-CB 3.49Å; G541-C544 PolarHBondContact O-N 2.78Å; P542-C544 PolarHBondContact O-N 2.68Å; C544-K546 VanDerWaalsContact C-N 3.29Å; C544-K546 PolarHBondContact O-N 2.9Å; C544-S549 VanDerWaalsContact O-CB 3.24Å; C544-S549 WeakPolarHBondContact O-CB 3.36Å; C544-S549 PolarHBondContact O-OG 2.95Å; C544-F551 HydrophobicContact CB-CG 4.1Å; C544-F551 HydrophobicContact CB-CD1 4.47Å; C544-F551 HydrophobicContact CB-CB 3.97Å; C544-W552 PolarHBondContact O-NE1 3.29Å
545	N	78.3	Confident	83.2	Confident	37 Å²	37	67.4 Å²	67.4	20%	0.198	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-76.6	-11.8	-169.9	-60.8	-6.3	0	0	0	113.7	I433 W539 P542 K543 L547 W552	I433-N545 VanDerWaalsContact CD1-ND2 3.3Å; I433-N545 WeakPolarHBondContact CD1-ND2 3.23Å; I433-N545 HydrophobicContact CG2-CB 4.4Å; W539-N545 PolarHBondContact NE1-OD1 2.91Å; P542-N545 PolarHBondContact O-N 2.77Å; P542-N545 VanDerWaalsContact O-N 3.08Å; P542-N545 WeakPolarHBondContact O-CB 3.29Å; K543-N545 VanDerWaalsContact C-N 3.31Å; N545-L547 PolarHBondContact O-N 3.13Å; N545-W552 PolarHBondContact O-NE1 3.27Å; N545-W552 VanDerWaalsContact O-NE1 3.15Å
546	K	79.7	Confident	83	Confident	159 Å²	159	68.5 Å²	68.5	69%	0.691	33%	0.331	S	S	*	.	S	Bend	trans	-58.9	126.3	175.3	-63.4	-175.5	176.8	-172.3	0	110.8	C544 N548 S549 W552	C544-K546 VanDerWaalsContact C-N 3.29Å; C544-K546 PolarHBondContact O-N 2.9Å; K546-N548 VanDerWaalsContact C-N 3.26Å; K546-N548 PolarHBondContact O-N 3.47Å; K546-S549 WeakPolarHBondContact O-CB 3.46Å; K546-S549 PolarHBondContact O-N 3.09Å; K546-S549 PolarHBondContact O-OG 2.87Å; K546-W552 VanDerWaalsContact O-CD1 3.26Å
547	L	73.5	Confident	82.8	Confident	93 Å²	93	69.3 Å²	69.3	49%	0.487	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-40.3	-45.7	-176.5	-92.6	109.3	0	0	0	115.3	M437 N545 S549	M437-L547 HydrophobicContact CE-CB 4.41Å; M437-L547 HydrophobicContact CE-CD2 3.91Å; M437-L547 HydrophobicContact CE-CG 3.83Å; M437-L547 HydrophobicContact SD-CG 4.2Å; N545-L547 PolarHBondContact O-N 3.13Å; L547-S549 PolarHBondContact O-N 3.21Å; L547-S549 VanDerWaalsContact C-N 3.33Å
548	N	73	Confident	82.7	Confident	141 Å²	141	69.7 Å²	69.7	75%	0.754	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.7	18.7	-177.2	-75.8	-27.1	0	0	0	114.9	K546	K546-N548 VanDerWaalsContact C-N 3.26Å; K546-N548 PolarHBondContact O-N 3.47Å
549	S	83	Confident	82.7	Confident	19 Å²	19	64.3 Å²	64.3	13%	0.133	31%	0.307	C	S	.	.			trans	-67.9	157.3	-178.3	77.3	0	0	0	0	113	C544 K546 L547 F551 W552 K553	C544-S549 VanDerWaalsContact O-CB 3.24Å; C544-S549 WeakPolarHBondContact O-CB 3.36Å; C544-S549 PolarHBondContact O-OG 2.95Å; K546-S549 WeakPolarHBondContact O-CB 3.46Å; K546-S549 PolarHBondContact O-N 3.09Å; K546-S549 PolarHBondContact O-OG 2.87Å; L547-S549 PolarHBondContact O-N 3.21Å; L547-S549 VanDerWaalsContact C-N 3.33Å; S549-F551 PolarHBondContact O-N 2.82Å; S549-F551 PolarHBondContact OG-N 2.78Å; S549-F551 WeakPolarHBondContact OG-CB 3.24Å; S549-W552 PolarHBondContact O-N 3.07Å; S549-W552 VanDerWaalsContact OG-CD1 3.26Å; S549-W552 PolarHBondContact OG-N 2.89Å; S549-K553 PolarHBondContact O-N 2.91Å
550	K	83.1	Confident	82.5	Confident	189 Å²	189	63.9 Å²	63.9	82%	0.822	31%	0.305	S	S	*	.	H	α-helix	trans	-61.4	-27	170.5	-69	-176.8	177.6	-179.3	0	112.2	R554	K550-R554 VanDerWaalsContact O-CB 3.24Å; K550-R554 WeakPolarHBondContact O-CB 3.26Å; K550-R554 PolarHBondContact O-N 2.8Å
551	F	87.7	Confident	82.2	Confident	13 Å²	13	58.4 Å²	58.4	6%	0.057	28%	0.279	C	S	.	.	H	α-helix	trans	-64.1	-54.9	176.9	172.7	-92.7	0	0	0	110.8	F429 I510 I537 W539 C544 S549 K553 R554 L555	F429-F551 HydrophobicContact CE2-CE1 4.08Å; F429-F551 HydrophobicContact CE2-CZ 4.14Å; F429-F551 HydrophobicContact CZ-CE1 4.07Å; F429-F551 AromaticContact CZ-CZ 3.68Å; F429-F551 HydrophobicContact CZ-CZ 3.68Å; I510-F551 HydrophobicContact CD1-CZ 4.49Å; I510-F551 HydrophobicContact CG2-CE2 4.21Å; I510-F551 HydrophobicContact CG2-CZ 4.3Å; I537-F551 HydrophobicContact CG2-CE2 3.54Å; I537-F551 HydrophobicContact CG2-CD2 3.61Å; W539-F551 HydrophobicContact CB-CD2 4.45Å; W539-F551 HydrophobicContact CB-CE2 3.93Å; W539-F551 HydrophobicContact CB-CZ 4.49Å; W539-F551 AromaticContact CD1-CZ 3.97Å; W539-F551 HydrophobicContact CG-CE2 4.41Å; C544-F551 HydrophobicContact CB-CG 4.1Å; C544-F551 HydrophobicContact CB-CD1 4.47Å; C544-F551 HydrophobicContact CB-CB 3.97Å; S549-F551 PolarHBondContact O-N 2.82Å; S549-F551 PolarHBondContact OG-N 2.78Å; S549-F551 WeakPolarHBondContact OG-CB 3.24Å; F551-K553 PolarHBondContact O-N 2.79Å; F551-R554 VanDerWaalsContact O-N 3.13Å; F551-R554 PolarHBondContact O-N 2.88Å; F551-R554 WeakPolarHBondContact O-CB 3.48Å; F551-L555 HydrophobicContact CE1-CD2 4.4Å; F551-L555 PolarHBondContact O-N 3Å
552	W	87.6	Confident	81.8	Confident	1 Å²	1	60.6 Å²	60.6	0%	0.004	28%	0.284	C	S	.	.	H	α-helix	trans	-65.5	-41.4	179.9	-64.7	125.8	0	0	0	112.7	F429 I433 L434 M437 Y442 C544 N545 K546 S549 R554 L555 Q556	F429-W552 HydrophobicContact CE2-CH2 4.2Å; I433-W552 HydrophobicContact CG2-CZ2 4.19Å; L434-W552 HydrophobicContact CD1-CH2 4.28Å; L434-W552 HydrophobicContact CD1-CZ3 4.01Å; M437-W552 HydrophobicContact CB-CE3 4.38Å; M437-W552 HydrophobicContact CB-CH2 3.44Å; M437-W552 VanDerWaalsContact CB-CH2 3.44Å; M437-W552 HydrophobicContact CB-CZ2 3.79Å; M437-W552 HydrophobicContact CB-CZ3 3.76Å; M437-W552 HydrophobicContact CE-CD2 4.4Å; M437-W552 HydrophobicContact CE-CG 4.31Å; M437-W552 HydrophobicContact CG-CD2 3.8Å; M437-W552 HydrophobicContact CG-CE3 3.71Å; M437-W552 HydrophobicContact CG-CH2 3.6Å; M437-W552 HydrophobicContact CG-CZ2 3.66Å; M437-W552 HydrophobicContact CG-CZ3 3.61Å; M437-W552 HydrophobicContact SD-CZ2 4.42Å; Y442-W552 HydrophobicContact CE2-CB 4.48Å; Y442-W552 HydrophobicContact CE2-CE3 4.32Å; Y442-W552 WeakPolarHBondContact OH-CB 3.39Å; C544-W552 PolarHBondContact O-NE1 3.29Å; N545-W552 PolarHBondContact O-NE1 3.27Å; N545-W552 VanDerWaalsContact O-NE1 3.15Å; K546-W552 VanDerWaalsContact O-CD1 3.26Å; S549-W552 PolarHBondContact O-N 3.07Å; S549-W552 VanDerWaalsContact OG-CD1 3.26Å; S549-W552 PolarHBondContact OG-N 2.89Å; W552-R554 PolarHBondContact O-N 3.2Å; W552-L555 HydrophobicContact CE3-CD2 3.71Å; W552-L555 HydrophobicContact CZ3-CD2 3.6Å; W552-L555 PolarHBondContact O-N 2.98Å; W552-Q556 VanDerWaalsContact O-CB 3.31Å; W552-Q556 WeakPolarHBondContact O-CB 3.32Å; W552-Q556 PolarHBondContact O-N 3.38Å
553	K	84.3	Confident	81.1	Confident	59 Å²	59	63.9 Å²	63.9	26%	0.257	29%	0.288	S	S	.	.	H	α-helix	trans	-58.3	-35.8	172.8	-73.6	177.8	173.1	175.4	0	112.6	I383 E384 L387 S549 F551 Y557	I383-K553 HydrophobicContact CG2-CB 4.43Å; E384-K553 IonicContact OE1-NZ 3.69Å; E384-K553 PolarHBondContact OE1-NZ 3.28Å; L387-K553 HydrophobicContact CD1-CB 4.14Å; L387-K553 HydrophobicContact CD1-CG 4.3Å; S549-K553 PolarHBondContact O-N 2.91Å; F551-K553 PolarHBondContact O-N 2.79Å; K553-Y557 WeakPolarHBondContact O-CB 3.49Å; K553-Y557 PolarHBondContact O-N 2.7Å
554	R	86.7	Confident	80.5	Confident	84 Å²	84	59.5 Å²	59.5	32%	0.317	27%	0.272	S	S	.	.	H	α-helix	trans	-72.8	-42.9	175.9	-172.1	68.8	179.8	126.3	15	111.6	I537 K550 F551 W552 Y557 E558	I537-R554 HydrophobicContact CG1-CG 4.33Å; I537-R554 HydrophobicContact CD1-CG 4.27Å; K550-R554 VanDerWaalsContact O-CB 3.24Å; K550-R554 WeakPolarHBondContact O-CB 3.26Å; K550-R554 PolarHBondContact O-N 2.8Å; F551-R554 VanDerWaalsContact O-N 3.13Å; F551-R554 PolarHBondContact O-N 2.88Å; F551-R554 WeakPolarHBondContact O-CB 3.48Å; W552-R554 PolarHBondContact O-N 3.2Å; R554-Y557 PolarHBondContact O-N 3.24Å; R554-E558 IonicContact CZ-OE1 3.83Å; R554-E558 IonicContact NE-OE1 2.7Å; R554-E558 IonicContact NH1-OE1 3.37Å; R554-E558 PolarHBondContact NH1-OE1 3.47Å; R554-E558 IonicContact NH2-OE1 2.64Å; R554-E558 PolarHBondContact NH2-OE1 2.81Å; R554-E558 PolarHBondContact O-N 3.07Å
555	L	88.3	Confident	79.4	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-63.5	-47.5	177.5	-173.8	65.4	0	0	0	111.5	L434 L438 I508 I510 I537 F551 W552 Y557 E558 M559	L434-L555 HydrophobicContact CD1-CD2 3.85Å; L438-L555 HydrophobicContact CD1-CD2 4.43Å; L438-L555 HydrophobicContact CD2-CD2 3.96Å; L438-L555 HydrophobicContact CD2-CG 4.47Å; L438-L555 HydrophobicContact CG-CD2 4.44Å; I508-L555 HydrophobicContact CD1-CD1 4.49Å; I508-L555 HydrophobicContact CG2-CD1 3.67Å; I510-L555 HydrophobicContact CD1-CD1 4.35Å; I537-L555 HydrophobicContact CD1-CB 4.21Å; I537-L555 HydrophobicContact CD1-CD1 3.79Å; F551-L555 HydrophobicContact CE1-CD2 4.4Å; F551-L555 PolarHBondContact O-N 3Å; W552-L555 HydrophobicContact CE3-CD2 3.71Å; W552-L555 HydrophobicContact CZ3-CD2 3.6Å; W552-L555 PolarHBondContact O-N 2.98Å; L555-Y557 VanDerWaalsContact C-N 3.26Å; L555-Y557 PolarHBondContact O-N 2.89Å; L555-E558 PolarHBondContact O-N 2.94Å; L555-M559 WeakPolarHBondContact O-CG 3.47Å; L555-M559 PolarHBondContact O-N 3.15Å
556	Q	86.5	Confident	77.8	Confident	41 Å²	41	70.3 Å²	70.3	19%	0.192	33%	0.329	C	S	.	.	H	α-helix	trans	-59.5	-34.8	177.1	-168.5	-173.3	24	0	0	112.5	L387 R390 Y442 W552	L387-Q556 HydrophobicContact CD2-CG 4.3Å; R390-Q556 PolarHBondContact NH2-O 2.81Å; Y442-Q556 HydrophobicContact CD1-CG 4.38Å; Y442-Q556 HydrophobicContact CE1-CG 4.22Å; W552-Q556 VanDerWaalsContact O-CB 3.31Å; W552-Q556 WeakPolarHBondContact O-CB 3.32Å; W552-Q556 PolarHBondContact O-N 3.38Å
557	Y	84.8	Confident	76	Confident	76 Å²	76	69.5 Å²	69.5	30%	0.298	33%	0.331	S	S	.	.	H	α-helix	trans	-67.4	-32.9	174.8	176.3	-91.2	0	0	0	112.8	M386 K553 R554 L555	M386-Y557 HydrophobicContact CB-CD2 4.32Å; M386-Y557 HydrophobicContact CB-CE2 3.87Å; M386-Y557 HydrophobicContact CG-CE2 4.4Å; K553-Y557 WeakPolarHBondContact O-CB 3.49Å; K553-Y557 PolarHBondContact O-N 2.7Å; R554-Y557 PolarHBondContact O-N 3.24Å; L555-Y557 VanDerWaalsContact C-N 3.26Å; L555-Y557 PolarHBondContact O-N 2.89Å
558	E	87.8	Confident	74.1	Confident	15 Å²	15	70.8 Å²	70.8	7%	0.07	34%	0.343	C	S	.	.	H	α-helix	trans	-87.7	-26.4	-179.4	-59	-58.9	169.4	0	0	113.9	R472 K506 I508 T535 I537 R554 L555	R472-E558 PolarHBondContact NE-O 3.34Å; K506-E558 VanDerWaalsContact CE-OE2 3.29Å; K506-E558 WeakPolarHBondContact CE-OE2 3.48Å; K506-E558 PolarHBondContact NZ-O 3.43Å; K506-E558 IonicContact NZ-OE2 2.65Å; K506-E558 PolarHBondContact NZ-OE2 3.14Å; I508-E558 HydrophobicContact CD1-CB 4.12Å; I508-E558 HydrophobicContact CG1-CB 4.37Å; T535-E558 HydrophobicContact CG2-CG 4.25Å; I537-E558 HydrophobicContact CD1-CG 4.43Å; R554-E558 IonicContact CZ-OE1 3.83Å; R554-E558 IonicContact NE-OE1 2.7Å; R554-E558 IonicContact NH1-OE1 3.37Å; R554-E558 PolarHBondContact NH1-OE1 3.47Å; R554-E558 IonicContact NH2-OE1 2.64Å; R554-E558 PolarHBondContact NH2-OE1 2.81Å; R554-E558 PolarHBondContact O-N 3.07Å; L555-E558 PolarHBondContact O-N 2.94Å
559	M	87	Confident	72.1	Confident	1 Å²	1	72.5 Å²	72.5	1%	0.005	35%	0.346	C	S	.	.	S	Bend	trans	-61.9	160.3	171.7	-76.2	-64.8	-76.7	0	0	112.9	R390 A407 L438 Y444 I474 I508 L555	R390-M559 PolarHBondContact NH1-O 2.9Å; A407-M559 HydrophobicContact CB-CE 4.04Å; A407-M559 HydrophobicContact CB-SD 4.29Å; L438-M559 HydrophobicContact CD2-CE 4.36Å; L438-M559 HydrophobicContact CD2-CG 4.43Å; Y444-M559 HydrophobicContact CD1-CE 3.73Å; Y444-M559 HydrophobicContact CD2-CE 3.69Å; Y444-M559 HydrophobicContact CE1-CB 4.15Å; Y444-M559 HydrophobicContact CE1-CE 4.04Å; Y444-M559 HydrophobicContact CE2-CB 4.04Å; Y444-M559 HydrophobicContact CE2-CE 4Å; Y444-M559 HydrophobicContact CE2-CG 4.17Å; Y444-M559 HydrophobicContact CG-CE 3.54Å; Y444-M559 WeakPolarHBondContact OH-CB 3.47Å; I474-M559 HydrophobicContact CD1-SD 4.03Å; I508-M559 HydrophobicContact CD1-CG 4.26Å; I508-M559 HydrophobicContact CD1-SD 3.81Å; L555-M559 WeakPolarHBondContact O-CG 3.47Å; L555-M559 PolarHBondContact O-N 3.15Å
560	P	85.2	Confident	69.7	Low	0 Å²	0	80.3 Å²	80.3	0%	0	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-54.3	158.1	173.1	-20.1	34.1	0	0	0	111.3	R390 D406 Y444 K471 R472	R390-P560 PolarHBondContact NH2-O 2.96Å; R390-P560 VanDerWaalsContact NH2-O 3.15Å; D406-P560 HydrophobicContact CB-CG 4.49Å; D406-P560 WeakPolarHBondContact O-CG 3.45Å; Y444-P560 WeakPolarHBondContact CE1-O 3.37Å; Y444-P560 PolarHBondContact OH-O 3.47Å; K471-P560 HydrophobicContact CB-CG 3.89Å; K471-P560 HydrophobicContact CD-CB 4.25Å; K471-P560 HydrophobicContact CD-CG 4.17Å; R472-P560 HydrophobicContact CG-CG 3.85Å
561	F	76.4	Confident	67.2	Low	19 Å²	19	79.9 Å²	79.9	8%	0.083	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-80.3	126	170.8	177.3	-121.7	0	0	0	110	R390 G394 A395 R563	R390-F561 HydrophobicContact CG-CB 4.27Å; R390-F561 HydrophobicContact CG-CD2 3.6Å; R390-F561 HydrophobicContact CG-CE2 4.07Å; R390-F561 HydrophobicContact CG-CG 3.89Å; R390-F561 VanDerWaalsContact O-CE2 3.25Å; R390-F561 WeakPolarHBondContact O-CE2 3.34Å; R390-F561 WeakPolarHBondContact O-CZ 3.47Å; G394-F561 WeakPolarHBondContact O-CE1 3.32Å; A395-F561 VanDerWaalsContact O-CD1 3.23Å; A395-F561 WeakPolarHBondContact O-CD1 3.37Å; F561-R563 HydrophobicContact CE1-CG 4.06Å; F561-R563 HydrophobicContact CZ-CG 3.74Å
562	K	70.8	Confident	64.6	Low	61 Å²	61	83.4 Å²	83.4	27%	0.265	41%	0.413	S	S	.	.			trans	-132.8	136.9	173.2	-162.1	167.4	-161.5	166.3	0	107.9	D406 G443 Y444	D406-K562 IonicContact OD2-NZ 2.68Å; D406-K562 PolarHBondContact OD2-NZ 2.78Å; G443-K562 WeakPolarHBondContact O-CD 3.37Å; G443-K562 VanDerWaalsContact O-CE 3.24Å; G443-K562 WeakPolarHBondContact O-CE 3.28Å; G443-K562 PolarHBondContact O-NZ 2.83Å; Y444-K562 HydrophobicContact CD1-CB 4.34Å; Y444-K562 HydrophobicContact CD1-CD 4.06Å; Y444-K562 HydrophobicContact CE1-CB 3.85Å; Y444-K562 HydrophobicContact CE1-CD 4.42Å
563	R	64.6	Low	62	Low	137 Å²	137	90.7 Å²	90.7	52%	0.517	45%	0.451	S	S	.	.			trans	-76.3	126.9	172.1	-72.1	179.4	174.4	-176.4	0.8	108	G394 F561 E565	G394-R563 PolarHBondContact O-NH2 2.68Å; F561-R563 HydrophobicContact CE1-CG 4.06Å; F561-R563 HydrophobicContact CZ-CG 3.74Å; R563-E565 PolarHBondContact O-N 3.5Å
564	I	63.8	Low	59.6	Low	87 Å²	87	94.7 Å²	94.7	45%	0.446	48%	0.476	S	S	.	.			trans	-77.9	104	172.9	-58.2	174.6	0	0	0	106.3	Y442	Y442-I564 HydrophobicContact CD1-CD1 4.23Å
565	E	55.9	Low	57.2	Low	167 Å²	167	95.9 Å²	95.9	78%	0.78	49%	0.492	S	S	*	.			trans	-65.1	127.3	166.8	-67.1	-175	154.1	0	0	108.5	R563 I567	R563-E565 PolarHBondContact O-N 3.5Å; E565-I567 PolarHBondContact O-N 2.8Å; E565-I567 VanDerWaalsContact O-N 3.14Å
566	P	44.9	Very low	54.4	Low	114 Å²	114	100.4 Å²	100.4	74%	0.74	52%	0.524	S	S	*	.			trans	-69.7	113.3	178.4	27.6	-32.3	0	0	0	109.1	T568	P566-T568 PolarHBondContact O-N 2.84Å
567	I	41.7	Very low	52	Low	143 Å²	143	106.2 Å²	106.2	73%	0.733	55%	0.55	S	S	*	*			trans	-59.9	103.2	175.9	-58.3	173.1	0	0	0	108.8	E565 H569	E565-I567 PolarHBondContact O-N 2.8Å; E565-I567 VanDerWaalsContact O-N 3.14Å; I567-H569 PolarHBondContact O-N 3.18Å; I567-H569 VanDerWaalsContact O-N 3.14Å
568	T	32.9	Very low	49.4	Very low	120 Å²	120	110.5 Å²	110.5	74%	0.736	57%	0.573	S	S	*	*			trans	-69.5	105.2	167.9	40.2	0	0	0	0	108.7	P566 E570	P566-T568 PolarHBondContact O-N 2.84Å; T568-E570 VanDerWaalsContact C-N 3.29Å; T568-E570 PolarHBondContact O-N 2.84Å
569	H	31.5	Very low	46.8	Very low	177 Å²	177	113.3 Å²	113.3	82%	0.819	61%	0.606	S	S	*	*			trans	-69	83.6	173.2	-120.6	-65.9	0	0	0	109.7	I567	I567-H569 PolarHBondContact O-N 3.18Å; I567-H569 VanDerWaalsContact O-N 3.14Å
570	E	31.2	Very low	44.4	Very low	183 Å²	183	118.8 Å²	118.8	86%	0.855	64%	0.642	S	S	*	*			trans	-83.6	125.4	166.7	-102.8	-179.7	153.9	0	0	110.3	T568	T568-E570 VanDerWaalsContact C-N 3.29Å; T568-E570 PolarHBondContact O-N 2.84Å
571	Q	32.5	Very low	41.9	Very low	180 Å²	180	129 Å²	129	84%	0.841	69%	0.686	S	S	*	*			trans	-92.4	123.6	-178.5	-68	178.1	-58.6	0	0	110.3
572	A	31.5	Very low	39.9	Very low	86 Å²	86	131.7 Å²	131.7	71%	0.711	72%	0.72	S	S	*	*			trans	71.5	134.4	139.9	0	0	0	0	0	120.6
573	L	34.2	Very low	38.2	Very low	154 Å²	154	137.7 Å²	137.7	81%	0.806	75%	0.749	S	S	*	*			trans	80.5	89.3	143.9	-67.8	158.9	0	0	0	120.3
574	D	32.6	Very low	36.8	Very low	144 Å²	144	138 Å²	138	77%	0.77	76%	0.761	S	S	*	*				87.5	153.4	107.2	-133	-10.2	0	0	0	121.3
575	V	36.4	Very low	35.4	Very low	109 Å²	109	141.2 Å²	141.2	66%	0.661	77%	0.774	S	S	*	*			trans	69.1	82.9	163.2	-170.4	0	0	0	0	118.3
576	S	31.2	Very low	34.5	Very low	95 Å²	95	139.5 Å²	139.5	66%	0.664	77%	0.774	S	S	*	*				33.1	134.1	123.3	62.7	0	0	0	0	123.2
577	E	34.4	Very low	34.1	Very low	162 Å²	162	140.3 Å²	140.3	76%	0.757	78%	0.777	S	S	*	*			trans	83.1	137.3	138.3	-83.5	-157.5	101.8	0	0	122.7
578	Q	31.6	Very low	33.9	Very low	167 Å²	167	138.7 Å²	138.7	78%	0.78	78%	0.779	S	S	*	*			trans	71.6	102.8	149.1	-67.5	167.4	27.7	0	0	120.5
579	G	32.3	Very low	34.3	Very low	74 Å²	74	137 Å²	137	76%	0.763	78%	0.777	S	S	*	*				107.1	154.4	116.2	0	0	0	0	0	117.1
580	P	36.3	Very low	34.8	Very low	115 Å²	115	136.5 Å²	136.5	75%	0.747	78%	0.778	S	S	*	*			trans	-98.4	164.7	-165	38.7	-36.2	0	0	0	114.8
581	F	33.9	Very low	35	Very low	214 Å²	214	133 Å²	133	94%	0.939	77%	0.774	S	S	*	*			trans	72.6	122.8	176.3	-69.6	-88.6	0	0	0	116.8
582	G	32.8	Very low	35	Very low	77 Å²	77	133 Å²	133	79%	0.794	78%	0.776	S	S	*	*			trans	167.7	85.7	177.1	0	0	0	0	0	111.2
583	E	36.3	Very low	35.5	Very low	186 Å²	186	133.9 Å²	133.9	87%	0.869	78%	0.784	S	S	*	*			trans	-65.1	142.6	176.4	-59.7	162.2	113.1	0	0	111.6
584	L	34.5	Very low	35.4	Very low	145 Å²	145	131.1 Å²	131.1	76%	0.759	78%	0.783	S	S	*	*				171.1	122.6	116.9	-89.7	159.5	0	0	0	113.9
585	Q	34.7	Very low	35.5	Very low	154 Å²	154	129.1 Å²	129.1	72%	0.72	79%	0.787	S	S	*	*			trans	24	132.6	140.7	-59.3	174.6	-28.6	0	0	119.8
586	T	37.3	Very low	35.5	Very low	130 Å²	130	130 Å²	130	80%	0.798	79%	0.792	S	S	*	*				-167.6	116.5	67.3	31.9	0	0	0	0	109.7
587	V	37.1	Very low	35.8	Very low	132 Å²	132	131.3 Å²	131.3	80%	0.8	80%	0.801	S	S	*	*				64.2	105.6	85.3	-177.2	0	0	0	0	116.9
588	S	37.7	Very low	35.9	Very low	109 Å²	109	130.2 Å²	130.2	76%	0.762	81%	0.806	S	S	*	*				-177.7	100.9	124.9	-171	0	0	0	0	108.4
589	A	40.2	Very low	36.3	Very low	84 Å²	84	126.6 Å²	126.6	69%	0.694	81%	0.805	S	S	*	*				63.4	134.5	80.1	0	0	0	0	0	112.3
590	I	42.2	Very low	36.7	Very low	166 Å²	166	131.4 Å²	131.4	85%	0.851	81%	0.812	S	S	*	*			cis	-157.7	158.9	33.3	-63	166.8	0	0	0	107.5
591	S	36	Very low	36.7	Very low	111 Å²	111	129.9 Å²	129.9	78%	0.776	81%	0.809	S	S	*	*			cis	-175.3	149.2	-35.7	-174.8	0	0	0	0	107.4
592	M	33	Very low	36.8	Very low	178 Å²	178	126.3 Å²	126.3	88%	0.877	81%	0.805	S	S	*	*			trans	-83.9	164.1	174.3	-62.7	-146.9	-60.7	0	0	113
593	A	40.7	Very low	37	Very low	106 Å²	106	127.2 Å²	127.2	88%	0.876	81%	0.805	S	S	*	*			trans	-152.7	108.6	155.4	0	0	0	0	0	111.8
594	A	32.3	Very low	37	Very low	96 Å²	96	127 Å²	127	79%	0.793	80%	0.804	S	S	*	*			trans	-150.6	136.6	165.8	0	0	0	0	0	109.8
595	A	35	Very low	37.3	Very low	102 Å²	102	124.7 Å²	124.7	84%	0.843	80%	0.797	S	S	*	*			trans	63.9	147.8	-176.7	0	0	0	0	0	114.6
596	T	36	Very low	37.4	Very low	127 Å²	127	124 Å²	124	78%	0.779	80%	0.798	S	S	*	*			cis	-145	162.3	17	47	0	0	0	0	111.4
597	S	38.1	Very low	37.1	Very low	122 Å²	122	123.5 Å²	123.5	85%	0.853	79%	0.79	S	S	*	*				179.5	149	121.5	-79.7	0	0	0	0	112.9
598	T	36.1	Very low	36.8	Very low	140 Å²	140	127.8 Å²	127.8	86%	0.859	79%	0.792	S	S	*	*			trans	-95.9	149.2	-168.6	47.4	0	0	0	0	114.9
599	A	40.4	Very low	36.5	Very low	91 Å²	91	126.7 Å²	126.7	75%	0.752	78%	0.784	S	S	*	*				172.4	120	118.4	0	0	0	0	0	115.3
600	L	39.9	Very low	36	Very low	175 Å²	175	127.9 Å²	127.9	92%	0.916	78%	0.783	S	S	*	*			trans	51.7	144.4	136.1	-78.4	155.5	0	0	0	125.2
601	A	37.6	Very low	35.4	Very low	83 Å²	83	128.2 Å²	128.2	69%	0.686	78%	0.779	S	S	*	*			trans	89.6	79.1	148.3	0	0	0	0	0	121.4
602	T	35.7	Very low	35.3	Very low	139 Å²	139	129.9 Å²	129.9	85%	0.853	77%	0.774	S	S	*	*				39.2	130.2	122.9	57.1	0	0	0	0	122.9
603	A	35.7	Very low	35.2	Very low	95 Å²	95	127.2 Å²	127.2	79%	0.785	76%	0.763	S	S	*	*			trans	128.6	108.2	133.6	0	0	0	0	0	117.2
604	H	36.7	Very low	34.7	Very low	183 Å²	183	127.5 Å²	127.5	85%	0.847	75%	0.754	S	S	*	*			trans	-14.4	168.8	143.7	-70.2	-69.5	0	0	0	120.4
605	P	40.8	Very low	34.6	Very low	95 Å²	95	132.6 Å²	132.6	62%	0.617	76%	0.755	S	S	*	*			cis	-137.8	-139.5	-41.3	40.3	-20.3	0	0	0	110.1
606	D	36.3	Very low	34.3	Very low	139 Å²	139	135.6 Å²	135.6	74%	0.743	75%	0.751	S	S	*	*			trans	73	152.9	164	-68.5	-19.3	0	0	0	118.8
607	L	31.4	Very low	33.9	Very low	121 Å²	121	134.3 Å²	134.3	63%	0.634	75%	0.747	S	S	*	*			cis	-172.4	148.6	-26.9	-167.1	95.8	0	0	0	107.6
608	R	31.1	Very low	33.5	Very low	222 Å²	222	137.4 Å²	137.4	84%	0.838	75%	0.748	S	S	*	*			trans	62	166.5	163.3	-84.9	-170.9	164.6	101.8	-4.8	116.7
609	S	31.2	Very low	33.2	Very low	86 Å²	86	139.1 Å²	139.1	60%	0.601	75%	0.748	S	S	*	*			cis	-166.8	149.4	-23.9	50.3	0	0	0	0	110.5
610	T	30	Very low	32.7	Very low	109 Å²	109	143.9 Å²	143.9	67%	0.669	75%	0.747	S	S	*	*			trans	18.1	128.1	146.6	56.9	0	0	0	0	120.1
611	F	30.5	Very low	32.4	Very low	173 Å²	173	145.2 Å²	145.2	76%	0.759	75%	0.748	S	S	*	*				176.4	158.6	96.1	-109.5	-80	0	0	0	114.4
612	H	32.6	Very low	31.9	Very low	145 Å²	145	147.8 Å²	147.8	67%	0.671	74%	0.744	S	S	*	*			trans	82.1	120.8	153.4	-77.7	-59.8	0	0	0	123.8
613	N	32.2	Very low	31.8	Very low	122 Å²	122	149.6 Å²	149.6	65%	0.652	74%	0.742	S	S	*	*				92.9	98	127.3	-71.9	4.9	0	0	0	122.4
614	T	28.9	Very low	31.4	Very low	112 Å²	112	154 Å²	154	69%	0.687	74%	0.74	S	S	*	*				60.9	141.7	121.9	55.1	0	0	0	0	122.9
615	Y	29.4	Very low	31.2	Very low	204 Å²	204	156.8 Å²	156.8	80%	0.8	75%	0.745	S	S	*	*			trans	84.2	124.7	159.4	-72	-70.7	0	0	0	120.5
616	H	29.9	Very low	30.7	Very low	165 Å²	165	161.4 Å²	161.4	76%	0.764	75%	0.75	S	S	*	*			trans	65.5	129.5	147.9	-81.2	-72.5	0	0	0	123.4
617	S	27.5	Very low	30.4	Very low	99 Å²	99	160.3 Å²	160.3	69%	0.692	75%	0.753	S	S	*	*			trans	66.7	119.5	139.7	60.9	0	0	0	0	121.9
618	Q	28.6	Very low	30.6	Very low	188 Å²	188	164 Å²	164	88%	0.879	76%	0.76	S	S	*	*			trans	39.3	106.3	130.9	-60.2	-177.4	-7.2	0	0	119.8
619	M	31.6	Very low	30.4	Very low	175 Å²	175	161 Å²	161	86%	0.862	76%	0.756	S	S	*	*				-157.4	133.1	129.7	-79.9	-136.5	-160.6	0	0	107.7
620	R	30.1	Very low	30.5	Very low	192 Å²	192	168.2 Å²	168.2	73%	0.725	77%	0.771	S	S	*	*			cis	84.7	98.1	46.8	-166.5	-168	-149.3	-176.4	11.5	112.8
621	Q	32.9	Very low	30.6	Very low	202 Å²	202	169.4 Å²	169.4	94%	0.944	77%	0.774	S	S	*	*			trans	-125.9	134.4	150.8	-91.5	-177.3	-18.1	0	0	109.8
622	K	27.6	Very low	31	Very low	137 Å²	137	167.8 Å²	167.8	60%	0.596	78%	0.777	S	S	*	*			trans	-102.9	157.7	179.6	-68	173.1	167.2	-176.9	0	109.1
623	H	32	Very low	31.1	Very low	178 Å²	178	166.5 Å²	166.5	82%	0.824	78%	0.782	S	S	*	*				-167.9	105.3	127.5	-89	-65	0	0	0	107.6
624	Y	28.6	Very low	31.3	Very low	186 Å²	186	166.4 Å²	166.4	73%	0.729	79%	0.788	S	S	*	*				83.1	101	91.7	-103.4	-82.5	0	0	0	115
625	Y	31.8	Very low	31.4	Very low	242 Å²	242	168.3 Å²	168.3	95%	0.949	80%	0.8	S	S	*	*			trans	-141.4	151.4	145.6	-119.9	-90.7	0	0	0	109
626	R	30.7	Very low	31.5	Very low	192 Å²	192	161.7 Å²	161.7	73%	0.725	79%	0.793	S	S	*	*			trans	-121.4	122.9	-159.3	-177.2	-176.4	-171.8	166.6	1.8	110.5
627	S	30.7	Very low	31.7	Very low	117 Å²	117	159.9 Å²	159.9	82%	0.818	79%	0.794	S	S	*	*			trans	-110.2	141.5	169.1	50.8	0	0	0	0	110.2
628	Y	33.9	Very low	31.8	Very low	197 Å²	197	163.2 Å²	163.2	77%	0.773	80%	0.803	S	S	*	*			trans	-88.5	149.7	172.2	-84.2	-97.3	0	0	0	110.5
629	E	27.6	Very low	32	Very low	161 Å²	161	159.1 Å²	159.1	75%	0.752	79%	0.793	S	S	*	*			trans	-119.4	147.4	-172.4	-173	165.6	-130.7	0	0	109.1
630	Y	33.7	Very low	31.9	Very low	236 Å²	236	158.7 Å²	158.7	93%	0.925	79%	0.794	S	S	*	*			trans	-150.1	106.8	168.6	-116.3	-78.2	0	0	0	109.2
631	D	31.6	Very low	31.7	Very low	135 Å²	135	155.7 Å²	155.7	72%	0.722	80%	0.796	S	S	*	*			trans	-78.8	141.8	173.7	-73.3	-57.7	0	0	0	112.3
632	V	38.8	Very low	31.4	Very low	138 Å²	138	151.2 Å²	151.2	84%	0.836	79%	0.787	S	S	*	*			trans	-147	138.3	140.7	177.1	0	0	0	0	108.2
633	P	35.1	Very low	31.6	Very low	118 Å²	118	151.7 Å²	151.7	77%	0.766	80%	0.795	S	S	*	*			trans	-100.7	178.8	-154.9	41	-37.3	0	0	0	115.6
634	P	36	Very low	31.3	Very low	120 Å²	120	146.5 Å²	146.5	78%	0.779	79%	0.789	S	S	*	*			trans	-105.4	159.2	-153.9	39.6	-35.9	0	0	0	116.8
635	T	32.4	Very low	31.4	Very low	153 Å²	153	145.2 Å²	145.2	94%	0.939	80%	0.795	S	S	*	*			trans	-177.5	144.8	148.1	26	0	0	0	0	105.8
636	G	31.5	Very low	31.3	Very low	64 Å²	64	142 Å²	142	66%	0.66	79%	0.789	S	S	*	*			cis	178.5	168.4	4.6	0	0	0	0	0	109.6
637	T	33	Very low	31.3	Very low	128 Å²	128	141.2 Å²	141.2	79%	0.785	79%	0.793	S	S	*	*			trans	61	98	160	55.6	0	0	0	0	122
638	L	30.5	Very low	31.5	Very low	168 Å²	168	141.5 Å²	141.5	88%	0.88	79%	0.79	S	S	*	*				74.9	159.1	115.1	-70.4	172.6	0	0	0	120.7
639	P	32.7	Very low	31.2	Very low	103 Å²	103	142.3 Å²	142.3	67%	0.669	79%	0.793	S	S	*	*			trans	-117.7	171.9	-142.2	43.3	-35.2	0	0	0	114.8
640	L	29.5	Very low	31.3	Very low	166 Å²	166	140.8 Å²	140.8	87%	0.869	80%	0.799	S	S	*	*			trans	-164.6	153.4	133.8	-131.1	73.1	0	0	0	113.1
641	T	25.5	Very low	31.2	Very low	128 Å²	128	136 Å²	136	79%	0.785	79%	0.789	S	S	*	*			trans	-80.5	148.8	172.7	51.5	0	0	0	0	112.8
642	S	26.1	Very low	31.3	Very low	108 Å²	108	137.2 Å²	137.2	76%	0.755	79%	0.794	S	S	*	*			trans	162.2	165.3	135.1	-170.1	0	0	0	0	112.1
643	I	31.1	Very low	30.9	Very low	148 Å²	148	136.6 Å²	136.6	76%	0.759	79%	0.793	S	S	*	*			trans	68.4	118.4	166	-40.8	-177.5	0	0	0	114.9
644	G	25.9	Very low	30.8	Very low	68 Å²	68	138.8 Å²	138.8	70%	0.701	80%	0.795	S	S	*	*			cis	96.6	81.9	5.5	0	0	0	0	0	113.2
645	N	32	Very low	30.7	Very low	159 Å²	159	138.2 Å²	138.2	85%	0.85	79%	0.79	S	S	*	*			trans	-151.7	142.2	163.7	-116.6	-16.8	0	0	0	114
646	Q	28.7	Very low	31	Very low	174 Å²	174	138.4 Å²	138.4	81%	0.813	78%	0.784	S	S	*	*			trans	-92	170.7	-177.5	-61.5	164.3	-39.3	0	0	111.3
647	H	32.2	Very low	31.3	Very low	176 Å²	176	141.4 Å²	141.4	82%	0.815	78%	0.784	S	S	*	*			trans	166.4	140.3	142.9	-88.8	-56	0	0	0	109.6
648	T	33.5	Very low	31.3	Very low	124 Å²	124	143 Å²	143	76%	0.761	79%	0.787	S	S	*	*			cis	-154.2	153.3	-30.1	-28.6	0	0	0	0	107.4
649	Y	26.9	Very low	31.4	Very low	214 Å²	214	138.6 Å²	138.6	84%	0.839	78%	0.782	S	S	*	*			trans	-72.6	156.7	178.1	-87	-104.4	0	0	0	113.9
650	C	31.1	Very low	31.4	Very low	128 Å²	128	143.3 Å²	143.3	87%	0.865	80%	0.795	S	S	*	*			trans	-140.4	147.5	145.5	-119.7	0	0	0	0	111.4
651	N	31.6	Very low	31.6	Very low	135 Å²	135	146.9 Å²	146.9	72%	0.722	80%	0.797	S	S	*	*			trans	-93.7	165	-160.4	-59.7	-65.2	0	0	0	114.1
652	I	33.7	Very low	32.2	Very low	161 Å²	161	145.8 Å²	145.8	83%	0.826	79%	0.793	S	S	*	*			trans	163.7	124.6	130.1	-82.3	151.8	0	0	0	108.3
653	P	30	Very low	32.6	Very low	126 Å²	126	149.2 Å²	149.2	82%	0.818	80%	0.797	S	S	*	*				-142.5	144.2	121.4	35.1	-21.4	0	0	0	113.9
654	M	32.4	Very low	32.7	Very low	164 Å²	164	147.4 Å²	147.4	81%	0.808	79%	0.793	S	S	*	*			trans	-139.1	128.9	166.8	-97	-138.8	-58.6	0	0	113.1
655	T	35.3	Very low	33	Very low	108 Å²	108	153.1 Å²	153.1	66%	0.663	80%	0.798	S	S	*	*			trans	60.7	124.1	142.3	62	0	0	0	0	121.5
656	L	38.2	Very low	33	Very low	157 Å²	157	150.7 Å²	150.7	82%	0.822	79%	0.794	S	S	*	*				-168.3	100	109.7	-92	172.7	0	0	0	107.5
657	I	37.3	Very low	33.1	Very low	127 Å²	127	147.1 Å²	147.1	65%	0.651	79%	0.788	S	S	*	*				83	117.1	88.8	-73.3	-174	0	0	0	114.9
658	N	33.3	Very low	33	Very low	160 Å²	160	149.2 Å²	149.2	86%	0.856	79%	0.789	S	S	*	*			trans	63.9	132.6	162.7	-62.6	-11.9	0	0	0	119.9
659	G	32.5	Very low	32.9	Very low	76 Å²	76	149.1 Å²	149.1	78%	0.784	78%	0.78	S	S	*	*			cis	176.6	155.8	-5.7	0	0	0	0	0	113.1
660	Q	32.7	Very low	33.2	Very low	202 Å²	202	147.3 Å²	147.3	94%	0.944	78%	0.779	S	S	*	*			trans	-117	141.9	175.8	-89.7	-177	-21.6	0	0	112.9
661	R	34.1	Very low	33	Very low	241 Å²	241	148.4 Å²	148.4	91%	0.909	78%	0.776	S	S	*	*			trans	-56.5	-177.4	172.6	-97.1	-175	165.8	172.6	-3.8	115
662	P	37.7	Very low	33.4	Very low	106 Å²	106	146.1 Å²	146.1	69%	0.688	77%	0.769	S	S	*	*			cis	-140.8	172.2	-34	37.4	-20.8	0	0	0	114.4
663	Q	34.2	Very low	33.3	Very low	180 Å²	180	144.9 Å²	144.9	84%	0.841	76%	0.764	S	S	*	*			trans	175.3	146	144.6	-96.7	-175.4	51.8	0	0	106.5
664	T	32.7	Very low	33.4	Very low	109 Å²	109	148 Å²	148	67%	0.669	77%	0.767	S	S	*	*			cis	-159.2	155.6	4.8	-4.1	0	0	0	0	111.1
665	K	32.2	Very low	33.5	Very low	188 Å²	188	143.3 Å²	143.3	82%	0.817	76%	0.755	S	S	*	*			trans	68.6	124	150.8	-71.3	-179.9	177.6	178.8	0	122.8
666	S	32.4	Very low	33.6	Very low	108 Å²	108	146.3 Å²	146.3	76%	0.755	76%	0.761	S	S	*	*			trans	55.4	141.8	138.9	61	0	0	0	0	120.7
667	S	30.7	Very low	33.5	Very low	100 Å²	100	143.8 Å²	143.8	70%	0.699	75%	0.752	S	S	*	*			cis	180	160.6	-5.2	45.6	0	0	0	0	108.3
668	R	31.3	Very low	33.5	Very low	220 Å²	220	144.4 Å²	144.4	83%	0.83	76%	0.757	S	S	*	*			trans	66.4	159.4	170.9	-75	-173.1	134	151.4	-1	116.1
669	E	30.7	Very low	33.7	Very low	122 Å²	122	142.1 Å²	142.1	57%	0.57	75%	0.753	S	S	*	*			cis	-164.8	159.6	-35.7	-126.3	-179.8	117.2	0	0	106.5
670	Q	33.4	Very low	34	Very low	175 Å²	175	142.1 Å²	142.1	82%	0.818	75%	0.746	S	S	*	*			trans	76.6	157.5	157.1	-65.5	162.8	14.7	0	0	120.8
671	N	27.4	Very low	34.2	Very low	151 Å²	151	139.8 Å²	139.8	81%	0.807	74%	0.738	S	S	*	*			trans	-137.9	173.3	-166.4	-165.1	42.9	0	0	0	104.9
672	P	38.8	Very low	34.1	Very low	87 Å²	87	134.9 Å²	134.9	57%	0.565	73%	0.73	S	S	*	*			cis	-122.5	-147.5	-26.4	30.1	-5.8	0	0	0	111
673	D	32.8	Very low	34	Very low	136 Å²	136	135.1 Å²	135.1	73%	0.727	73%	0.731	S	S	*	*			trans	96.3	133.1	153.1	-61.8	-28.6	0	0	0	122.2
674	E	32.6	Very low	33.9	Very low	191 Å²	191	133.5 Å²	133.5	89%	0.893	73%	0.727	S	S	*	*			trans	56.7	148.7	150.3	-67.5	-174.5	156.2	0	0	121.2
675	A	34.1	Very low	33.9	Very low	66 Å²	66	135.5 Å²	135.5	55%	0.545	73%	0.733	S	S	.	*			cis	-169.2	-179	-16.2	0	0	0	0	0	109.4
676	H	36.9	Very low	34.1	Very low	171 Å²	171	131.9 Å²	131.9	79%	0.792	73%	0.729	S	S	*	*			trans	75	142.3	158	-62.2	-57	0	0	0	120.5
677	T	36	Very low	34.2	Very low	103 Å²	103	137 Å²	137	63%	0.632	73%	0.731	S	S	*	*			cis	-172.1	164.3	-34.8	10.4	0	0	0	0	109.8
678	N	36.8	Very low	34.2	Very low	141 Å²	141	138.8 Å²	138.8	75%	0.754	73%	0.729	S	S	*	*			trans	75.1	140.8	162.2	-50	-34.2	0	0	0	117.2
679	S	38.4	Very low	34.2	Very low	111 Å²	111	134.7 Å²	134.7	78%	0.776	73%	0.728	S	S	*	*			cis	-169.3	172.6	-13.3	-86	0	0	0	0	107
680	A	38.5	Very low	34.1	Very low	76 Å²	76	133.2 Å²	133.2	63%	0.628	73%	0.731	S	S	*	*			cis	-160	157	12.1	0	0	0	0	0	112.5
681	I	36.2	Very low	34.2	Very low	153 Å²	153	132.4 Å²	132.4	79%	0.785	73%	0.731	S	S	*	*				50.2	127.4	123.4	-61.4	175.5	0	0	0	118.6
682	L	33.3	Very low	34.6	Very low	139 Å²	139	130 Å²	130	73%	0.728	73%	0.726	S	S	*	*			cis	-162.8	151.7	7.2	-117.1	169.3	0	0	0	110.7
683	P	34.9	Very low	34.3	Very low	110 Å²	110	130.8 Å²	130.8	71%	0.714	73%	0.734	S	S	*	*			trans	-109.6	-153.1	163.2	38.7	-29.1	0	0	0	112.7
684	L	32.7	Very low	34.6	Very low	146 Å²	146	131.3 Å²	131.3	76%	0.764	74%	0.741	S	S	*	*			trans	93.3	148.7	-176.1	-51.9	168.7	0	0	0	113.9
685	L	32.9	Very low	34.7	Very low	151 Å²	151	129.1 Å²	129.1	79%	0.791	74%	0.735	S	S	*	*			cis	-165.3	162.5	-12	-108.3	166.6	0	0	0	107.4
686	P	35.7	Very low	34.7	Very low	112 Å²	112	141.1 Å²	141.1	73%	0.727	77%	0.766	S	S	*	*			trans	-104.4	142.7	178.2	36.7	-28.8	0	0	0	114.9
687	R	34	Very low	34.6	Very low	216 Å²	216	139.7 Å²	139.7	82%	0.815	77%	0.765	S	S	*	*			trans	-179	121.5	157.9	-106.7	-174.2	133.6	125.9	10.6	110
688	E	29.9	Very low	34.5	Very low	137 Å²	137	141.6 Å²	141.6	64%	0.64	77%	0.772	S	S	*	*				87.8	135.7	86.2	-86.1	-165.7	146.7	0	0	115.9
689	T	32	Very low	34.4	Very low	134 Å²	134	141.6 Å²	141.6	82%	0.822	77%	0.773	S	S	*	*			trans	68.8	147	170.3	71.5	0	0	0	0	117.2
690	S	29.6	Very low	34.1	Very low	91 Å²	91	143.4 Å²	143.4	64%	0.636	77%	0.772	S	S	*	*			cis	-171.4	179.1	-14.6	49.9	0	0	0	0	109.7
691	I	35	Very low	33.9	Very low	158 Å²	158	147.6 Å²	147.6	81%	0.81	78%	0.781	S	S	*	*			trans	75.8	136.3	165.1	-53.8	154.9	0	0	0	115
692	S	35.1	Very low	33.7	Very low	100 Å²	100	147.3 Å²	147.3	70%	0.699	78%	0.781	S	S	*	*			cis	-162.9	159.9	-22.6	56.3	0	0	0	0	111
693	S	32	Very low	33.7	Very low	104 Å²	104	147.9 Å²	147.9	73%	0.727	79%	0.785	S	S	*	*			trans	-33.1	147.4	164.5	54.2	0	0	0	0	118.8
694	V	39.6	Very low	33.7	Very low	147 Å²	147	150.8 Å²	150.8	89%	0.891	79%	0.791	S	S	*	*				-150.3	149.9	122.8	173	0	0	0	0	109.3
695	I	35.5	Very low	33.7	Very low	146 Å²	146	151.2 Å²	151.2	75%	0.749	79%	0.793	S	S	*	*			trans	-87.2	150.5	-172.6	-65.1	153.1	0	0	0	112.8
696	W	33.6	Very low	33.8	Very low	318 Å²	318	151.2 Å²	151.2	100%	1.205	79%	0.793	S	S	*	*			trans	-140.5	0	136.3	-97.1	90.8	0	0	0	109

Retrieved 696 of 696 residues in 421 ms (Link to these results)

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