A0A087Y3M1_POEFO Loading...

Pleiotropic regulator 1

Involved in pre-mRNA splicing as component of the spliceosome. Component of the PRP19-CDC5L complex that forms an integral part of the spliceosome and is required for activating pre-mRNA splicing. As a component of the minor spliceosome, involved in the splicing of U12-type introns in pre-mRNAs.

AlphaFold DB , UniProt , Accession A0A087Y3M1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 515 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.1	Very low	58.4	Low	244 Å²	244	149.3 Å²	149.3	100%	1.202	76%	0.761	S	S	*	*				0	97.3	0	-72.9	174.4	179	0	0	106.9
2	T	41.8	Very low	60.1	Low	139 Å²	139	141.8 Å²	141.8	85%	0.853	73%	0.728	S	S	*	*			trans	-87.6	107.3	176.9	43.1	0	0	0	0	107.5	E4	T2-E4 PolarHBondContact O-N 2.88Å
3	E	50.3	Low	61.2	Low	186 Å²	186	139.2 Å²	139.2	87%	0.869	72%	0.715	S	S	*	*			trans	-63.6	123.2	174.9	-72.7	-174.8	152.5	0	0	109.9	V5	E3-V5 PolarHBondContact O-N 2.85Å
4	E	47.4	Very low	62.3	Low	193 Å²	193	135.1 Å²	135.1	90%	0.902	70%	0.699	S	S	*	*			trans	-67.9	110.9	172.8	-81.2	-171.5	143.5	0	0	109.8	T2 Q6	T2-E4 PolarHBondContact O-N 2.88Å; E4-Q6 PolarHBondContact O-N 2.82Å; E4-Q6 VanDerWaalsContact O-N 3.1Å
5	V	59.8	Low	63.5	Low	127 Å²	127	134.2 Å²	134.2	77%	0.77	69%	0.689	S	S	*	*			trans	-67.6	109.5	172.5	179.3	0	0	0	0	108.8	E3 K7	E3-V5 PolarHBondContact O-N 2.85Å; V5-K7 PolarHBondContact O-N 2.75Å
6	Q	62.9	Low	64.6	Low	160 Å²	160	135.2 Å²	135.2	75%	0.748	68%	0.681	S	S	*	*			trans	-67.7	101.6	179.1	-156.8	174.6	27	0	0	110.4	E4 H8	E4-Q6 PolarHBondContact O-N 2.82Å; E4-Q6 VanDerWaalsContact O-N 3.1Å; Q6-H8 PolarHBondContact O-N 2.73Å; Q6-H8 VanDerWaalsContact O-N 3.11Å; Q6-H8 PolarHBondContact O-ND1 2.68Å
7	K	60.1	Low	65.3	Low	201 Å²	201	131.5 Å²	131.5	87%	0.874	67%	0.67	S	S	*	*			trans	-68.6	106	-178.9	-65.9	-178.9	-177.5	175.8	0	110.1	V5	V5-K7 PolarHBondContact O-N 2.75Å
8	H	65.9	Low	66.4	Low	82 Å²	82	130.3 Å²	130.3	38%	0.38	67%	0.665	S	S	.	*			trans	-84.9	139.9	172.2	-70.1	71.2	0	0	0	110	Q6 L13 R16	Q6-H8 PolarHBondContact O-N 2.73Å; Q6-H8 VanDerWaalsContact O-N 3.11Å; Q6-H8 PolarHBondContact O-ND1 2.68Å; H8-L13 HydrophobicContact CB-CD1 4.38Å; H8-R16 PolarHBondContact CD2-NH1 3.13Å; H8-R16 VanDerWaalsContact CD2-NH1 3.28Å; H8-R16 PolarHBondContact NE2-NH1 2.89Å; H8-R16 VanDerWaalsContact NE2-NH1 3.18Å
9	S	75.1	Confident	67.3	Low	74 Å²	74	130.8 Å²	130.8	52%	0.517	66%	0.662	S	S	.	*			trans	-55.5	140.7	173.1	171.8	0	0	0	0	110.8	H11 T12 L13	S9-H11 PolarHBondContact O-N 2.76Å; S9-H11 VanDerWaalsContact O-N 3.13Å; S9-T12 WeakPolarHBondContact O-CB 3.44Å; S9-T12 PolarHBondContact O-N 3.13Å; S9-L13 PolarHBondContact O-N 2.98Å
10	V	65.8	Low	68	Low	113 Å²	113	134.5 Å²	134.5	69%	0.685	67%	0.668	S	S	*	*	H	α-helix	trans	-52.4	-37.3	179.4	177.1	0	0	0	0	110.9	T12 L13 V14	V10-T12 VanDerWaalsContact C-N 3.35Å; V10-T12 PolarHBondContact O-N 3.2Å; V10-L13 PolarHBondContact O-N 3.34Å; V10-V14 HydrophobicContact CG1-CG2 4.36Å; V10-V14 WeakPolarHBondContact O-CG2 3.26Å; V10-V14 PolarHBondContact O-N 3.2Å
11	H	71.6	Confident	68.5	Low	123 Å²	123	131.9 Å²	131.9	57%	0.569	66%	0.659	S	S	*	*	H	α-helix	trans	-59.4	-43.9	176.6	-168.7	-90.7	0	0	0	112.1	S9 L13 V14 F15	S9-H11 PolarHBondContact O-N 2.76Å; S9-H11 VanDerWaalsContact O-N 3.13Å; H11-L13 VanDerWaalsContact C-N 3.33Å; H11-L13 PolarHBondContact O-N 3.14Å; H11-V14 PolarHBondContact O-N 2.82Å; H11-F15 AromaticContact CE1-CD2 3.45Å; H11-F15 VanDerWaalsContact CE1-CD2 3.45Å; H11-F15 WeakPolarHBondContact CE1-CD2 3.31Å; H11-F15 AromaticContact CE1-CE2 3.12Å; H11-F15 WeakPolarHBondContact CE1-CE2 3.49Å; H11-F15 AromaticContact ND1-CD2 3.62Å; H11-F15 AromaticContact ND1-CE2 3.79Å; H11-F15 AromaticContact NE2-CD2 3.96Å; H11-F15 AromaticContact NE2-CE2 3.36Å; H11-F15 WeakPolarHBondContact NE2-CE2 3.37Å; H11-F15 WeakPolarHBondContact O-CD2 3.25Å; H11-F15 PolarHBondContact O-N 2.99Å
12	T	77.9	Confident	70.3	Confident	59 Å²	59	125.9 Å²	125.9	36%	0.362	63%	0.628	S	S	.	*	H	α-helix	trans	-68	-33.9	179.6	-41.7	0	0	0	0	112.1	S9 V10 R16	S9-T12 WeakPolarHBondContact O-CB 3.44Å; S9-T12 PolarHBondContact O-N 3.13Å; V10-T12 VanDerWaalsContact C-N 3.35Å; V10-T12 PolarHBondContact O-N 3.2Å; T12-R16 WeakPolarHBondContact O-CB 3.39Å; T12-R16 WeakPolarHBondContact O-CG 3.38Å; T12-R16 PolarHBondContact O-N 2.94Å; T12-R16 VanDerWaalsContact O-N 3.08Å
13	L	74.9	Confident	71.9	Confident	108 Å²	108	123.3 Å²	123.3	57%	0.565	61%	0.609	S	S	*	*	H	α-helix	trans	-68.9	-43.3	175.3	-105.3	149.1	0	0	0	111.8	H8 S9 V10 H11 R16 S17	H8-L13 HydrophobicContact CB-CD1 4.38Å; S9-L13 PolarHBondContact O-N 2.98Å; V10-L13 PolarHBondContact O-N 3.34Å; H11-L13 VanDerWaalsContact C-N 3.33Å; H11-L13 PolarHBondContact O-N 3.14Å; L13-R16 PolarHBondContact O-N 2.68Å; L13-S17 WeakPolarHBondContact O-CB 3.41Å; L13-S17 PolarHBondContact O-N 2.85Å
14	V	76.4	Confident	72.9	Confident	82 Å²	82	120.8 Å²	120.8	50%	0.497	60%	0.599	S	S	.	*	H	α-helix	trans	-63	-45.3	176.5	173.2	0	0	0	0	110.8	V10 H11 R16 S17 L18	V10-V14 HydrophobicContact CG1-CG2 4.36Å; V10-V14 WeakPolarHBondContact O-CG2 3.26Å; V10-V14 PolarHBondContact O-N 3.2Å; H11-V14 PolarHBondContact O-N 2.82Å; V14-R16 PolarHBondContact O-N 2.83Å; V14-S17 PolarHBondContact O-N 2.85Å; V14-L18 WeakPolarHBondContact O-CB 3.41Å; V14-L18 PolarHBondContact O-N 2.7Å
15	F	80.5	Confident	74	Confident	122 Å²	122	118 Å²	118	54%	0.535	58%	0.584	S	S	.	*	H	α-helix	trans	-64.3	-37.9	177.3	-92.6	-86.4	0	0	0	113.1	H11 L18 K19	H11-F15 AromaticContact CE1-CD2 3.45Å; H11-F15 VanDerWaalsContact CE1-CD2 3.45Å; H11-F15 WeakPolarHBondContact CE1-CD2 3.31Å; H11-F15 AromaticContact CE1-CE2 3.12Å; H11-F15 WeakPolarHBondContact CE1-CE2 3.49Å; H11-F15 AromaticContact ND1-CD2 3.62Å; H11-F15 AromaticContact ND1-CE2 3.79Å; H11-F15 AromaticContact NE2-CD2 3.96Å; H11-F15 AromaticContact NE2-CE2 3.36Å; H11-F15 WeakPolarHBondContact NE2-CE2 3.37Å; H11-F15 WeakPolarHBondContact O-CD2 3.25Å; H11-F15 PolarHBondContact O-N 2.99Å; F15-L18 PolarHBondContact O-N 3.26Å; F15-K19 WeakPolarHBondContact O-CB 3.49Å; F15-K19 PolarHBondContact O-N 3.24Å
16	R	80.3	Confident	74.5	Confident	150 Å²	150	115.2 Å²	115.2	57%	0.566	57%	0.567	S	S	*	*	H	α-helix	trans	-67.2	-38.5	174.6	-80.1	178.7	161.1	162.9	-2.7	112.4	H8 T12 L13 V14 R20	H8-R16 PolarHBondContact CD2-NH1 3.13Å; H8-R16 VanDerWaalsContact CD2-NH1 3.28Å; H8-R16 PolarHBondContact NE2-NH1 2.89Å; H8-R16 VanDerWaalsContact NE2-NH1 3.18Å; T12-R16 WeakPolarHBondContact O-CB 3.39Å; T12-R16 WeakPolarHBondContact O-CG 3.38Å; T12-R16 PolarHBondContact O-N 2.94Å; T12-R16 VanDerWaalsContact O-N 3.08Å; L13-R16 PolarHBondContact O-N 2.68Å; V14-R16 PolarHBondContact O-N 2.83Å; R16-R20 PolarHBondContact O-N 3.47Å; R16-R20 VanDerWaalsContact O-N 3.09Å
17	S	77.1	Confident	74.7	Confident	72 Å²	72	111.7 Å²	111.7	50%	0.503	56%	0.56	S	S	.	*	H	α-helix	trans	-64.6	-46.7	174.2	-173	0	0	0	0	111.2	L13 V14 K19 R20 T21	L13-S17 WeakPolarHBondContact O-CB 3.41Å; L13-S17 PolarHBondContact O-N 2.85Å; V14-S17 PolarHBondContact O-N 2.85Å; S17-K19 VanDerWaalsContact C-N 3.34Å; S17-K19 PolarHBondContact O-N 3.01Å; S17-R20 PolarHBondContact O-N 3.39Å; S17-T21 PolarHBondContact O-N 3.03Å; S17-T21 PolarHBondContact O-OG1 2.79Å; S17-T21 VanDerWaalsContact O-OG1 3.05Å
18	L	84.7	Confident	74.8	Confident	111 Å²	111	108 Å²	108	58%	0.581	55%	0.55	S	S	*	*	H	α-helix	trans	-62.8	-41.5	-179.2	-154.7	84.2	0	0	0	111.6	V14 F15 T21 H22	V14-L18 WeakPolarHBondContact O-CB 3.41Å; V14-L18 PolarHBondContact O-N 2.7Å; F15-L18 PolarHBondContact O-N 3.26Å; L18-T21 VanDerWaalsContact CA-OG1 3.31Å; L18-T21 WeakPolarHBondContact CA-OG1 3.49Å; L18-T21 PolarHBondContact O-N 3.18Å; L18-T21 PolarHBondContact O-OG1 3.03Å; L18-H22 WeakPolarHBondContact O-CB 3.45Å; L18-H22 PolarHBondContact O-N 3.04Å
19	K	84.9	Confident	74.4	Confident	140 Å²	140	109.7 Å²	109.7	61%	0.609	56%	0.558	S	S	*	*	H	α-helix	trans	-63.4	-43.2	175	-174.2	173.1	-179.6	176.7	0	111.9	F15 S17 T21 H22 D23	F15-K19 WeakPolarHBondContact O-CB 3.49Å; F15-K19 PolarHBondContact O-N 3.24Å; S17-K19 VanDerWaalsContact C-N 3.34Å; S17-K19 PolarHBondContact O-N 3.01Å; K19-T21 PolarHBondContact O-N 3.39Å; K19-H22 PolarHBondContact O-N 3.19Å; K19-D23 WeakPolarHBondContact O-CB 3.42Å; K19-D23 VanDerWaalsContact O-CG 3.26Å; K19-D23 PolarHBondContact O-N 2.76Å
20	R	79.7	Confident	73.3	Confident	203 Å²	203	109.7 Å²	109.7	77%	0.766	56%	0.562	S	S	*	*	H	α-helix	trans	-62.2	-42.7	175.6	-88.6	-176.4	179	162.1	-0.4	112.7	R16 S17 H22 D23 M24	R16-R20 PolarHBondContact O-N 3.47Å; R16-R20 VanDerWaalsContact O-N 3.09Å; S17-R20 PolarHBondContact O-N 3.39Å; R20-H22 VanDerWaalsContact C-N 3.34Å; R20-D23 PolarHBondContact O-N 2.75Å; R20-M24 WeakPolarHBondContact O-CB 3.1Å; R20-M24 PolarHBondContact O-N 3.14Å
21	T	78.6	Confident	72.7	Confident	80 Å²	80	112.9 Å²	112.9	49%	0.491	57%	0.567	S	S	.	*	H	α-helix	trans	-66.6	-37.9	177.2	42.3	0	0	0	0	111.9	S17 L18 K19 F25	S17-T21 PolarHBondContact O-N 3.03Å; S17-T21 PolarHBondContact O-OG1 2.79Å; S17-T21 VanDerWaalsContact O-OG1 3.05Å; L18-T21 VanDerWaalsContact CA-OG1 3.31Å; L18-T21 WeakPolarHBondContact CA-OG1 3.49Å; L18-T21 PolarHBondContact O-N 3.18Å; L18-T21 PolarHBondContact O-OG1 3.03Å; K19-T21 PolarHBondContact O-N 3.39Å; T21-F25 WeakPolarHBondContact O-CB 3.5Å; T21-F25 PolarHBondContact O-N 2.97Å
22	H	80.1	Confident	71.4	Confident	118 Å²	118	113.1 Å²	113.1	55%	0.546	58%	0.577	S	S	.	*	H	α-helix	trans	-64.6	-48.1	174.7	175.8	-87.2	0	0	0	111.7	L18 K19 R20 M24 F25 V26	L18-H22 WeakPolarHBondContact O-CB 3.45Å; L18-H22 PolarHBondContact O-N 3.04Å; K19-H22 PolarHBondContact O-N 3.19Å; R20-H22 VanDerWaalsContact C-N 3.34Å; H22-M24 VanDerWaalsContact C-N 3.31Å; H22-M24 PolarHBondContact O-N 3.04Å; H22-F25 PolarHBondContact O-N 3.38Å; H22-V26 WeakPolarHBondContact O-CG2 3.41Å; H22-V26 PolarHBondContact O-N 3.09Å
23	D	76.4	Confident	70.1	Confident	85 Å²	85	117.9 Å²	117.9	46%	0.455	60%	0.599	S	S	.	*	H	α-helix	trans	-64.3	-36.8	180	-68.7	-11.9	0	0	0	111.5	K19 R20 S27	K19-D23 WeakPolarHBondContact O-CB 3.42Å; K19-D23 VanDerWaalsContact O-CG 3.26Å; K19-D23 PolarHBondContact O-N 2.76Å; R20-D23 PolarHBondContact O-N 2.75Å; D23-S27 WeakPolarHBondContact O-CB 3.42Å; D23-S27 PolarHBondContact O-N 2.96Å; D23-S27 PolarHBondContact O-OG 3.5Å
24	M	71	Confident	68.9	Low	134 Å²	134	116.4 Å²	116.4	66%	0.66	60%	0.602	S	S	*	*	H	α-helix	trans	-64.1	-45.9	172.7	-172.7	-178.5	-179.6	0	0	111.5	R20 H22 V26 S27 D28	R20-M24 WeakPolarHBondContact O-CB 3.1Å; R20-M24 PolarHBondContact O-N 3.14Å; H22-M24 VanDerWaalsContact C-N 3.31Å; H22-M24 PolarHBondContact O-N 3.04Å; M24-V26 PolarHBondContact O-N 3.03Å; M24-S27 PolarHBondContact O-N 3.18Å; M24-S27 PolarHBondContact O-OG 3.44Å; M24-D28 PolarHBondContact O-N 2.7Å; M24-D28 VanDerWaalsContact O-N 3.12Å
25	F	70.4	Confident	67.7	Low	135 Å²	135	120.5 Å²	120.5	59%	0.592	62%	0.62	S	S	*	*	H	α-helix	trans	-65	-39	179.7	-159.8	-93.2	0	0	0	112.3	T21 H22 D28 H29	T21-F25 WeakPolarHBondContact O-CB 3.5Å; T21-F25 PolarHBondContact O-N 2.97Å; H22-F25 PolarHBondContact O-N 3.38Å; F25-D28 PolarHBondContact O-N 3.29Å; F25-H29 AromaticContact CD1-CD2 3.72Å; F25-H29 AromaticContact CD2-CD2 3.81Å; F25-H29 AromaticContact CE1-CD2 3.43Å; F25-H29 VanDerWaalsContact CE1-CD2 3.43Å; F25-H29 WeakPolarHBondContact CE1-CD2 3.38Å; F25-H29 AromaticContact CE2-CD2 3.53Å; F25-H29 AromaticContact CE2-NE2 3.54Å; F25-H29 AromaticContact CG-CD2 3.91Å; F25-H29 AromaticContact CZ-CD2 3.33Å; F25-H29 WeakPolarHBondContact CZ-CD2 3.26Å; F25-H29 AromaticContact CZ-NE2 3.52Å; F25-H29 WeakPolarHBondContact O-CB 3.44Å; F25-H29 PolarHBondContact O-N 2.8Å
26	V	70.2	Confident	66	Low	68 Å²	68	120.7 Å²	120.7	41%	0.412	63%	0.627	S	S	.	*	H	α-helix	trans	-65.9	-39.7	174	172.6	0	0	0	0	110.9	H22 M24 D28 A30	H22-V26 WeakPolarHBondContact O-CG2 3.41Å; H22-V26 PolarHBondContact O-N 3.09Å; M24-V26 PolarHBondContact O-N 3.03Å; V26-D28 VanDerWaalsContact C-N 3.3Å; V26-D28 PolarHBondContact O-N 3.42Å; V26-A30 HydrophobicContact CG1-CB 4.07Å; V26-A30 WeakPolarHBondContact O-CB 3.45Å; V26-A30 PolarHBondContact O-N 3.47Å
27	S	67.6	Low	64.8	Low	86 Å²	86	122.8 Å²	122.8	60%	0.601	64%	0.643	S	S	*	*	H	α-helix	trans	-65	-32.8	178	70.3	0	0	0	0	113.6	D23 M24	D23-S27 WeakPolarHBondContact O-CB 3.42Å; D23-S27 PolarHBondContact O-N 2.96Å; D23-S27 PolarHBondContact O-OG 3.5Å; M24-S27 PolarHBondContact O-N 3.18Å; M24-S27 PolarHBondContact O-OG 3.44Å
28	D	61	Low	63.6	Low	123 Å²	123	123.5 Å²	123.5	66%	0.658	64%	0.641	S	S	*	*	H	α-helix	trans	-86.6	-32.4	-176.2	-141	25.2	0	0	0	112.3	M24 F25 V26	M24-D28 PolarHBondContact O-N 2.7Å; M24-D28 VanDerWaalsContact O-N 3.12Å; F25-D28 PolarHBondContact O-N 3.29Å; V26-D28 VanDerWaalsContact C-N 3.3Å; V26-D28 PolarHBondContact O-N 3.42Å
29	H	58.1	Low	62.1	Low	117 Å²	117	128.9 Å²	128.9	54%	0.542	65%	0.654	S	S	.	*	H	α-helix	trans	-106.6	-13.9	-175.5	-71.1	-66	0	0	0	115.5	F25 K31	F25-H29 AromaticContact CD1-CD2 3.72Å; F25-H29 AromaticContact CD2-CD2 3.81Å; F25-H29 AromaticContact CE1-CD2 3.43Å; F25-H29 VanDerWaalsContact CE1-CD2 3.43Å; F25-H29 WeakPolarHBondContact CE1-CD2 3.38Å; F25-H29 AromaticContact CE2-CD2 3.53Å; F25-H29 AromaticContact CE2-NE2 3.54Å; F25-H29 AromaticContact CG-CD2 3.91Å; F25-H29 AromaticContact CZ-CD2 3.33Å; F25-H29 WeakPolarHBondContact CZ-CD2 3.26Å; F25-H29 AromaticContact CZ-NE2 3.52Å; F25-H29 WeakPolarHBondContact O-CB 3.44Å; F25-H29 PolarHBondContact O-N 2.8Å; H29-K31 VanDerWaalsContact C-N 3.35Å
30	A	52.3	Low	60.7	Low	74 Å²	74	128 Å²	128	61%	0.612	66%	0.655	S	S	*	*	S	Bend	trans	-82.4	-8.7	-178.5	0	0	0	0	0	114.4	V26	V26-A30 HydrophobicContact CG1-CB 4.07Å; V26-A30 WeakPolarHBondContact O-CB 3.45Å; V26-A30 PolarHBondContact O-N 3.47Å
31	K	53.8	Low	59.6	Low	181 Å²	181	122.1 Å²	122.1	79%	0.787	65%	0.645	S	S	*	*			trans	-108.3	82.5	168.8	-74.9	-178.1	-179.8	177.3	0	109.2	H29 I33	H29-K31 VanDerWaalsContact C-N 3.35Å; K31-I33 PolarHBondContact O-N 2.81Å
32	T	43.8	Very low	58.8	Low	128 Å²	128	124.6 Å²	124.6	79%	0.785	65%	0.651	S	S	*	*			trans	-55.4	112.1	153.8	49.1	0	0	0	0	106.6	A34	T32-A34 PolarHBondContact O-N 3.36Å
33	I	49.5	Very low	58.2	Low	159 Å²	159	126 Å²	126	82%	0.815	66%	0.655	S	S	*	*			trans	-55.5	108.8	169.2	-64	162.5	0	0	0	104.8	K31 L35	K31-I33 PolarHBondContact O-N 2.81Å; I33-L35 PolarHBondContact O-N 3Å
34	A	51.3	Low	57.8	Low	76 Å²	76	128.7 Å²	128.7	63%	0.628	67%	0.667	S	S	*	*			trans	-54.1	121.2	171.2	0	0	0	0	0	105.9	T32 D36	T32-A34 PolarHBondContact O-N 3.36Å; A34-D36 PolarHBondContact O-N 2.85Å
35	L	50	Low	57.7	Low	169 Å²	169	130 Å²	130	89%	0.885	67%	0.669	S	S	*	*			trans	-63.7	88.2	165.7	-79.8	162.2	0	0	0	105.4	I33 E37	I33-L35 PolarHBondContact O-N 3Å; L35-E37 PolarHBondContact O-N 3.34Å
36	D	45.4	Very low	57.5	Low	125 Å²	125	128.3 Å²	128.3	67%	0.668	66%	0.664	S	S	*	*			trans	-56.4	113.3	165	-105.2	-14.1	0	0	0	106	A34 D38	A34-D36 PolarHBondContact O-N 2.85Å; D36-D38 HydrophobicContact CB-CB 4.29Å; D36-D38 PolarHBondContact O-N 3.13Å
37	E	54.2	Low	57.7	Low	194 Å²	194	126.9 Å²	126.9	91%	0.907	66%	0.663	S	S	*	*			trans	-65	29.6	166.1	-75.8	-167.2	140.5	0	0	111.7	L35 R39	L35-E37 PolarHBondContact O-N 3.34Å; E37-R39 PolarHBondContact O-N 3.25Å
38	D	53.1	Low	58	Low	88 Å²	88	127 Å²	127	47%	0.471	66%	0.66	S	S	.	*			trans	-84.4	96.5	-179.8	-89.6	-0.3	0	0	0	109.4	D36 L40 S41	D36-D38 HydrophobicContact CB-CB 4.29Å; D36-D38 PolarHBondContact O-N 3.13Å; D38-L40 HydrophobicContact CB-CB 4.45Å; D38-L40 PolarHBondContact O-N 2.99Å; D38-S41 PolarHBondContact O-N 3.44Å; D38-S41 PolarHBondContact O-OG 2.9Å
39	R	52.9	Low	58.4	Low	224 Å²	224	126.8 Å²	126.8	85%	0.845	65%	0.653	S	S	*	*	H	α-helix	trans	-27.1	-26.7	157.6	-145.2	173.4	-176.8	-168.1	0.3	114.2	E37 K43	E37-R39 PolarHBondContact O-N 3.25Å; R39-K43 VanDerWaalsContact O-CB 3.24Å; R39-K43 WeakPolarHBondContact O-CB 3.32Å; R39-K43 PolarHBondContact O-N 3.22Å
40	L	55.4	Low	58.9	Low	122 Å²	122	125.5 Å²	125.5	64%	0.639	65%	0.65	S	S	*	*	H	α-helix	trans	-62.2	-44.2	174	-77.5	156	0	0	0	114.4	D38 H42 K43 M44	D38-L40 HydrophobicContact CB-CB 4.45Å; D38-L40 PolarHBondContact O-N 2.99Å; L40-H42 VanDerWaalsContact C-N 3.34Å; L40-H42 PolarHBondContact O-N 3.06Å; L40-K43 PolarHBondContact O-N 3.04Å; L40-M44 VanDerWaalsContact O-CB 3.31Å; L40-M44 WeakPolarHBondContact O-CB 3.43Å; L40-M44 PolarHBondContact O-N 2.8Å
41	S	57.1	Low	59.8	Low	79 Å²	79	129.8 Å²	129.8	55%	0.552	66%	0.655	S	S	*	*	H	α-helix	trans	-69	-36	-178.4	73.2	0	0	0	0	111.9	D38 K45	D38-S41 PolarHBondContact O-N 3.44Å; D38-S41 PolarHBondContact O-OG 2.9Å; S41-K45 PolarHBondContact O-N 2.51Å
42	H	61.4	Low	60.4	Low	131 Å²	131	126 Å²	126	61%	0.606	65%	0.647	S	S	*	*	H	α-helix	trans	-73.3	-38.3	176.5	-141.9	-76.4	0	0	0	111.5	L40 K45 M46	L40-H42 VanDerWaalsContact C-N 3.34Å; L40-H42 PolarHBondContact O-N 3.06Å; H42-K45 PolarHBondContact O-N 3.32Å; H42-M46 WeakPolarHBondContact O-CB 3.09Å; H42-M46 WeakPolarHBondContact O-CG 3.4Å; H42-M46 PolarHBondContact O-N 2.83Å
43	K	66.5	Low	61.4	Low	147 Å²	147	125.1 Å²	125.1	64%	0.639	63%	0.634	S	S	*	*	H	α-helix	trans	-64.8	-39.8	173.3	-160.8	175.1	-175	-176.5	0	111.2	R39 L40 M46 G47	R39-K43 VanDerWaalsContact O-CB 3.24Å; R39-K43 WeakPolarHBondContact O-CB 3.32Å; R39-K43 PolarHBondContact O-N 3.22Å; L40-K43 PolarHBondContact O-N 3.04Å; K43-M46 PolarHBondContact O-N 3.31Å; K43-G47 PolarHBondContact O-N 3.5Å
44	M	68.2	Low	61.7	Low	142 Å²	142	123.9 Å²	123.9	70%	0.7	62%	0.62	S	S	*	*	H	α-helix	trans	-63.6	-46.7	174	-167	86	156	0	0	111.6	L40 M46 G47 V48	L40-M44 VanDerWaalsContact O-CB 3.31Å; L40-M44 WeakPolarHBondContact O-CB 3.43Å; L40-M44 PolarHBondContact O-N 2.8Å; M44-M46 PolarHBondContact O-N 2.89Å; M44-G47 PolarHBondContact O-N 2.72Å; M44-V48 WeakPolarHBondContact O-CG2 3.43Å; M44-V48 PolarHBondContact O-N 3.03Å
45	K	70.2	Confident	62.2	Low	161 Å²	161	122.5 Å²	122.5	70%	0.7	61%	0.608	S	S	*	*	H	α-helix	trans	-60.1	-45.3	175.1	-94.9	-178.8	175.4	173.5	0	112.4	S41 H42 K49	S41-K45 PolarHBondContact O-N 2.51Å; H42-K45 PolarHBondContact O-N 3.32Å; K45-K49 WeakPolarHBondContact O-CB 3.4Å; K45-K49 PolarHBondContact O-N 3.35Å; K45-K49 VanDerWaalsContact O-N 3.1Å
46	M	66	Low	62.7	Low	100 Å²	100	119.2 Å²	119.2	49%	0.493	60%	0.597	S	S	.	*	H	α-helix	trans	-64.8	-41.9	176.9	-78.9	-116.1	71.6	0	0	112	H42 K43 M44 K49 L50	H42-M46 WeakPolarHBondContact O-CB 3.09Å; H42-M46 WeakPolarHBondContact O-CG 3.4Å; H42-M46 PolarHBondContact O-N 2.83Å; K43-M46 PolarHBondContact O-N 3.31Å; M44-M46 PolarHBondContact O-N 2.89Å; M46-K49 PolarHBondContact O-N 2.98Å; M46-L50 WeakPolarHBondContact O-CB 3.32Å; M46-L50 PolarHBondContact O-N 2.85Å
47	G	73.9	Confident	63.2	Low	38 Å²	38	117.6 Å²	117.6	39%	0.392	59%	0.592	S	S	.	*	H	α-helix	trans	-63.5	-41.4	177.8	0	0	0	0	0	113	K43 M44 K49 K51	K43-G47 PolarHBondContact O-N 3.5Å; M44-G47 PolarHBondContact O-N 2.72Å; G47-K49 VanDerWaalsContact C-N 3.33Å; G47-K49 PolarHBondContact O-N 3.06Å; G47-K51 WeakPolarHBondContact O-CB 3.22Å; G47-K51 PolarHBondContact O-N 3.49Å
48	V	73.4	Confident	63.3	Low	89 Å²	89	115 Å²	115	54%	0.539	58%	0.584	S	S	.	*	H	α-helix	trans	-63.5	-41.3	174.6	171.8	0	0	0	0	110.9	M44 K51 T52	M44-V48 WeakPolarHBondContact O-CG2 3.43Å; M44-V48 PolarHBondContact O-N 3.03Å; V48-K51 PolarHBondContact O-N 3.06Å; V48-T52 PolarHBondContact O-N 3.07Å; V48-T52 PolarHBondContact O-OG1 2.84Å
49	K	70.8	Confident	63.2	Low	118 Å²	118	119.4 Å²	119.4	51%	0.513	60%	0.601	S	S	.	*	H	α-helix	trans	-68.9	-43.5	-179.5	-151.5	176.5	-176.7	-171.6	0	112.5	K45 M46 G47 K51 T52 E53	K45-K49 WeakPolarHBondContact O-CB 3.4Å; K45-K49 PolarHBondContact O-N 3.35Å; K45-K49 VanDerWaalsContact O-N 3.1Å; M46-K49 PolarHBondContact O-N 2.98Å; G47-K49 VanDerWaalsContact C-N 3.33Å; G47-K49 PolarHBondContact O-N 3.06Å; K49-K51 VanDerWaalsContact C-N 3.34Å; K49-K51 PolarHBondContact O-N 3.38Å; K49-T52 WeakPolarHBondContact CA-OG1 3.28Å; K49-T52 PolarHBondContact O-N 2.86Å; K49-T52 PolarHBondContact O-OG1 2.86Å; K49-T52 VanDerWaalsContact O-OG1 3.14Å; K49-E53 WeakPolarHBondContact CE-OE1 3.38Å; K49-E53 WeakPolarHBondContact O-CB 3.22Å; K49-E53 PolarHBondContact O-N 2.84Å
50	L	67.8	Low	62.9	Low	91 Å²	91	116.1 Å²	116.1	48%	0.476	60%	0.597	S	S	.	*	H	α-helix	trans	-59.5	-43.9	172.6	-89.4	156.9	0	0	0	111.7	M46 T52 Y54	M46-L50 WeakPolarHBondContact O-CB 3.32Å; M46-L50 PolarHBondContact O-N 2.85Å; L50-T52 PolarHBondContact O-N 2.86Å; L50-Y54 HydrophobicContact CD2-CD2 3.74Å; L50-Y54 HydrophobicContact CD2-CE2 3.92Å; L50-Y54 WeakPolarHBondContact O-CB 3.26Å; L50-Y54 PolarHBondContact O-N 2.78Å
51	K	71.6	Confident	62.2	Low	164 Å²	164	115.8 Å²	115.8	71%	0.713	60%	0.602	S	S	*	*	H	α-helix	trans	-68.2	-32.9	178.3	-166	174.4	-177.2	177.6	0	112.6	G47 V48 K49 A55	G47-K51 WeakPolarHBondContact O-CB 3.22Å; G47-K51 PolarHBondContact O-N 3.49Å; V48-K51 PolarHBondContact O-N 3.06Å; K49-K51 VanDerWaalsContact C-N 3.34Å; K49-K51 PolarHBondContact O-N 3.38Å; K51-A55 WeakPolarHBondContact O-CB 3.44Å; K51-A55 PolarHBondContact O-N 2.79Å
52	T	65	Low	61.9	Low	100 Å²	100	118.7 Å²	118.7	61%	0.613	62%	0.616	S	S	*	*	H	α-helix	trans	-77	-37.4	177.7	25.6	0	0	0	0	112.7	V48 K49 L50	V48-T52 PolarHBondContact O-N 3.07Å; V48-T52 PolarHBondContact O-OG1 2.84Å; K49-T52 WeakPolarHBondContact CA-OG1 3.28Å; K49-T52 PolarHBondContact O-N 2.86Å; K49-T52 PolarHBondContact O-OG1 2.86Å; K49-T52 VanDerWaalsContact O-OG1 3.14Å; L50-T52 PolarHBondContact O-N 2.86Å
53	E	66.4	Low	60.9	Low	110 Å²	110	120 Å²	120	51%	0.514	63%	0.627	S	S	.	*	H	α-helix	trans	-84.7	-36.1	-177.4	-72.5	175	-175.9	0	0	113.1	K49	K49-E53 WeakPolarHBondContact CE-OE1 3.38Å; K49-E53 WeakPolarHBondContact O-CB 3.22Å; K49-E53 PolarHBondContact O-N 2.84Å
54	Y	55.6	Low	60	Low	133 Å²	133	123 Å²	123	52%	0.522	64%	0.64	S	S	.	*	H	α-helix	trans	-110.7	-12.2	-169.8	-63.2	-90.7	0	0	0	115.2	L50 P56 V57 L58	L50-Y54 HydrophobicContact CD2-CD2 3.74Å; L50-Y54 HydrophobicContact CD2-CE2 3.92Å; L50-Y54 WeakPolarHBondContact O-CB 3.26Å; L50-Y54 PolarHBondContact O-N 2.78Å; Y54-P56 VanDerWaalsContact C-N 3.29Å; Y54-V57 PolarHBondContact O-N 2.95Å; Y54-L58 PolarHBondContact O-N 2.98Å
55	A	61.8	Low	58.5	Low	47 Å²	47	124.9 Å²	124.9	39%	0.388	65%	0.647	S	S	.	*	T	Hydrogen-bonded Turn	trans	-56.3	-33.3	173.2	0	0	0	0	0	114.8	K51 V57	K51-A55 WeakPolarHBondContact O-CB 3.44Å; K51-A55 PolarHBondContact O-N 2.79Å; A55-V57 PolarHBondContact O-N 2.79Å
56	P	61.2	Low	56.8	Low	101 Å²	101	120.9 Å²	120.9	66%	0.656	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	-21.3	175.3	-18.1	31.4	0	0	0	113.7	Y54	Y54-P56 VanDerWaalsContact C-N 3.29Å
57	V	54.2	Low	55.4	Low	90 Å²	90	127.9 Å²	127.9	55%	0.545	67%	0.672	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.1	-22.1	-174.4	-174.8	0	0	0	0	111.8	Y54 A55 H59 M60	Y54-V57 PolarHBondContact O-N 2.95Å; A55-V57 PolarHBondContact O-N 2.79Å; V57-H59 PolarHBondContact O-N 3.41Å; V57-M60 PolarHBondContact O-N 3.17Å
58	L	57.1	Low	53.6	Low	141 Å²	141	133.4 Å²	133.4	74%	0.738	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.5	-17.7	-178.2	-98.6	150.4	0	0	0	115	Y54	Y54-L58 PolarHBondContact O-N 2.98Å
59	H	51	Low	51.9	Low	179 Å²	179	141 Å²	141	83%	0.829	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.3	3.3	178.3	-99.2	-71.6	0	0	0	114.4	V57	V57-H59 PolarHBondContact O-N 3.41Å
60	M	47.3	Very low	50	Low	155 Å²	155	141.7 Å²	141.7	76%	0.764	73%	0.726	S	S	*	*	S	Bend	trans	-74.7	126.1	173.7	-104.9	-173.1	172.8	0	0	110.6	V57 V62	V57-M60 PolarHBondContact O-N 3.17Å; M60-V62 PolarHBondContact O-N 3.37Å
61	P	40.7	Very low	48.1	Very low	116 Å²	116	142.9 Å²	142.9	75%	0.753	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-66.3	128.8	172.6	-9.4	24.2	0	0	0	109.2	L63	P61-L63 PolarHBondContact O-N 2.91Å
62	V	50.7	Low	46.2	Very low	139 Å²	139	143 Å²	143	84%	0.842	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-63.3	118.5	170.7	177.8	0	0	0	0	108.2	M60 K64	M60-V62 PolarHBondContact O-N 3.37Å; V62-K64 PolarHBondContact O-N 2.88Å
63	L	38.8	Very low	44.4	Very low	158 Å²	158	146 Å²	146	83%	0.827	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-60.3	117.4	172.2	-75.1	168	0	0	0	109	P61 E65	P61-L63 PolarHBondContact O-N 2.91Å; L63-E65 PolarHBondContact O-N 3.12Å
64	K	49.1	Very low	42.6	Very low	212 Å²	212	146 Å²	146	92%	0.922	77%	0.769	S	S	*	*			trans	-88	80.7	177.3	-154.7	-178	-167.8	179.7	0	108.1	V62	V62-K64 PolarHBondContact O-N 2.88Å
65	E	35.2	Very low	41.3	Very low	180 Å²	180	147 Å²	147	84%	0.841	79%	0.788	S	S	*	*			trans	-128.8	131	170.3	-77.1	-171.1	161.6	0	0	110.7	L63	L63-E65 PolarHBondContact O-N 3.12Å
66	G	35.6	Very low	39.6	Very low	77 Å²	77	147.9 Å²	147.9	79%	0.794	80%	0.802	S	S	*	*			trans	122.1	24.9	170.1	0	0	0	0	0	117.1	D68	G66-D68 PolarHBondContact O-N 3.13Å; G66-D68 VanDerWaalsContact O-N 3.11Å
67	R	36.3	Very low	38	Very low	248 Å²	248	152.6 Å²	152.6	94%	0.936	82%	0.815	S	S	*	*			trans	-81.6	70.6	163.4	-160.4	-174.6	-156.5	-177.4	4.7	108.8
68	D	36.8	Very low	36.6	Very low	154 Å²	154	156.9 Å²	156.9	82%	0.824	83%	0.829	S	S	*	*			trans	-160.6	76.1	167.4	-93.1	-28.3	0	0	0	110.2	G66	G66-D68 PolarHBondContact O-N 3.13Å; G66-D68 VanDerWaalsContact O-N 3.11Å
69	R	36.8	Very low	35.2	Very low	247 Å²	247	158.6 Å²	158.6	93%	0.932	84%	0.838	S	S	*	*	S	Bend	trans	176.7	102.9	147.8	-98.3	164.9	-169.7	-155.2	4	107.7
70	V	30.7	Very low	34	Very low	134 Å²	134	158.8 Å²	158.8	81%	0.812	84%	0.839	S	S	*	*			trans	139	67.6	158.7	-175.9	0	0	0	0	107	Q72	V70-Q72 PolarHBondContact O-N 3.01Å
71	S	29.1	Very low	33.5	Very low	115 Å²	115	157.2 Å²	157.2	80%	0.804	84%	0.84	S	S	*	*			trans	-72.8	100.8	144	42.3	0	0	0	0	106.6
72	Q	31.1	Very low	32.8	Very low	167 Å²	167	155.2 Å²	155.2	78%	0.78	84%	0.841	S	S	*	*			trans	177.6	96.1	145.7	-99.2	170.2	20.6	0	0	108.8	V70	V70-Q72 PolarHBondContact O-N 3.01Å
73	L	27.1	Very low	31.8	Very low	163 Å²	163	159.4 Å²	159.4	85%	0.853	84%	0.843	S	S	*	*	S	Bend		153.8	132.8	127.5	-79.4	154.8	0	0	0	111
74	S	28.3	Very low	31.3	Very low	111 Å²	111	156.7 Å²	156.7	78%	0.776	84%	0.843	S	S	*	*			trans	63.5	92.3	161.5	53.7	0	0	0	0	120
75	V	27.7	Very low	30.4	Very low	153 Å²	153	154.9 Å²	154.9	93%	0.927	84%	0.838	S	S	*	*				26.7	124.8	115.6	-174	0	0	0	0	118
76	G	26.9	Very low	30.3	Very low	66 Å²	66	152.6 Å²	152.6	68%	0.68	84%	0.839	S	S	*	*			trans	137.1	103.8	140.1	0	0	0	0	0	117.6
77	Q	27.8	Very low	30.4	Very low	199 Å²	199	152.3 Å²	152.3	93%	0.93	84%	0.836	S	S	*	*			trans	90.5	118.3	136.2	-143.5	152.6	1.4	0	0	120.1
78	E	25.6	Very low	30.1	Very low	180 Å²	180	148.5 Å²	148.5	84%	0.841	83%	0.834	S	S	*	*			trans	-77.2	149.5	170.7	-62	178.7	144.9	0	0	112.1
79	L	27.1	Very low	29.9	Very low	178 Å²	178	149.9 Å²	149.9	93%	0.932	84%	0.836	S	S	*	*			trans	174.2	133.8	133.2	-90	154	0	0	0	111.8
80	H	25.1	Very low	29.8	Very low	182 Å²	182	141.2 Å²	141.2	84%	0.843	82%	0.816	S	S	*	*			trans	-88.9	-176.7	169.3	-82.1	-72.5	0	0	0	111.2
81	P	37.4	Very low	29.7	Very low	122 Å²	122	144.4 Å²	144.4	79%	0.792	82%	0.823	S	S	*	*				-125.4	154.3	-57.9	35.7	-19.9	0	0	0	111.5
82	G	25.6	Very low	30	Very low	75 Å²	75	148.8 Å²	148.8	77%	0.773	82%	0.823	S	S	*	*			trans	-144.7	136.6	-178.2	0	0	0	0	0	114
83	Y	29.3	Very low	29.9	Very low	227 Å²	227	148.4 Å²	148.4	89%	0.89	83%	0.825	S	S	*	*			trans	-60.9	148.2	-169.7	-78.8	-99.3	0	0	0	115.7
84	A	28.3	Very low	30.1	Very low	100 Å²	100	148.4 Å²	148.4	83%	0.826	83%	0.825	S	S	*	*			trans	-71.2	135.1	174.5	0	0	0	0	0	112.6
85	H	30.3	Very low	30.3	Very low	174 Å²	174	148.1 Å²	148.1	81%	0.806	82%	0.818	S	S	*	*			trans	-114.6	139.8	159.5	-76.2	-64	0	0	0	109.9
86	P	33.6	Very low	30.5	Very low	132 Å²	132	144.6 Å²	144.6	86%	0.857	81%	0.813	S	S	*	*	S	Bend	trans	-87.3	112.7	-173.2	32.9	-29.1	0	0	0	110.1
87	G	37.8	Very low	31.1	Very low	71 Å²	71	146.8 Å²	146.8	73%	0.732	81%	0.813	S	S	*	*			trans	-173.2	-5	-178.3	0	0	0	0	0	119.1
88	D	30.4	Very low	31.3	Very low	168 Å²	168	146.5 Å²	146.5	90%	0.898	81%	0.811	S	S	*	*			trans	-123	113.9	179.8	-81.7	-30.9	0	0	0	111.9	A90	D88-A90 PolarHBondContact O-N 3.16Å
89	E	31.8	Very low	31.7	Very low	184 Å²	184	142.7 Å²	142.7	86%	0.86	81%	0.811	S	S	*	*			trans	-72.7	101.8	165.6	-77.4	-171	151.6	0	0	108.8
90	A	33.9	Very low	31.9	Very low	64 Å²	64	144.7 Å²	144.7	53%	0.529	81%	0.808	S	S	.	*			trans	-84.3	119.9	169.1	0	0	0	0	0	110.6	D88 Y92	D88-A90 PolarHBondContact O-N 3.16Å; A90-Y92 HydrophobicContact CB-CE2 3.92Å; A90-Y92 WeakPolarHBondContact O-CD2 3.3Å; A90-Y92 WeakPolarHBondContact O-CE2 3.15Å; A90-Y92 PolarHBondContact O-N 3.3Å
91	E	29.6	Very low	32.3	Very low	202 Å²	202	142 Å²	142	94%	0.944	81%	0.806	S	S	*	*			trans	-60.7	113.6	166.8	-109.3	179.8	162.2	0	0	110
92	Y	34.4	Very low	32.4	Very low	207 Å²	207	141.9 Å²	141.9	81%	0.812	81%	0.809	S	S	*	*			trans	-97.8	106.5	173.1	-71.7	-81.1	0	0	0	110.5	A90 I94	A90-Y92 HydrophobicContact CB-CE2 3.92Å; A90-Y92 WeakPolarHBondContact O-CD2 3.3Å; A90-Y92 WeakPolarHBondContact O-CE2 3.15Å; A90-Y92 PolarHBondContact O-N 3.3Å; Y92-I94 PolarHBondContact O-N 3.26Å
93	L	29.8	Very low	33	Very low	158 Å²	158	141.3 Å²	141.3	83%	0.827	80%	0.802	S	S	*	*			trans	-69.8	110	168.6	-164.1	81	0	0	0	109.1	T95	L93-T95 HydrophobicContact CD2-CG2 4.42Å; L93-T95 PolarHBondContact O-N 3.27Å
94	I	31.9	Very low	33.3	Very low	164 Å²	164	137.4 Å²	137.4	84%	0.841	81%	0.805	S	S	*	*			trans	-80.5	98.4	176.1	-59.6	173.5	0	0	0	108.7	Y92	Y92-I94 PolarHBondContact O-N 3.26Å
95	T	32.9	Very low	33.7	Very low	104 Å²	104	135.9 Å²	135.9	64%	0.638	80%	0.799	S	S	*	*			trans	-79.8	113.3	166	47.4	0	0	0	0	109.5	L93 T97	L93-T95 HydrophobicContact CD2-CG2 4.42Å; L93-T95 PolarHBondContact O-N 3.27Å; T95-T97 PolarHBondContact O-N 2.52Å
96	G	31.4	Very low	34.4	Very low	79 Å²	79	134.5 Å²	134.5	81%	0.814	80%	0.802	S	S	*	*			trans	-70.8	112.2	176.6	0	0	0	0	0	111.7
97	T	38.7	Very low	34.5	Very low	113 Å²	113	132.4 Å²	132.4	69%	0.693	80%	0.796	S	S	*	*			trans	-116.4	82.7	173.2	52	0	0	0	0	110.1	T95	T95-T97 PolarHBondContact O-N 2.52Å
98	H	31.4	Very low	34.4	Very low	192 Å²	192	137.2 Å²	137.2	89%	0.889	80%	0.804	S	S	*	*			trans	-155.1	124.6	152.6	-89.6	-66.8	0	0	0	109.8
99	A	34.4	Very low	34.9	Very low	101 Å²	101	135.1 Å²	135.1	84%	0.835	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-78.8	127	177.9	0	0	0	0	0	110.8
100	Y	32.3	Very low	35.3	Very low	219 Å²	219	131.2 Å²	131.2	86%	0.859	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-76.6	135.8	167.6	-99.2	-94.5	0	0	0	110.1	S102	Y100-S102 PolarHBondContact O-N 2.78Å
101	P	33.4	Very low	35.5	Very low	125 Å²	125	135.6 Å²	135.6	81%	0.812	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-71.6	125.6	173.5	26.9	-29.1	0	0	0	110.4
102	S	39.6	Very low	35.9	Very low	121 Å²	121	131.8 Å²	131.8	85%	0.846	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-77.3	121.7	-177	-40.5	0	0	0	0	111.2	Y100	Y100-S102 PolarHBondContact O-N 2.78Å
103	G	37.6	Very low	36	Very low	62 Å²	62	131.4 Å²	131.4	64%	0.639	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-70.4	156.6	160.6	0	0	0	0	0	111	G105	G103-G105 PolarHBondContact O-N 3.49Å
104	P	36.4	Very low	36.1	Very low	146 Å²	146	133.2 Å²	133.2	95%	0.948	81%	0.811	S	S	*	*	S	Bend	trans	-77.4	113.2	-173.8	29.8	-31.5	0	0	0	111.1
105	G	37	Very low	36	Very low	67 Å²	67	134 Å²	134	69%	0.691	81%	0.811	S	S	*	*	S	Bend	trans	159.7	99.3	167.7	0	0	0	0	0	114.9	G103	G103-G105 PolarHBondContact O-N 3.49Å
106	V	43.2	Very low	36.2	Very low	145 Å²	145	139.8 Å²	139.8	88%	0.879	82%	0.821	S	S	*	*			trans	61.4	114.6	160.9	-167.7	0	0	0	0	117.3
107	A	37.3	Very low	36.5	Very low	89 Å²	89	142.9 Å²	142.9	74%	0.736	82%	0.819	S	S	*	*			trans	-69.9	133.4	174.6	0	0	0	0	0	111.8	T109	A107-T109 PolarHBondContact O-N 3.02Å
108	L	35.1	Very low	36.8	Very low	171 Å²	171	143.6 Å²	143.6	90%	0.895	83%	0.826	S	S	*	*			trans	-76.5	108.3	172.8	-71.1	160.8	0	0	0	109.6
109	T	41.3	Very low	37.5	Very low	124 Å²	124	139.2 Å²	139.2	76%	0.761	82%	0.816	S	S	*	*			trans	-82.5	157.2	167.4	12.1	0	0	0	0	111.7	A107 D111	A107-T109 PolarHBondContact O-N 3.02Å; T109-D111 PolarHBondContact O-N 3.39Å
110	A	39.2	Very low	38.1	Very low	103 Å²	103	142.8 Å²	142.8	85%	0.851	82%	0.816	S	S	*	*	S	Bend	trans	-71.1	38.1	-161.3	0	0	0	0	0	117.8
111	D	39.4	Very low	38.8	Very low	155 Å²	155	135 Å²	135	83%	0.829	80%	0.802	S	S	*	*			trans	-122.7	51.8	179.7	-75.5	-33.5	0	0	0	113.4	T109	T109-D111 PolarHBondContact O-N 3.39Å
112	T	37.6	Very low	39.5	Very low	122 Å²	122	130.7 Å²	130.7	75%	0.748	78%	0.781	S	S	*	*			trans	-140.7	68.2	164.9	2.9	0	0	0	0	111.1	M114	T112-M114 PolarHBondContact O-N 2.78Å
113	K	35.9	Very low	39.8	Very low	200 Å²	200	130.1 Å²	130.1	87%	0.87	77%	0.772	S	S	*	*			trans	-68.5	117.6	154.8	-81.9	-178.6	177	174.8	0	107.7	H115	K113-H115 PolarHBondContact O-N 3.06Å; K113-H115 VanDerWaalsContact O-N 3.09Å
114	M	31.6	Very low	40.2	Very low	195 Å²	195	132.8 Å²	132.8	96%	0.961	77%	0.77	S	S	*	*			trans	-56	112.2	171.7	-73.8	-153.9	-82.3	0	0	110	T112	T112-M114 PolarHBondContact O-N 2.78Å
115	H	30.6	Very low	40.6	Very low	182 Å²	182	130 Å²	130	84%	0.843	75%	0.754	S	S	*	*			trans	-88.8	125.4	172	-129.2	-80.6	0	0	0	109.7	K113	K113-H115 PolarHBondContact O-N 3.06Å; K113-H115 VanDerWaalsContact O-N 3.09Å
116	R	36.6	Very low	40.9	Very low	224 Å²	224	133.9 Å²	133.9	85%	0.845	76%	0.756	S	S	*	*			trans	-70	129.8	169.8	-93.8	177.5	165.2	174.6	-5	109.5
117	N	36.9	Very low	41.1	Very low	144 Å²	144	130.4 Å²	130.4	77%	0.77	74%	0.743	S	S	*	*			trans	73.1	119.5	165.2	-55.4	-7.1	0	0	0	116.9
118	P	45.6	Very low	41.6	Very low	129 Å²	129	133.4 Å²	133.4	84%	0.838	75%	0.745	S	S	*	*			trans	-84.2	131.2	172.5	31.7	-29.1	0	0	0	111.2
119	S	47	Very low	42.2	Very low	99 Å²	99	129.1 Å²	129.1	69%	0.692	73%	0.734	S	S	*	*			trans	-79.1	157.3	168.1	53	0	0	0	0	111.1	G121 G122	S119-G121 PolarHBondContact O-N 2.47Å; S119-G122 PolarHBondContact O-N 3.15Å
120	E	47	Very low	42	Very low	177 Å²	177	129.8 Å²	129.8	83%	0.827	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.8	-10.9	-172.9	-70.6	-179.4	142	0	0	115.9
121	G	47.6	Very low	42.1	Very low	54 Å²	54	130.2 Å²	130.2	56%	0.557	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	-21.1	173.4	0	0	0	0	0	115.2	S119	S119-G121 PolarHBondContact O-N 2.47Å
122	G	47.3	Very low	42.4	Very low	36 Å²	36	128.5 Å²	128.5	37%	0.371	72%	0.724	S	S	.	*	H	α-helix	trans	-78.6	-19.1	-179.7	0	0	0	0	0	114.5	S119	S119-G122 PolarHBondContact O-N 3.15Å
123	V	45.8	Very low	42.5	Very low	108 Å²	108	126.7 Å²	126.7	66%	0.655	72%	0.716	S	S	*	*	H	α-helix	trans	-77.2	-27.2	-179.7	-171.3	0	0	0	0	111	A127	V123-A127 PolarHBondContact O-N 2.77Å
124	I	45.5	Very low	43	Very low	119 Å²	119	124.9 Å²	124.9	61%	0.61	71%	0.711	S	S	*	*	H	α-helix	trans	-80.4	-30	-178.3	-61.2	173.7	0	0	0	111.6
125	S	44.7	Very low	43.7	Very low	86 Å²	86	121.4 Å²	121.4	60%	0.601	70%	0.7	S	S	*	*	H	α-helix	trans	-81.9	-27	177.7	89.4	0	0	0	0	113.5
126	M	44	Very low	44.1	Very low	150 Å²	150	122.8 Å²	122.8	74%	0.739	70%	0.698	S	S	*	*	H	α-helix	trans	-75.4	-27.5	174	-112.7	-179.1	-179.8	0	0	113.1	L128 A129	M126-L128 VanDerWaalsContact C-N 3.26Å; M126-L128 PolarHBondContact O-N 3.24Å; M126-A129 PolarHBondContact O-N 2.9Å
127	A	46.7	Very low	44.3	Very low	72 Å²	72	119.4 Å²	119.4	60%	0.595	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	-18.7	176.8	0	0	0	0	0	113.7	V123	V123-A127 PolarHBondContact O-N 2.77Å
128	L	48.5	Very low	44.5	Very low	151 Å²	151	120.7 Å²	120.7	79%	0.791	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.9	-6.6	179.6	-78.8	161	0	0	0	113.9	M126	M126-L128 VanDerWaalsContact C-N 3.26Å; M126-L128 PolarHBondContact O-N 3.24Å
129	A	46.9	Very low	44.1	Very low	81 Å²	81	118.4 Å²	118.4	67%	0.669	69%	0.686	S	S	*	*	S	Bend	trans	-105.8	8.7	-175.9	0	0	0	0	0	114.3	M126	M126-A129 PolarHBondContact O-N 2.9Å
130	L	36.8	Very low	43.6	Very low	138 Å²	138	118.2 Å²	118.2	72%	0.723	68%	0.684	S	S	*	*	S	Bend	trans	-93.5	131.5	175.7	-70.7	169	0	0	0	110.8
131	P	41.7	Very low	43.3	Very low	112 Å²	112	120.8 Å²	120.8	73%	0.727	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-66.1	144.7	172.8	26	-30.7	0	0	0	110.6
132	P	46	Very low	42.7	Very low	120 Å²	120	124.5 Å²	124.5	78%	0.779	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-67.9	136.5	-175.1	26.7	-32.2	0	0	0	111.5
133	S	40.7	Very low	41.9	Very low	83 Å²	83	127 Å²	127	58%	0.58	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-71.1	141.3	177.6	53.5	0	0	0	0	112.1	V135 R136	S133-V135 PolarHBondContact O-N 3.06Å; S133-R136 PolarHBondContact O-N 3Å
134	Q	45	Very low	41.2	Very low	163 Å²	163	126.9 Å²	126.9	76%	0.762	73%	0.726	S	S	*	*	G	3₁₀ helix	trans	-56.1	-15.5	-179.4	-78.7	173.9	-22.8	0	0	114.6	R136 Q137	Q134-R136 PolarHBondContact O-N 2.8Å; Q134-Q137 PolarHBondContact O-N 2.97Å
135	V	46	Very low	40.6	Very low	121 Å²	121	125.9 Å²	125.9	73%	0.733	73%	0.729	S	S	*	*	G	3₁₀ helix	trans	-69.1	-14.2	176.4	-173.4	0	0	0	0	112.5	S133	S133-V135 PolarHBondContact O-N 3.06Å
136	R	39.7	Very low	40.2	Very low	211 Å²	211	129.4 Å²	129.4	80%	0.796	75%	0.747	S	S	*	*	G	3₁₀ helix	trans	-96	-6.1	176.1	-138.5	176	-174.2	-178.5	1.2	114.3	S133 Q134	S133-R136 PolarHBondContact O-N 3Å; Q134-R136 PolarHBondContact O-N 2.8Å
137	Q	41.4	Very low	39.7	Very low	154 Å²	154	126.1 Å²	126.1	72%	0.72	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.4	-15.1	174.7	-83.9	-179.6	-16.9	0	0	113.6	Q134	Q134-Q137 PolarHBondContact O-N 2.97Å
138	E	39.9	Very low	39.2	Very low	170 Å²	170	131.8 Å²	131.8	79%	0.794	76%	0.758	S	S	*	*	S	Bend	trans	-90.9	-8.1	175.7	-70	-176.6	156.5	0	0	113.6	S140	E138-S140 VanDerWaalsContact C-N 3.34Å; E138-S140 PolarHBondContact O-N 3.41Å
139	A	38.5	Very low	38.6	Very low	82 Å²	82	132.3 Å²	132.3	68%	0.678	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	3.6	178.5	0	0	0	0	0	114.5
140	S	36.2	Very low	37.9	Very low	94 Å²	94	137.2 Å²	137.2	66%	0.657	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.2	11.6	178	64.6	0	0	0	0	114.6	E138	E138-S140 VanDerWaalsContact C-N 3.34Å; E138-S140 PolarHBondContact O-N 3.41Å
141	R	40.4	Very low	37.9	Very low	232 Å²	232	141.9 Å²	141.9	88%	0.875	78%	0.776	S	S	*	*			trans	-109.3	71.7	166.9	-78.1	-174.6	171.8	179.3	-1.7	110.5	A143	R141-A143 PolarHBondContact O-N 2.87Å
142	T	34.2	Very low	37.4	Very low	132 Å²	132	145.8 Å²	145.8	81%	0.81	78%	0.784	S	S	*	*			trans	-74.1	117.2	168.5	-13.5	0	0	0	0	109.7
143	A	30.9	Very low	36.5	Very low	87 Å²	87	145.1 Å²	145.1	72%	0.719	79%	0.789	S	S	*	*			trans	49.5	97.7	141.9	0	0	0	0	0	118.6	R141	R141-A143 PolarHBondContact O-N 2.87Å
144	A	31	Very low	35.9	Very low	106 Å²	106	145 Å²	145	88%	0.876	80%	0.801	S	S	*	*			trans	-65.7	132.5	147.1	0	0	0	0	0	109.3
145	S	33.1	Very low	35.1	Very low	99 Å²	99	141.1 Å²	141.1	69%	0.692	81%	0.805	S	S	*	*			trans	-58.6	147.5	-176.2	45.6	0	0	0	0	115.3	A147	S145-A147 PolarHBondContact O-N 2.97Å
146	V	35.9	Very low	34.3	Very low	160 Å²	160	140.4 Å²	140.4	97%	0.97	81%	0.811	S	S	*	*	S	Bend	trans	-70.9	63.2	171.5	-177.4	0	0	0	0	111.3
147	A	35.3	Very low	33.8	Very low	81 Å²	81	137.9 Å²	137.9	67%	0.669	81%	0.814	S	S	*	*			trans	-144	13.5	-179.3	0	0	0	0	0	116.1	S145	S145-A147 PolarHBondContact O-N 2.97Å
148	E	35.4	Very low	33.2	Very low	190 Å²	190	142.1 Å²	142.1	89%	0.888	82%	0.823	S	S	*	*			trans	-132.8	37.9	178.6	-76.2	-171.5	151.1	0	0	114
149	I	35.3	Very low	32.7	Very low	163 Å²	163	140.4 Å²	140.4	84%	0.836	82%	0.824	S	S	*	*			trans	-121.5	62.8	167.3	-51.7	177.1	0	0	0	108.7
150	H	33.2	Very low	32.1	Very low	184 Å²	184	144.3 Å²	144.3	85%	0.852	83%	0.828	S	S	*	*			trans	-158.3	80.7	161.3	-97.7	109.5	0	0	0	109.1
151	R	35.3	Very low	31.8	Very low	235 Å²	235	146.3 Å²	146.3	89%	0.887	84%	0.839	S	S	*	*	S	Bend	trans	173.6	91.6	145.8	-101.2	177.8	-82.6	-178.9	-4.5	108.2
152	H	32.7	Very low	31.2	Very low	194 Å²	194	143.4 Å²	143.4	90%	0.898	84%	0.835	S	S	*	*			trans	172.6	89.2	132.8	-92.1	-65.8	0	0	0	107.4
153	A	26.8	Very low	31.1	Very low	107 Å²	107	142.6 Å²	142.6	88%	0.884	84%	0.835	S	S	*	*			trans	-83.6	150.4	164.7	0	0	0	0	0	109.6
154	G	27.8	Very low	31	Very low	80 Å²	80	144.8 Å²	144.8	83%	0.825	84%	0.839	S	S	*	*			trans	120.4	95.8	174	0	0	0	0	0	109.5
155	G	28	Very low	30.9	Very low	82 Å²	82	144.4 Å²	144.4	85%	0.845	84%	0.836	S	S	*	*			cis	106.9	97.7	40.3	0	0	0	0	0	107.1
156	A	30.1	Very low	30.8	Very low	105 Å²	105	145.8 Å²	145.8	87%	0.868	84%	0.84	S	S	*	*			trans	-160.2	127.6	163.9	0	0	0	0	0	110.9
157	D	28.5	Very low	30.4	Very low	158 Å²	158	143.3 Å²	143.3	85%	0.845	83%	0.83	S	S	*	*			trans	-74.4	158.1	-167.6	-85.5	-54.2	0	0	0	116.1
158	R	29.6	Very low	30.1	Very low	244 Å²	244	147.5 Å²	147.5	92%	0.921	84%	0.84	S	S	*	*			trans	-51.8	126.9	158	-73.1	171.3	164.6	165.4	-4.4	111.2
159	V	29.3	Very low	29.8	Very low	134 Å²	134	146.3 Å²	146.3	81%	0.812	84%	0.839	S	S	*	*			trans	-142.9	125.9	158.9	-177.5	0	0	0	0	111.5
160	H	25.9	Very low	29.5	Very low	163 Å²	163	148.1 Å²	148.1	76%	0.755	84%	0.844	S	S	*	*			trans	-64.4	146.6	164.3	-77.2	35.3	0	0	0	111.4	Q162	H160-Q162 PolarHBondContact O-N 2.94Å
161	P	29.5	Very low	29.2	Very low	136 Å²	136	143.2 Å²	143.2	88%	0.883	84%	0.843	S	S	*	*			trans	-88.1	101.5	157.5	30.2	-21.7	0	0	0	109.4
162	Q	28.5	Very low	28.9	Very low	171 Å²	171	136 Å²	136	80%	0.799	84%	0.842	S	S	*	*			trans	-85.1	141.5	156.9	-82.8	-164.5	-18.7	0	0	110	H160	H160-Q162 PolarHBondContact O-N 2.94Å
163	S	31.1	Very low	28.8	Very low	116 Å²	116	130 Å²	130	81%	0.811	83%	0.832	S	S	*	*			trans	-43.2	126.2	172.8	54.9	0	0	0	0	113.9
164	T	30	Very low	29.1	Very low	132 Å²	132	131.3 Å²	131.3	81%	0.81	83%	0.83	S	S	*	*			trans	-117.1	110.8	158.7	37.2	0	0	0	0	108.9
165	A	28.5	Very low	29.3	Very low	98 Å²	98	138.7 Å²	138.7	81%	0.81	83%	0.833	S	S	*	*			trans	-67.4	128.8	165.1	0	0	0	0	0	108.6
166	V	30.5	Very low	29.9	Very low	128 Å²	128	143.1 Å²	143.1	78%	0.776	84%	0.837	S	S	*	*			trans	-97.3	104.5	165.3	179	0	0	0	0	107.4	L168	V166-L168 HydrophobicContact CG1-CG 4.44Å
167	S	27.7	Very low	30.3	Very low	108 Å²	108	142.7 Å²	142.7	76%	0.755	83%	0.828	S	S	*	*			trans	-76.4	114.8	163.5	47.5	0	0	0	0	109.2
168	L	28.9	Very low	30.7	Very low	169 Å²	169	139.5 Å²	139.5	89%	0.885	82%	0.823	S	S	*	*			trans	-109.6	117.9	160.7	-88.8	159.2	0	0	0	107.3	V166	V166-L168 HydrophobicContact CG1-CG 4.44Å
169	L	28.9	Very low	31	Very low	166 Å²	166	135.3 Å²	135.3	87%	0.869	82%	0.818	S	S	*	*			trans	-123.2	111.6	176.8	-123.1	162.4	0	0	0	106.1
170	E	27.8	Very low	31.4	Very low	200 Å²	200	137 Å²	137	94%	0.935	82%	0.82	S	S	*	*			trans	159.6	126.4	154.2	-95.6	-179.1	174.6	0	0	106.2
171	G	28.7	Very low	32.1	Very low	81 Å²	81	140.8 Å²	140.8	84%	0.835	83%	0.827	S	S	*	*			cis	179.3	147.7	-0.9	0	0	0	0	0	105.9
172	G	27.3	Very low	32.6	Very low	83 Å²	83	145.2 Å²	145.2	86%	0.856	83%	0.826	S	S	*	*			trans	110.4	105.2	164.1	0	0	0	0	0	116.6
173	G	31.3	Very low	33.4	Very low	68 Å²	68	139.9 Å²	139.9	70%	0.701	81%	0.811	S	S	*	*			trans	83.6	108.4	133.2	0	0	0	0	0	118.6
174	T	32.7	Very low	34.3	Very low	136 Å²	136	140.5 Å²	140.5	83%	0.834	81%	0.813	S	S	*	*			trans	94.1	121.3	142.3	72.1	0	0	0	0	119.9
175	R	33.4	Very low	35.5	Very low	234 Å²	234	139.5 Å²	139.5	88%	0.883	81%	0.807	S	S	*	*			trans	80.3	97.3	154.8	-66	176.5	174.1	-178.3	-1.4	117.4	S177	R175-S177 VanDerWaalsContact C-N 3.32Å; R175-S177 PolarHBondContact O-N 2.8Å
176	N	38.9	Very low	37.3	Very low	175 Å²	175	138.3 Å²	138.3	94%	0.936	79%	0.785	S	S	*	*			trans	-47	94.7	145	-72.8	-23.9	0	0	0	110.4
177	S	38.6	Very low	39.7	Very low	96 Å²	96	135.5 Å²	135.5	67%	0.671	77%	0.769	S	S	*	*			trans	-106.3	82.9	151.2	63.9	0	0	0	0	107.1	R175 L179	R175-S177 VanDerWaalsContact C-N 3.32Å; R175-S177 PolarHBondContact O-N 2.8Å; S177-L179 PolarHBondContact O-N 2.94Å
178	A	38.6	Very low	42.3	Very low	91 Å²	91	137.4 Å²	137.4	75%	0.752	76%	0.764	S	S	*	*			trans	-56.2	101.1	154.7	0	0	0	0	0	105.8	M180	A178-M180 PolarHBondContact O-N 3.24Å
179	L	35.9	Very low	45.1	Very low	156 Å²	156	129.6 Å²	129.6	82%	0.817	72%	0.724	S	S	*	*			trans	-59.7	91.3	163.2	-80.2	161.4	0	0	0	105.1	S177 R181	S177-L179 PolarHBondContact O-N 2.94Å; L179-R181 VanDerWaalsContact C-N 3.26Å; L179-R181 PolarHBondContact O-N 2.78Å
180	M	36.9	Very low	47.9	Very low	171 Å²	171	126.6 Å²	126.6	84%	0.842	71%	0.705	S	S	*	*			trans	-50.6	104.8	159.1	-75.7	174.7	84.1	0	0	104.1	A178 R182	A178-M180 PolarHBondContact O-N 3.24Å; M180-R182 PolarHBondContact O-N 3.07Å
181	R	40	Very low	51	Low	242 Å²	242	119.9 Å²	119.9	91%	0.913	67%	0.671	S	S	*	*			trans	-53.2	100.3	163.5	-82.3	-177.6	172.8	172.8	-2	104.1	L179 A183	L179-R181 VanDerWaalsContact C-N 3.26Å; L179-R181 PolarHBondContact O-N 2.78Å; R181-A183 PolarHBondContact O-N 2.8Å
182	R	41	Very low	54	Low	228 Å²	228	116.6 Å²	116.6	86%	0.86	63%	0.634	S	S	*	*			trans	-49	119.1	171.2	-77.7	-176.1	174.3	-178.4	-1.3	103.9	M180	M180-R182 PolarHBondContact O-N 3.07Å
183	A	44.7	Very low	57.1	Low	59 Å²	59	113.8 Å²	113.8	49%	0.488	60%	0.601	S	S	.	*			trans	-47.1	135.4	170.4	0	0	0	0	0	106.2	R181 T185	R181-A183 PolarHBondContact O-N 2.8Å; A183-T185 VanDerWaalsContact C-N 3.28Å; A183-T185 PolarHBondContact O-N 3.45Å
184	P	50	Low	60.1	Low	130 Å²	130	111.3 Å²	111.3	84%	0.844	57%	0.572	S	S	*	*			trans	-56.3	100.5	-177.5	21.8	-31.2	0	0	0	107.6	M186	P184-M186 PolarHBondContact O-N 2.74Å
185	T	56.1	Low	63	Low	111 Å²	111	105 Å²	105	68%	0.681	53%	0.534	S	S	*	.			trans	-70.4	114.7	175.2	48	0	0	0	0	103.9	A183 P187	A183-T185 VanDerWaalsContact C-N 3.28Å; A183-T185 PolarHBondContact O-N 3.45Å; T185-P187 VanDerWaalsContact O-N 3.14Å
186	M	65.4	Low	65.9	Low	73 Å²	73	98.5 Å²	98.5	36%	0.36	51%	0.512	S	S	.	.	P	Polyproline II helix	trans	-52.7	126.8	178	-69.9	178	80.7	0	0	107.8	P184 W505	P184-M186 PolarHBondContact O-N 2.74Å; M186-W505 HydrophobicContact CB-CH2 3.69Å; M186-W505 HydrophobicContact CB-CZ2 3.31Å; M186-W505 HydrophobicContact CE-CH2 3.62Å; M186-W505 HydrophobicContact CE-CZ2 4.47Å; M186-W505 HydrophobicContact CE-CZ3 4.38Å; M186-W505 HydrophobicContact CG-CH2 4.48Å; M186-W505 HydrophobicContact CG-CZ2 4.46Å; M186-W505 HydrophobicContact SD-CH2 4.06Å; M186-W505 HydrophobicContact SD-CZ2 4.44Å
187	P	80	Confident	68.6	Low	68 Å²	68	94.3 Å²	94.3	44%	0.442	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-67.3	150.5	-173	28.1	-33.7	0	0	0	109.5	T185 T444 W505	T185-P187 VanDerWaalsContact O-N 3.14Å; P187-T444 HydrophobicContact CG-CG2 4.09Å; P187-T444 WeakPolarHBondContact O-CG2 3.46Å; P187-W505 VanDerWaalsContact O-CZ2 3.26Å; P187-W505 WeakPolarHBondContact O-CZ2 3.46Å
188	K	83.4	Confident	71.2	Confident	148 Å²	148	94.3 Å²	94.3	64%	0.643	48%	0.477	S	S	*	.	P	Polyproline II helix	trans	-56.8	128.9	177.1	-170.6	-175.8	175.7	-170.5	0	108.6	R443	K188-R443 PolarHBondContact O-NH1 3.42Å; K188-R443 VanDerWaalsContact O-NH1 3.14Å; K188-R443 PolarHBondContact O-NH2 3.24Å
189	P	86.8	Confident	73.9	Confident	6 Å²	6	93 Å²	93	4%	0.039	45%	0.452	C	S	.	.	P	Polyproline II helix	trans	-64.1	153.7	175.2	28.1	-37.1	0	0	0	110.9	D441 T444 Y446 I503 W505	P189-D441 WeakPolarHBondContact CA-OD2 3.46Å; P189-D441 WeakPolarHBondContact CB-OD2 3.34Å; P189-T444 HydrophobicContact CB-CG2 4.06Å; P189-T444 WeakPolarHBondContact CB-OG1 3.49Å; P189-Y446 HydrophobicContact CB-CD1 4.1Å; P189-Y446 HydrophobicContact CB-CG 4.13Å; P189-Y446 HydrophobicContact CG-CD1 4.06Å; P189-Y446 HydrophobicContact CG-CG 4.08Å; P189-I503 HydrophobicContact CB-CG2 4.48Å; P189-I503 HydrophobicContact CG-CD1 4.03Å; P189-I503 HydrophobicContact CG-CG2 3.34Å; P189-W505 VanDerWaalsContact CD-CD2 3.43Å; P189-W505 HydrophobicContact CG-CB 4.27Å; P189-W505 HydrophobicContact CG-CD2 4.01Å; P189-W505 HydrophobicContact CG-CE3 3.86Å; P189-W505 HydrophobicContact CG-CG 4.22Å; P189-W505 HydrophobicContact CG-CZ3 4.42Å
190	Q	88.7	Confident	76.7	Confident	102 Å²	102	89 Å²	89	48%	0.477	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-74.7	142.4	169.9	179.9	171.4	-13.7	0	0	108.8	H192 D441	Q190-H192 PolarHBondContact O-CD2 2.86Å; Q190-D441 PolarHBondContact N-OD2 3.36Å
191	W	92.1	Very high	79.6	Confident	59 Å²	59	81.4 Å²	81.4	22%	0.223	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-75.5	132.1	171.2	-177.7	85	0	0	0	109.3	P193 A496 E498 H501 I503	W191-P193 HydrophobicContact CH2-CB 4.02Å; W191-P193 HydrophobicContact CZ3-CB 4.41Å; W191-A496 HydrophobicContact CH2-CB 4.42Å; W191-A496 VanDerWaalsContact CH2-O 3.31Å; W191-A496 WeakPolarHBondContact CH2-O 3.33Å; W191-A496 HydrophobicContact CZ2-CB 4.13Å; W191-E498 HydrophobicContact CB-CG 3.97Å; W191-E498 HydrophobicContact CD2-CG 3.71Å; W191-E498 HydrophobicContact CE3-CG 4.16Å; W191-E498 HydrophobicContact CG-CB 4.39Å; W191-E498 HydrophobicContact CG-CG 3.62Å; W191-H501 PolarHBondContact NE1-O 2.96Å; W191-H501 VanDerWaalsContact NE1-O 3.14Å; W191-I503 HydrophobicContact CB-CD1 3.9Å; W191-I503 HydrophobicContact CB-CG1 4.39Å
192	H	91.9	Very high	82.2	Confident	12 Å²	12	73.6 Å²	73.6	6%	0.056	38%	0.379	C	S	.	.			trans	-124.5	139.8	175.8	-66.4	-70.8	0	0	0	108.2	Q190 D425 V427 D441 F448	Q190-H192 PolarHBondContact O-CD2 2.86Å; H192-D425 PolarHBondContact CE1-O 3.37Å; H192-V427 HydrophobicContact CB-CG2 4.14Å; H192-V427 WeakPolarHBondContact ND1-CG2 3.29Å; H192-D441 IonicContact NE2-OD1 3.29Å; H192-D441 PolarHBondContact NE2-OD1 2.89Å; H192-F448 HydrophobicContact CB-CD1 4.43Å; H192-F448 HydrophobicContact CB-CD2 4.35Å; H192-F448 HydrophobicContact CB-CE1 4.01Å; H192-F448 HydrophobicContact CB-CE2 3.93Å; H192-F448 HydrophobicContact CB-CZ 3.74Å
193	P	92.4	Very high	84.6	Confident	24 Å²	24	64.2 Å²	64.2	16%	0.156	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-64.4	143.6	175.9	28	-34.4	0	0	0	110.4	W191 E492	W191-P193 HydrophobicContact CH2-CB 4.02Å; W191-P193 HydrophobicContact CZ3-CB 4.41Å; P193-E492 HydrophobicContact CB-CB 4.32Å; P193-E492 HydrophobicContact CG-CB 3.98Å; P193-E492 VanDerWaalsContact CG-CD 3.49Å; P193-E492 HydrophobicContact CG-CG 3.95Å; P193-E492 WeakPolarHBondContact CG-OE2 3.35Å
194	P	93.8	Very high	87.1	Confident	16 Å²	16	61.8 Å²	61.8	10%	0.104	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-68.8	148	174.1	31.4	-33.9	0	0	0	110.4	D493 A496	P194-D493 HydrophobicContact CG-CB 4.16Å; P194-D493 WeakPolarHBondContact O-CB 3.24Å; P194-D493 PolarHBondContact O-N 2.93Å; P194-A496 HydrophobicContact CG-CB 3.68Å
195	W	94.6	Very high	89.3	Confident	5 Å²	5	62.2 Å²	62.2	2%	0.019	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	132.9	178.3	-69.8	68.5	0	0	0	110.3	M439 Q449 I451 F471 L478 E492	W195-M439 HydrophobicContact CB-CE 4.35Å; W195-M439 HydrophobicContact CD2-CE 3.86Å; W195-M439 HydrophobicContact CG-CE 3.58Å; W195-Q449 PolarHBondContact O-NE2 3.48Å; W195-I451 HydrophobicContact CB-CD1 4.27Å; W195-F471 AromaticContact CH2-CD1 4Å; W195-F471 HydrophobicContact CH2-CD1 4Å; W195-F471 AromaticContact CH2-CE1 3.48Å; W195-F471 HydrophobicContact CH2-CE1 3.48Å; W195-F471 VanDerWaalsContact CH2-CE1 3.48Å; W195-F471 AromaticContact CZ2-CE1 3.63Å; W195-F471 HydrophobicContact CZ2-CE1 3.63Å; W195-F471 HydrophobicContact CZ2-CZ 4.4Å; W195-F471 HydrophobicContact CZ3-CE1 4.14Å; W195-L478 HydrophobicContact CE3-CB 3.78Å; W195-L478 HydrophobicContact CH2-CB 4.31Å; W195-L478 HydrophobicContact CZ3-CB 3.57Å; W195-E492 HydrophobicContact CD2-CG 3.97Å; W195-E492 HydrophobicContact CE3-CG 4.31Å; W195-E492 HydrophobicContact CH2-CG 3.8Å; W195-E492 HydrophobicContact CZ2-CG 3.43Å; W195-E492 VanDerWaalsContact CZ2-CG 3.43Å; W195-E492 VanDerWaalsContact CZ2-OE1 3.22Å; W195-E492 WeakPolarHBondContact CZ2-OE1 3.45Å; W195-E492 HydrophobicContact CZ3-CG 4.22Å
196	K	94	Very high	91.1	Very high	97 Å²	97	57.5 Å²	57.5	42%	0.422	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	150.1	176	65.8	-177.1	177.5	-166.6	0	111.2	F198 Y490 K491 D493	K196-F198 PolarHBondContact O-N 3.24Å; K196-Y490 CarbonylContact O-C 3.59Å; K196-Y490 VanDerWaalsContact O-CA 3.24Å; K196-Y490 WeakPolarHBondContact O-CA 3.37Å; K196-K491 PolarHBondContact N-O 3.31Å; K196-K491 PolarHBondContact O-N 3.4Å; K196-D493 HydrophobicContact CD-CB 4.11Å; K196-D493 WeakPolarHBondContact CE-OD1 3.31Å; K196-D493 HydrophobicContact CG-CB 4.46Å; K196-D493 IonicContact NZ-OD1 3.8Å; K196-D493 PolarHBondContact NZ-OD1 2.97Å
197	L	95.2	Very high	92.6	Very high	86 Å²	86	59.7 Å²	59.7	45%	0.45	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	120.1	175.2	-179	64.4	0	0	0	109	V200 K488 Y490	L197-V200 HydrophobicContact CD1-CG2 4.18Å; L197-V200 HydrophobicContact CD2-CG2 3.79Å; L197-V200 HydrophobicContact CG-CG2 4.3Å; L197-K488 HydrophobicContact CD1-CB 3.69Å; L197-K488 HydrophobicContact CD1-CD 4.22Å; L197-K488 HydrophobicContact CD1-CG 4.19Å; L197-Y490 HydrophobicContact CB-CD1 4.24Å; L197-Y490 HydrophobicContact CB-CE1 3.97Å; L197-Y490 HydrophobicContact CD1-CE1 4.17Å; L197-Y490 HydrophobicContact CD1-CE2 4.19Å
198	F	93.6	Very high	93.5	Very high	97 Å²	97	56.5 Å²	56.5	43%	0.425	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	-41	-179.8	173.6	-106	0	0	0	111.8	K196 V489 K491	K196-F198 PolarHBondContact O-N 3.24Å; F198-V489 WeakPolarHBondContact CA-O 3.42Å; F198-V489 WeakPolarHBondContact CB-O 3.4Å; F198-V489 HydrophobicContact CD1-CG1 4.5Å; F198-V489 PolarHBondContact N-O 2.85Å; F198-K491 HydrophobicContact CB-CB 4.05Å; F198-K491 HydrophobicContact CG-CB 4.47Å
199	R	94.8	Very high	94.1	Very high	64 Å²	64	51.6 Å²	51.6	24%	0.242	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	144.3	-176.9	-171.9	178.9	-67.5	156.1	-5.3	111.6	I201 A235 S236 K488 V489	R199-I201 HydrophobicContact CG-CG1 4.04Å; R199-A235 PolarHBondContact NH1-O 2.98Å; R199-A235 PolarHBondContact NH2-O 2.99Å; R199-S236 PolarHBondContact NH1-O 2.81Å; R199-K488 WeakPolarHBondContact O-CA 3.35Å; R199-V489 HydrophobicContact CB-CB 4.26Å; R199-V489 PolarHBondContact N-O 2.87Å; R199-V489 VanDerWaalsContact N-O 3.08Å; R199-V489 PolarHBondContact O-N 3.48Å
200	V	96.3	Very high	94.6	Very high	71 Å²	71	51.7 Å²	51.7	43%	0.43	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	122.9	167	-175.6	0	0	0	0	107.9	L197 T486 K488	L197-V200 HydrophobicContact CD1-CG2 4.18Å; L197-V200 HydrophobicContact CD2-CG2 3.79Å; L197-V200 HydrophobicContact CG-CG2 4.3Å; V200-T486 HydrophobicContact CG1-CG2 3.95Å; V200-K488 HydrophobicContact CG1-CG 4.3Å; V200-K488 HydrophobicContact CG2-CD 4.41Å; V200-K488 HydrophobicContact CG2-CG 4.21Å
201	I	96.1	Very high	95	Very high	11 Å²	11	47.5 Å²	47.5	6%	0.056	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	120	177.1	-57	167.9	0	0	0	106.9	R199 F220 W232 T486 I487 V489	R199-I201 HydrophobicContact CG-CG1 4.04Å; I201-F220 HydrophobicContact CD1-CE1 4.33Å; I201-F220 HydrophobicContact CD1-CZ 3.81Å; I201-W232 HydrophobicContact CG2-CD2 4.23Å; I201-W232 HydrophobicContact CG2-CE3 3.61Å; I201-W232 HydrophobicContact CG2-CH2 3.99Å; I201-W232 HydrophobicContact CG2-CZ3 3.48Å; I201-W232 VanDerWaalsContact CG2-CZ3 3.48Å; I201-T486 WeakPolarHBondContact O-CA 3.46Å; I201-I487 HydrophobicContact CB-CB 4.22Å; I201-I487 PolarHBondContact N-O 2.93Å; I201-I487 PolarHBondContact O-N 3.45Å; I201-V489 HydrophobicContact CD1-CG2 4.2Å
202	S	94.6	Very high	95.2	Very high	78 Å²	78	45 Å²	45	55%	0.545	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	148.3	174.3	-173	0	0	0	0	109.9
203	G	92.8	Very high	95.4	Very high	31 Å²	31	44.9 Å²	44.9	32%	0.32	24%	0.235	S	C	.	.			trans	158.3	-8	176.8	0	0	0	0	0	114.8	K230	G203-K230 PolarHBondContact O-NZ 2.96Å
204	H	96.4	Very high	95.5	Very high	8 Å²	8	45.6 Å²	45.6	4%	0.037	24%	0.236	C	C	.	.			trans	-79.1	151.3	167.1	-81.6	-70.2	0	0	0	111.5	V208 T222 S224 D226 K230 W232 K485	H204-V208 HydrophobicContact CB-CG2 3.99Å; H204-T222 PolarHBondContact NE2-OG1 3.49Å; H204-S224 VanDerWaalsContact CE1-CB 3.49Å; H204-S224 WeakPolarHBondContact CE1-CB 3.14Å; H204-S224 WeakPolarHBondContact ND1-CB 3.5Å; H204-D226 IonicContact CE1-OD2 3.89Å; H204-D226 IonicContact CG-OD2 3.58Å; H204-D226 IonicContact ND1-OD1 2.87Å; H204-D226 IonicContact ND1-OD2 3.37Å; H204-D226 PolarHBondContact ND1-OD2 2.9Å; H204-K230 VanDerWaalsContact CE1-CD 3.5Å; H204-K230 WeakPolarHBondContact CE1-CD 3.49Å; H204-W232 AromaticContact CD2-CZ2 3.95Å; H204-W232 AromaticContact NE2-CZ2 3.9Å; H204-W232 AromaticContact NE2-NE1 3.88Å; H204-K485 HydrophobicContact CB-CB 4.48Å
205	L	95.4	Very high	95.4	Very high	140 Å²	140	46.9 Å²	46.9	73%	0.733	24%	0.244	S	C	*	.	S	Bend	trans	-97	-12	178.5	-61.7	175.7	0	0	0	112.8	D226 K485	L205-D226 HydrophobicContact CB-CB 3.94Å; L205-D226 PolarHBondContact N-OD2 3.49Å; L205-D226 VanDerWaalsContact N-OD2 3.13Å; L205-K485 WeakPolarHBondContact O-CD 3.42Å; L205-K485 WeakPolarHBondContact O-CE 3.35Å; L205-K485 PolarHBondContact O-NZ 3.18Å
206	G	95.6	Very high	95.4	Very high	11 Å²	11	48.6 Å²	48.6	11%	0.113	26%	0.264	C	S	.	.	S	Bend	trans	-138.4	177.1	177.5	0	0	0	0	0	112.2	V208 S224	G206-V208 PolarHBondContact O-N 2.87Å; G206-S224 VanDerWaalsContact C-OG 3.28Å; G206-S224 PolarHBondContact O-OG 3.34Å
207	W	96.7	Very high	95.4	Very high	120 Å²	120	45.9 Å²	45.9	46%	0.455	25%	0.254	S	S	.	.			trans	-51.5	128.6	179.2	-61.5	-14.5	0	0	0	112.1	R209 S224 A225 F467 A483	W207-R209 PolarHBondContact O-N 2.85Å; W207-S224 CarbonylContact O-C 3.53Å; W207-S224 VanDerWaalsContact O-CA 3.31Å; W207-S224 WeakPolarHBondContact O-CA 3.38Å; W207-S224 PolarHBondContact O-OG 2.93Å; W207-A225 HydrophobicContact CB-CB 4.16Å; W207-A225 PolarHBondContact O-N 3.06Å; W207-F467 HydrophobicContact CB-CD2 4.22Å; W207-F467 HydrophobicContact CB-CE2 3.67Å; W207-F467 HydrophobicContact CD2-CE2 4.06Å; W207-F467 HydrophobicContact CD2-CZ 4.2Å; W207-F467 HydrophobicContact CE3-CE2 4.21Å; W207-F467 HydrophobicContact CE3-CZ 4Å; W207-F467 AromaticContact CG-CE2 3.85Å; W207-F467 HydrophobicContact CG-CE2 3.85Å; W207-F467 HydrophobicContact CG-CZ 4.47Å; W207-A483 PolarHBondContact NE1-O 3.41Å
208	V	97.6	Very high	95.4	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	118.3	176.4	-168.4	0	0	0	0	107.7	H204 G206 T222 F467 A481 E482 I487	H204-V208 HydrophobicContact CB-CG2 3.99Å; G206-V208 PolarHBondContact O-N 2.87Å; V208-T222 HydrophobicContact CG1-CG2 4.24Å; V208-F467 WeakPolarHBondContact O-CB 3.36Å; V208-F467 VanDerWaalsContact O-CD2 3.31Å; V208-F467 WeakPolarHBondContact O-CD2 3.38Å; V208-A481 HydrophobicContact CB-CB 3.71Å; V208-A481 HydrophobicContact CG1-CB 3.44Å; V208-A481 VanDerWaalsContact CG1-CB 3.44Å; V208-E482 PolarHBondContact N-O 3.36Å; V208-I487 HydrophobicContact CG1-CG1 4.35Å; V208-I487 HydrophobicContact CG2-CG1 4.38Å
209	R	97.1	Very high	95.5	Very high	45 Å²	45	45 Å²	45	17%	0.17	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	-28.5	-168.8	-58.3	-57.5	-62.6	-83.8	6.2	113.9	W207 G223 V250 R251 E267	W207-R209 PolarHBondContact O-N 2.85Å; R209-G223 PolarHBondContact N-O 3.11Å; R209-V250 VanDerWaalsContact CB-O 3.31Å; R209-V250 WeakPolarHBondContact CB-O 3.34Å; R209-R251 VanDerWaalsContact CZ-NE 3.33Å; R209-E267 IonicContact NH1-OE1 3.69Å
210	S	96	Very high	95.6	Very high	8 Å²	8	42 Å²	42	6%	0.056	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	151.9	-176.4	45.6	0	0	0	0	111.5	T222 G223 R251	S210-T222 WeakPolarHBondContact O-CA 3.39Å; S210-G223 PolarHBondContact N-O 3.46Å; S210-G223 PolarHBondContact O-N 3.18Å; S210-R251 VanDerWaalsContact CB-O 3.31Å; S210-R251 WeakPolarHBondContact CB-O 3.45Å; S210-R251 PolarHBondContact OG-O 2.77Å
211	I	97.2	Very high	95.7	Very high	14 Å²	14	38.7 Å²	38.7	7%	0.072	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	140.5	174.7	-60.2	164	0	0	0	107.8	F220 V221 T222 L470 I479 T480 A481	I211-F220 HydrophobicContact CG2-CD2 4.36Å; I211-V221 CarbonylContact C-O 3.55Å; I211-V221 VanDerWaalsContact CA-O 3.3Å; I211-V221 WeakPolarHBondContact CA-O 3.37Å; I211-T222 HydrophobicContact CG1-CG2 4.07Å; I211-L470 HydrophobicContact CG2-CB 4.47Å; I211-I479 HydrophobicContact CD1-CB 4.36Å; I211-I479 HydrophobicContact CD1-CG2 3.84Å; I211-I479 HydrophobicContact CG2-CG2 4.25Å; I211-T480 VanDerWaalsContact CD1-C 3.49Å; I211-A481 HydrophobicContact CD1-CB 3.3Å; I211-A481 HydrophobicContact CG1-CB 3.53Å
212	A	96.5	Very high	95.7	Very high	8 Å²	8	38.1 Å²	38.1	7%	0.066	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	138.7	165	0	0	0	0	0	109.4	F220 V221 V253 V255	A212-F220 CarbonylContact O-C 3.58Å; A212-F220 WeakPolarHBondContact O-CA 3.33Å; A212-F220 WeakPolarHBondContact O-CB 3.49Å; A212-V221 PolarHBondContact N-O 3.47Å; A212-V221 PolarHBondContact O-N 2.65Å; A212-V253 HydrophobicContact CB-CG1 4.09Å; A212-V255 HydrophobicContact CB-CG2 4.1Å
213	V	96.4	Very high	95.9	Very high	9 Å²	9	34.4 Å²	34.4	6%	0.055	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	142.1	175.6	172.6	0	0	0	0	109.1	N217 F220 L470 D472 I479	V213-N217 WeakPolarHBondContact CG1-OD1 3.41Å; V213-F220 HydrophobicContact CG2-CB 3.94Å; V213-L470 HydrophobicContact CB-CD2 3.93Å; V213-L470 HydrophobicContact CG2-CD2 3.72Å; V213-D472 HydrophobicContact CG1-CB 4.44Å; V213-I479 HydrophobicContact CG2-CD1 3.69Å
214	E	95.1	Very high	96.1	Very high	38 Å²	38	33 Å²	33	18%	0.178	17%	0.171	C	C	.	.			trans	-71.6	141.7	174.2	-173.1	-87.6	138.4	0	0	111	G216 N217 Q218 W219	E214-G216 VanDerWaalsContact C-N 3.29Å; E214-G216 PolarHBondContact O-N 2.87Å; E214-G216 WeakPolarHBondContact OE1-CA 3.41Å; E214-G216 PolarHBondContact OE1-N 2.8Å; E214-G216 WeakPolarHBondContact OE2-CA 3.45Å; E214-G216 PolarHBondContact OE2-N 3.13Å; E214-N217 PolarHBondContact O-N 2.88Å; E214-N217 PolarHBondContact OE2-N 3.47Å; E214-N217 VanDerWaalsContact OE2-N 3.07Å; E214-Q218 PolarHBondContact OE2-N 3.21Å; E214-W219 HydrophobicContact CB-CD2 3.7Å; E214-W219 HydrophobicContact CB-CE3 3.69Å; E214-W219 HydrophobicContact CB-CG 4.3Å; E214-W219 HydrophobicContact CB-CH2 3.91Å; E214-W219 HydrophobicContact CB-CZ2 3.96Å; E214-W219 HydrophobicContact CB-CZ3 3.76Å; E214-W219 WeakPolarHBondContact CB-O 3.24Å; E214-W219 HydrophobicContact CG-CD2 3.89Å; E214-W219 VanDerWaalsContact CG-CE2 3.44Å; E214-W219 HydrophobicContact CG-CE3 4.21Å; E214-W219 HydrophobicContact CG-CH2 3.71Å; E214-W219 HydrophobicContact CG-CZ2 3.37Å; E214-W219 HydrophobicContact CG-CZ3 4.1Å; E214-W219 PolarHBondContact N-O 3.49Å; E214-W219 VanDerWaalsContact N-O 3.09Å
215	P	92.4	Very high	96.1	Very high	43 Å²	43	33.9 Å²	33.9	28%	0.279	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-35.2	-176.5	-23.8	29.3	0	0	0	115.8	N217 H473	P215-N217 VanDerWaalsContact C-N 3.28Å; P215-N217 PolarHBondContact O-N 3.26Å; P215-H473 PolarHBondContact O-CD2 2.96Å
216	G	92.9	Very high	96.2	Very high	42 Å²	42	28.3 Å²	28.3	43%	0.433	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	5.7	175.1	0	0	0	0	0	115.2	E214 Q218	E214-G216 VanDerWaalsContact C-N 3.29Å; E214-G216 PolarHBondContact O-N 2.87Å; E214-G216 WeakPolarHBondContact OE1-CA 3.41Å; E214-G216 PolarHBondContact OE1-N 2.8Å; E214-G216 WeakPolarHBondContact OE2-CA 3.45Å; E214-G216 PolarHBondContact OE2-N 3.13Å; G216-Q218 PolarHBondContact O-N 3.48Å; G216-Q218 VanDerWaalsContact O-N 3.11Å; G216-Q218 PolarHBondContact O-NE2 3.47Å
217	N	94.2	Very high	96.2	Very high	40 Å²	40	34.5 Å²	34.5	21%	0.214	17%	0.171	C	C	.	.	S	Bend	trans	58.6	22	174	-141.5	39.5	0	0	0	115	V213 E214 P215 L234 D472 H473	V213-N217 WeakPolarHBondContact CG1-OD1 3.41Å; E214-N217 PolarHBondContact O-N 2.88Å; E214-N217 PolarHBondContact OE2-N 3.47Å; E214-N217 VanDerWaalsContact OE2-N 3.07Å; P215-N217 VanDerWaalsContact C-N 3.28Å; P215-N217 PolarHBondContact O-N 3.26Å; N217-L234 HydrophobicContact CB-CD2 4.25Å; N217-L234 WeakPolarHBondContact ND2-CD2 3.23Å; N217-L234 VanDerWaalsContact O-CD2 3.23Å; N217-L234 WeakPolarHBondContact O-CD2 3.46Å; N217-L234 WeakPolarHBondContact OD1-CD2 3.37Å; N217-D472 PolarHBondContact ND2-OD2 3.44Å; N217-D472 WeakPolarHBondContact OD1-CB 3.28Å; N217-D472 PolarHBondContact OD1-OD2 3.13Å; N217-H473 PolarHBondContact OD1-N 3.24Å
218	Q	94.7	Very high	96.2	Very high	120 Å²	120	29.9 Å²	29.9	56%	0.561	16%	0.156	S	C	*	.	S	Bend	trans	-85.5	-34.9	-178.7	-63.8	-55	-53.6	0	0	112.3	E214 G216 L234	E214-Q218 PolarHBondContact OE2-N 3.21Å; G216-Q218 PolarHBondContact O-N 3.48Å; G216-Q218 VanDerWaalsContact O-N 3.11Å; G216-Q218 PolarHBondContact O-NE2 3.47Å; Q218-L234 PolarHBondContact O-N 3.23Å; Q218-L234 VanDerWaalsContact O-N 3.08Å
219	W	96.1	Very high	96.2	Very high	45 Å²	45	29.9 Å²	29.9	17%	0.17	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	165.4	-177.6	50.4	-94.1	0	0	0	110.6	E214 V221 I231 W232 K240 V255 L276	E214-W219 HydrophobicContact CB-CD2 3.7Å; E214-W219 HydrophobicContact CB-CE3 3.69Å; E214-W219 HydrophobicContact CB-CG 4.3Å; E214-W219 HydrophobicContact CB-CH2 3.91Å; E214-W219 HydrophobicContact CB-CZ2 3.96Å; E214-W219 HydrophobicContact CB-CZ3 3.76Å; E214-W219 WeakPolarHBondContact CB-O 3.24Å; E214-W219 HydrophobicContact CG-CD2 3.89Å; E214-W219 VanDerWaalsContact CG-CE2 3.44Å; E214-W219 HydrophobicContact CG-CE3 4.21Å; E214-W219 HydrophobicContact CG-CH2 3.71Å; E214-W219 HydrophobicContact CG-CZ2 3.37Å; E214-W219 HydrophobicContact CG-CZ3 4.1Å; E214-W219 PolarHBondContact N-O 3.49Å; E214-W219 VanDerWaalsContact N-O 3.09Å; W219-V221 HydrophobicContact CE3-CG2 3.76Å; W219-V221 HydrophobicContact CH2-CG2 4.47Å; W219-V221 HydrophobicContact CZ3-CG2 3.36Å; W219-I231 HydrophobicContact CB-CG2 3.93Å; W219-I231 HydrophobicContact CD2-CG2 3.82Å; W219-I231 HydrophobicContact CE3-CG2 3.72Å; W219-I231 HydrophobicContact CG-CG2 3.97Å; W219-W232 CarbonylContact C-O 3.46Å; W219-W232 WeakPolarHBondContact CA-O 3.26Å; W219-W232 WeakPolarHBondContact CB-O 3.39Å; W219-K240 HydrophobicContact CB-CD 4.39Å; W219-V255 HydrophobicContact CH2-CG1 4.04Å; W219-V255 HydrophobicContact CH2-CG2 4.13Å; W219-V255 HydrophobicContact CZ3-CG2 3.89Å; W219-L276 HydrophobicContact CH2-CD1 3.58Å; W219-L276 HydrophobicContact CH2-CD2 4.05Å; W219-L276 HydrophobicContact CH2-CG 4.47Å; W219-L276 HydrophobicContact CZ2-CD1 3.8Å; W219-L276 HydrophobicContact CZ2-CD2 4.38Å
220	F	97.4	Very high	96.3	Very high	1 Å²	1	29 Å²	29	0%	0.004	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	158	173.4	68.3	-85.6	0	0	0	109.4	I201 I211 A212 V213 T222 I231 W232 L234 I479 I487	I201-F220 HydrophobicContact CD1-CE1 4.33Å; I201-F220 HydrophobicContact CD1-CZ 3.81Å; I211-F220 HydrophobicContact CG2-CD2 4.36Å; A212-F220 CarbonylContact O-C 3.58Å; A212-F220 WeakPolarHBondContact O-CA 3.33Å; A212-F220 WeakPolarHBondContact O-CB 3.49Å; V213-F220 HydrophobicContact CG2-CB 3.94Å; F220-T222 HydrophobicContact CD2-CG2 3.89Å; F220-T222 HydrophobicContact CE2-CG2 3.74Å; F220-I231 WeakPolarHBondContact O-CA 3.17Å; F220-W232 HydrophobicContact CD1-CB 3.97Å; F220-W232 HydrophobicContact CD2-CB 4.28Å; F220-W232 HydrophobicContact CE1-CB 3.44Å; F220-W232 VanDerWaalsContact CE1-CB 3.44Å; F220-W232 HydrophobicContact CE1-CG 4.32Å; F220-W232 HydrophobicContact CE2-CB 3.79Å; F220-W232 AromaticContact CE2-CD1 3.58Å; F220-W232 AromaticContact CE2-CG 3.83Å; F220-W232 HydrophobicContact CE2-CG 3.83Å; F220-W232 HydrophobicContact CG-CB 4.37Å; F220-W232 HydrophobicContact CZ-CB 3.34Å; F220-W232 AromaticContact CZ-CD1 3.97Å; F220-W232 AromaticContact CZ-CG 3.72Å; F220-W232 HydrophobicContact CZ-CG 3.72Å; F220-W232 PolarHBondContact N-O 3.34Å; F220-W232 PolarHBondContact O-N 3.42Å; F220-L234 HydrophobicContact CD1-CB 4.18Å; F220-L234 HydrophobicContact CD1-CD1 3.57Å; F220-L234 HydrophobicContact CD1-CG 4.5Å; F220-L234 HydrophobicContact CE1-CD1 4.15Å; F220-L234 HydrophobicContact CG-CD1 4.34Å; F220-I479 HydrophobicContact CB-CD1 4.25Å; F220-I479 HydrophobicContact CD1-CD1 4.19Å; F220-I479 HydrophobicContact CD2-CD1 4.35Å; F220-I479 HydrophobicContact CD2-CG2 4.46Å; F220-I479 HydrophobicContact CE2-CG2 4.25Å; F220-I479 HydrophobicContact CG-CD1 4.01Å; F220-I487 HydrophobicContact CE2-CD1 4.19Å; F220-I487 HydrophobicContact CE2-CG2 3.97Å; F220-I487 HydrophobicContact CZ-CG2 4.23Å
221	V	97.6	Very high	96.4	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	142.2	-175.8	-177.3	0	0	0	0	108.9	I211 A212 W219 I229 K230 I231 V253 V255 L262	I211-V221 CarbonylContact C-O 3.55Å; I211-V221 VanDerWaalsContact CA-O 3.3Å; I211-V221 WeakPolarHBondContact CA-O 3.37Å; A212-V221 PolarHBondContact N-O 3.47Å; A212-V221 PolarHBondContact O-N 2.65Å; W219-V221 HydrophobicContact CE3-CG2 3.76Å; W219-V221 HydrophobicContact CH2-CG2 4.47Å; W219-V221 HydrophobicContact CZ3-CG2 3.36Å; V221-I229 HydrophobicContact CG1-CG2 3.16Å; V221-K230 CarbonylContact C-O 3.57Å; V221-K230 WeakPolarHBondContact CA-O 3.14Å; V221-I231 HydrophobicContact CG2-CG1 4.22Å; V221-V253 HydrophobicContact CB-CG1 4.06Å; V221-V253 HydrophobicContact CG1-CG1 3.68Å; V221-V255 HydrophobicContact CG2-CG2 4.24Å; V221-L262 HydrophobicContact CB-CD1 4.34Å; V221-L262 HydrophobicContact CG1-CD1 3.97Å; V221-L262 HydrophobicContact CG2-CD1 3.58Å
222	T	97.9	Very high	96.4	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	135.9	171.4	57.2	0	0	0	0	111.4	H204 V208 S210 I211 F220 I229 K230 W232 I487	H204-T222 PolarHBondContact NE2-OG1 3.49Å; V208-T222 HydrophobicContact CG1-CG2 4.24Å; S210-T222 WeakPolarHBondContact O-CA 3.39Å; I211-T222 HydrophobicContact CG1-CG2 4.07Å; F220-T222 HydrophobicContact CD2-CG2 3.89Å; F220-T222 HydrophobicContact CE2-CG2 3.74Å; T222-I229 WeakPolarHBondContact O-CA 3.44Å; T222-K230 PolarHBondContact N-O 3.08Å; T222-K230 PolarHBondContact O-N 2.79Å; T222-K230 PolarHBondContact OG1-O 2.81Å; T222-W232 PolarHBondContact OG1-NE1 2.77Å; T222-I487 HydrophobicContact CG2-CD1 3.52Å; T222-I487 HydrophobicContact CG2-CG1 3.98Å
223	G	97.4	Very high	96.4	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	129.8	171.2	0	0	0	0	0	110.1	R209 S210	R209-G223 PolarHBondContact N-O 3.11Å; S210-G223 PolarHBondContact N-O 3.46Å; S210-G223 PolarHBondContact O-N 3.18Å
224	S	97.5	Very high	96.3	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	163.3	-177.1	174.2	0	0	0	0	113.2	H204 G206 W207 D226 R227 T228 V250	H204-S224 VanDerWaalsContact CE1-CB 3.49Å; H204-S224 WeakPolarHBondContact CE1-CB 3.14Å; H204-S224 WeakPolarHBondContact ND1-CB 3.5Å; G206-S224 VanDerWaalsContact C-OG 3.28Å; G206-S224 PolarHBondContact O-OG 3.34Å; W207-S224 CarbonylContact O-C 3.53Å; W207-S224 VanDerWaalsContact O-CA 3.31Å; W207-S224 WeakPolarHBondContact O-CA 3.38Å; W207-S224 PolarHBondContact O-OG 2.93Å; S224-D226 VanDerWaalsContact CB-OD1 3.32Å; S224-D226 WeakPolarHBondContact CB-OD1 3.28Å; S224-D226 PolarHBondContact O-N 3.03Å; S224-D226 PolarHBondContact OG-N 2.78Å; S224-R227 PolarHBondContact O-N 3.38Å; S224-T228 PolarHBondContact N-O 3.44Å; S224-V250 PolarHBondContact O-N 3.25Å; S224-V250 VanDerWaalsContact O-N 3.15Å
225	A	97.1	Very high	96.2	Very high	28 Å²	28	31.1 Å²	31.1	23%	0.231	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-13.5	169.4	0	0	0	0	0	113.4	W207 R227 T249	W207-A225 HydrophobicContact CB-CB 4.16Å; W207-A225 PolarHBondContact O-N 3.06Å; A225-R227 PolarHBondContact O-N 3.28Å; A225-T249 HydrophobicContact CB-CG2 3.69Å
226	D	96.2	Very high	96.3	Very high	23 Å²	23	31.4 Å²	31.4	12%	0.123	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.7	0.5	170.3	65.9	19.3	0	0	0	114	H204 L205 S224 T228	H204-D226 IonicContact CE1-OD2 3.89Å; H204-D226 IonicContact CG-OD2 3.58Å; H204-D226 IonicContact ND1-OD1 2.87Å; H204-D226 IonicContact ND1-OD2 3.37Å; H204-D226 PolarHBondContact ND1-OD2 2.9Å; L205-D226 HydrophobicContact CB-CB 3.94Å; L205-D226 PolarHBondContact N-OD2 3.49Å; L205-D226 VanDerWaalsContact N-OD2 3.13Å; S224-D226 VanDerWaalsContact CB-OD1 3.32Å; S224-D226 WeakPolarHBondContact CB-OD1 3.28Å; S224-D226 PolarHBondContact O-N 3.03Å; S224-D226 PolarHBondContact OG-N 2.78Å; D226-T228 PolarHBondContact O-N 2.89Å; D226-T228 WeakPolarHBondContact OD1-CA 3.43Å; D226-T228 WeakPolarHBondContact OD1-CB 3.1Å; D226-T228 PolarHBondContact OD1-N 2.91Å; D226-T228 PolarHBondContact OD1-OG1 3.06Å; D226-T228 PolarHBondContact OD2-OG1 2.88Å
227	R	96.7	Very high	96.3	Very high	141 Å²	141	29.9 Å²	29.9	53%	0.532	16%	0.16	S	C	.	.	S	Bend	trans	71.3	9.8	179.7	-44.3	167	-75.5	177	-2.2	113.5	S224 A225 I247 S248	S224-R227 PolarHBondContact O-N 3.38Å; A225-R227 PolarHBondContact O-N 3.28Å; R227-I247 WeakPolarHBondContact CD-O 3.44Å; R227-S248 WeakPolarHBondContact CG-O 3.47Å
228	T	96.8	Very high	96.4	Very high	22 Å²	22	35.2 Å²	35.2	14%	0.135	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	151.1	177.5	74.6	0	0	0	0	110.8	S224 D226 T244	S224-T228 PolarHBondContact N-O 3.44Å; D226-T228 PolarHBondContact O-N 2.89Å; D226-T228 WeakPolarHBondContact OD1-CA 3.43Å; D226-T228 WeakPolarHBondContact OD1-CB 3.1Å; D226-T228 PolarHBondContact OD1-N 2.91Å; D226-T228 PolarHBondContact OD1-OG1 3.06Å; D226-T228 PolarHBondContact OD2-OG1 2.88Å; T228-T244 HydrophobicContact CG2-CG2 4.13Å
229	I	97.9	Very high	96.5	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.005	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	119.6	169.3	-61.7	173.8	0	0	0	106.1	V221 T222 L243 V250 L262 S264 W274	V221-I229 HydrophobicContact CG1-CG2 3.16Å; T222-I229 WeakPolarHBondContact O-CA 3.44Å; I229-L243 HydrophobicContact CB-CB 4.15Å; I229-L243 PolarHBondContact N-O 2.99Å; I229-L243 PolarHBondContact O-N 2.96Å; I229-V250 HydrophobicContact CD1-CG1 4.23Å; I229-V250 HydrophobicContact CD1-CG2 4.46Å; I229-V250 HydrophobicContact CG1-CB 4.46Å; I229-V250 HydrophobicContact CG1-CG1 4.04Å; I229-V250 HydrophobicContact CG1-CG2 3.92Å; I229-L262 HydrophobicContact CD1-CD2 4.41Å; I229-S264 WeakPolarHBondContact CD1-OG 3.38Å; I229-W274 HydrophobicContact CD1-CZ2 4.08Å
230	K	97.8	Very high	96.5	Very high	27 Å²	27	36.5 Å²	36.5	12%	0.117	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	134.3	-178.5	-69.8	-170.4	-179.2	-161.6	0	110.2	G203 H204 V221 T222 W232 L239 L241	G203-K230 PolarHBondContact O-NZ 2.96Å; H204-K230 VanDerWaalsContact CE1-CD 3.5Å; H204-K230 WeakPolarHBondContact CE1-CD 3.49Å; V221-K230 CarbonylContact C-O 3.57Å; V221-K230 WeakPolarHBondContact CA-O 3.14Å; T222-K230 PolarHBondContact N-O 3.08Å; T222-K230 PolarHBondContact O-N 2.79Å; T222-K230 PolarHBondContact OG1-O 2.81Å; K230-W232 HydrophobicContact CB-CZ2 3.87Å; K230-W232 HydrophobicContact CD-CH2 4.22Å; K230-W232 HydrophobicContact CD-CZ2 3.61Å; K230-W232 HydrophobicContact CG-CZ2 4.37Å; K230-L239 HydrophobicContact CB-CD1 3.71Å; K230-L239 HydrophobicContact CD-CD1 3.84Å; K230-L239 HydrophobicContact CD-CD2 4.46Å; K230-L239 HydrophobicContact CG-CD1 3.95Å; K230-L241 WeakPolarHBondContact CA-O 3.39Å
231	I	97.6	Very high	96.4	Very high	10 Å²	10	39.1 Å²	39.1	5%	0.051	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	124	174.2	-51.2	-172.1	0	0	0	107.6	W219 F220 V221 K240 L241 L243 L276	W219-I231 HydrophobicContact CB-CG2 3.93Å; W219-I231 HydrophobicContact CD2-CG2 3.82Å; W219-I231 HydrophobicContact CE3-CG2 3.72Å; W219-I231 HydrophobicContact CG-CG2 3.97Å; F220-I231 WeakPolarHBondContact O-CA 3.17Å; V221-I231 HydrophobicContact CG2-CG1 4.22Å; I231-K240 HydrophobicContact CG2-CB 4.45Å; I231-K240 PolarHBondContact O-N 3.31Å; I231-L241 HydrophobicContact CB-CB 4.16Å; I231-L241 HydrophobicContact CD1-CB 4.27Å; I231-L241 HydrophobicContact CD1-CD2 4.07Å; I231-L241 HydrophobicContact CG1-CB 4.28Å; I231-L241 PolarHBondContact N-O 3Å; I231-L241 PolarHBondContact O-N 3.49Å; I231-L243 HydrophobicContact CD1-CD1 4.19Å; I231-L276 HydrophobicContact CD1-CD2 4.28Å
232	W	97.7	Very high	96.3	Very high	8 Å²	8	41.7 Å²	41.7	3%	0.03	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	143.9	-177.2	-54.4	89.7	0	0	0	109.9	I201 H204 W219 F220 T222 K230 K238 L239 I487	I201-W232 HydrophobicContact CG2-CD2 4.23Å; I201-W232 HydrophobicContact CG2-CE3 3.61Å; I201-W232 HydrophobicContact CG2-CH2 3.99Å; I201-W232 HydrophobicContact CG2-CZ3 3.48Å; I201-W232 VanDerWaalsContact CG2-CZ3 3.48Å; H204-W232 AromaticContact CD2-CZ2 3.95Å; H204-W232 AromaticContact NE2-CZ2 3.9Å; H204-W232 AromaticContact NE2-NE1 3.88Å; W219-W232 CarbonylContact C-O 3.46Å; W219-W232 WeakPolarHBondContact CA-O 3.26Å; W219-W232 WeakPolarHBondContact CB-O 3.39Å; F220-W232 HydrophobicContact CD1-CB 3.97Å; F220-W232 HydrophobicContact CD2-CB 4.28Å; F220-W232 HydrophobicContact CE1-CB 3.44Å; F220-W232 VanDerWaalsContact CE1-CB 3.44Å; F220-W232 HydrophobicContact CE1-CG 4.32Å; F220-W232 HydrophobicContact CE2-CB 3.79Å; F220-W232 AromaticContact CE2-CD1 3.58Å; F220-W232 AromaticContact CE2-CG 3.83Å; F220-W232 HydrophobicContact CE2-CG 3.83Å; F220-W232 HydrophobicContact CG-CB 4.37Å; F220-W232 HydrophobicContact CZ-CB 3.34Å; F220-W232 AromaticContact CZ-CD1 3.97Å; F220-W232 AromaticContact CZ-CG 3.72Å; F220-W232 HydrophobicContact CZ-CG 3.72Å; F220-W232 PolarHBondContact N-O 3.34Å; F220-W232 PolarHBondContact O-N 3.42Å; T222-W232 PolarHBondContact OG1-NE1 2.77Å; K230-W232 HydrophobicContact CB-CZ2 3.87Å; K230-W232 HydrophobicContact CD-CH2 4.22Å; K230-W232 HydrophobicContact CD-CZ2 3.61Å; K230-W232 HydrophobicContact CG-CZ2 4.37Å; W232-K238 WeakPolarHBondContact CA-O 3.49Å; W232-L239 HydrophobicContact CD2-CD1 4.08Å; W232-L239 HydrophobicContact CE3-CB 3.87Å; W232-L239 HydrophobicContact CE3-CD1 4.08Å; W232-L239 HydrophobicContact CH2-CB 4.34Å; W232-L239 HydrophobicContact CH2-CD1 4.08Å; W232-L239 HydrophobicContact CZ2-CD1 4.08Å; W232-L239 HydrophobicContact CZ3-CB 3.69Å; W232-L239 HydrophobicContact CZ3-CD1 4.08Å; W232-L239 HydrophobicContact CZ3-CG 4.42Å; W232-I487 HydrophobicContact CD2-CD1 4.38Å; W232-I487 HydrophobicContact CZ2-CD1 4.01Å
233	D	96.9	Very high	96.3	Very high	26 Å²	26	42.1 Å²	42.1	14%	0.139	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	127.3	170.2	-170.3	55.9	0	0	0	110.6	S236 G237 K238 K240	D233-S236 WeakPolarHBondContact CB-OG 3.27Å; D233-S236 WeakPolarHBondContact OD2-CB 3.49Å; D233-S236 PolarHBondContact OD2-N 3.23Å; D233-S236 PolarHBondContact OD2-OG 2.96Å; D233-G237 WeakPolarHBondContact O-CA 3.25Å; D233-G237 PolarHBondContact O-N 2.99Å; D233-K238 PolarHBondContact N-O 3.08Å; D233-K240 HydrophobicContact CB-CD 4.23Å; D233-K240 HydrophobicContact CB-CG 4.28Å; D233-K240 WeakPolarHBondContact OD1-CE 3.12Å; D233-K240 IonicContact OD1-NZ 2.84Å; D233-K240 PolarHBondContact OD1-NZ 3.07Å
234	L	94.3	Very high	96.2	Very high	9 Å²	9	47.1 Å²	47.1	5%	0.047	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-38.5	-175.3	-172.6	72.6	0	0	0	111.8	N217 Q218 F220 D472 R477 I479	N217-L234 HydrophobicContact CB-CD2 4.25Å; N217-L234 WeakPolarHBondContact ND2-CD2 3.23Å; N217-L234 VanDerWaalsContact O-CD2 3.23Å; N217-L234 WeakPolarHBondContact O-CD2 3.46Å; N217-L234 WeakPolarHBondContact OD1-CD2 3.37Å; Q218-L234 PolarHBondContact O-N 3.23Å; Q218-L234 VanDerWaalsContact O-N 3.08Å; F220-L234 HydrophobicContact CD1-CB 4.18Å; F220-L234 HydrophobicContact CD1-CD1 3.57Å; F220-L234 HydrophobicContact CD1-CG 4.5Å; F220-L234 HydrophobicContact CE1-CD1 4.15Å; F220-L234 HydrophobicContact CG-CD1 4.34Å; L234-D472 HydrophobicContact CD2-CB 4.18Å; L234-R477 PolarHBondContact O-NH1 3.1Å; L234-I479 HydrophobicContact CD1-CD1 3.48Å; L234-I479 VanDerWaalsContact CD1-CD1 3.48Å; L234-I479 HydrophobicContact CD1-CG1 4.46Å
235	A	93.5	Very high	96	Very high	67 Å²	67	48.7 Å²	48.7	55%	0.554	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-53.7	-178.1	0	0	0	0	0	111.9	R199	R199-A235 PolarHBondContact NH1-O 2.98Å; R199-A235 PolarHBondContact NH2-O 2.99Å
236	S	93.4	Very high	96	Very high	50 Å²	50	47.9 Å²	47.9	35%	0.35	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-22.6	-176.6	69.8	0	0	0	0	114.5	R199 D233 K238	R199-S236 PolarHBondContact NH1-O 2.81Å; D233-S236 WeakPolarHBondContact CB-OG 3.27Å; D233-S236 WeakPolarHBondContact OD2-CB 3.49Å; D233-S236 PolarHBondContact OD2-N 3.23Å; D233-S236 PolarHBondContact OD2-OG 2.96Å; S236-K238 PolarHBondContact O-N 2.81Å; S236-K238 PolarHBondContact OG-N 3.21Å
237	G	93.4	Very high	96	Very high	10 Å²	10	52.2 Å²	52.2	10%	0.103	28%	0.284	C	S	.	.			trans	73.7	11.9	-174.4	0	0	0	0	0	113.8	D233	D233-G237 WeakPolarHBondContact O-CA 3.25Å; D233-G237 PolarHBondContact O-N 2.99Å
238	K	95.8	Very high	96	Very high	151 Å²	151	47.4 Å²	47.4	66%	0.657	27%	0.272	S	S	*	.			trans	-82.5	147.1	179.3	-67.7	-177.4	178.5	-179.6	0	111.4	W232 D233 S236 K240	W232-K238 WeakPolarHBondContact CA-O 3.49Å; D233-K238 PolarHBondContact N-O 3.08Å; S236-K238 PolarHBondContact O-N 2.81Å; S236-K238 PolarHBondContact OG-N 3.21Å; K238-K240 PolarHBondContact O-N 3.03Å
239	L	97.3	Very high	96.1	Very high	82 Å²	82	47.3 Å²	47.3	43%	0.429	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	122.4	172.5	-176.9	64.2	0	0	0	109.7	K230 W232 L241	K230-L239 HydrophobicContact CB-CD1 3.71Å; K230-L239 HydrophobicContact CD-CD1 3.84Å; K230-L239 HydrophobicContact CD-CD2 4.46Å; K230-L239 HydrophobicContact CG-CD1 3.95Å; W232-L239 HydrophobicContact CD2-CD1 4.08Å; W232-L239 HydrophobicContact CE3-CB 3.87Å; W232-L239 HydrophobicContact CE3-CD1 4.08Å; W232-L239 HydrophobicContact CH2-CB 4.34Å; W232-L239 HydrophobicContact CH2-CD1 4.08Å; W232-L239 HydrophobicContact CZ2-CD1 4.08Å; W232-L239 HydrophobicContact CZ3-CB 3.69Å; W232-L239 HydrophobicContact CZ3-CD1 4.08Å; W232-L239 HydrophobicContact CZ3-CG 4.42Å; L239-L241 WeakPolarHBondContact CD1-O 3.33Å
240	K	95.8	Very high	96.1	Very high	110 Å²	110	47.3 Å²	47.3	48%	0.478	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	-49.5	174.1	-78.1	-178.6	166.8	163.1	0	111.5	W219 I231 D233 K238	W219-K240 HydrophobicContact CB-CD 4.39Å; I231-K240 HydrophobicContact CG2-CB 4.45Å; I231-K240 PolarHBondContact O-N 3.31Å; D233-K240 HydrophobicContact CB-CD 4.23Å; D233-K240 HydrophobicContact CB-CG 4.28Å; D233-K240 WeakPolarHBondContact OD1-CE 3.12Å; D233-K240 IonicContact OD1-NZ 2.84Å; D233-K240 PolarHBondContact OD1-NZ 3.07Å; K238-K240 PolarHBondContact O-N 3.03Å
241	L	95.9	Very high	96	Very high	57 Å²	57	47.4 Å²	47.4	30%	0.298	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	148.1	-173.3	-168.9	67.7	0	0	0	111	K230 I231 L239 L243 N279	K230-L241 WeakPolarHBondContact CA-O 3.39Å; I231-L241 HydrophobicContact CB-CB 4.16Å; I231-L241 HydrophobicContact CD1-CB 4.27Å; I231-L241 HydrophobicContact CD1-CD2 4.07Å; I231-L241 HydrophobicContact CG1-CB 4.28Å; I231-L241 PolarHBondContact N-O 3Å; I231-L241 PolarHBondContact O-N 3.49Å; L239-L241 WeakPolarHBondContact CD1-O 3.33Å; L241-L243 HydrophobicContact CD2-CD2 3.51Å; L241-L243 HydrophobicContact CD2-CG 3.95Å; L241-L243 HydrophobicContact CG-CD2 4.12Å; L241-L243 HydrophobicContact CG-CG 4.35Å; L241-N279 HydrophobicContact CD2-CB 3.89Å; L241-N279 VanDerWaalsContact CD2-CG 3.47Å; L241-N279 WeakPolarHBondContact CD2-OD1 3.22Å
242	S	96.4	Very high	95.9	Very high	53 Å²	53	47 Å²	47	37%	0.371	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	109.6	170.7	-173.6	0	0	0	0	108.9
243	L	96.4	Very high	95.9	Very high	9 Å²	9	47.1 Å²	47.1	5%	0.047	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	122.7	177.4	-63.8	174.7	0	0	0	109.5	I229 I231 L241 W274 N279	I229-L243 HydrophobicContact CB-CB 4.15Å; I229-L243 PolarHBondContact N-O 2.99Å; I229-L243 PolarHBondContact O-N 2.96Å; I231-L243 HydrophobicContact CD1-CD1 4.19Å; L241-L243 HydrophobicContact CD2-CD2 3.51Å; L241-L243 HydrophobicContact CD2-CG 3.95Å; L241-L243 HydrophobicContact CG-CD2 4.12Å; L241-L243 HydrophobicContact CG-CG 4.35Å; L243-W274 HydrophobicContact CB-CE3 4.26Å; L243-W274 HydrophobicContact CB-CH2 4.13Å; L243-W274 HydrophobicContact CB-CZ3 3.87Å; L243-W274 HydrophobicContact CD1-CD2 4.26Å; L243-W274 HydrophobicContact CD1-CE3 3.98Å; L243-W274 HydrophobicContact CD1-CZ3 4.43Å; L243-W274 HydrophobicContact CD2-CE3 4.18Å; L243-W274 HydrophobicContact CD2-CZ3 4.17Å; L243-W274 HydrophobicContact CG-CE3 4.38Å; L243-W274 HydrophobicContact CG-CZ3 4.39Å; L243-N279 HydrophobicContact CD2-CB 4.12Å
244	T	95.9	Very high	95.9	Very high	105 Å²	105	46.4 Å²	46.4	64%	0.644	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.9	141	175.8	54.8	0	0	0	0	109.8	T228 W274	T228-T244 HydrophobicContact CG2-CG2 4.13Å; T244-W274 WeakPolarHBondContact O-CH2 3.45Å
245	G	93.6	Very high	96	Very high	33 Å²	33	47.1 Å²	47.1	34%	0.34	27%	0.273	S	S	.	.			trans	167	-25.7	175.8	0	0	0	0	0	114.5	K272	G245-K272 PolarHBondContact O-NZ 2.71Å
246	H	96.6	Very high	96	Very high	12 Å²	12	44.6 Å²	44.6	6%	0.056	25%	0.251	C	S	.	.			trans	-71.2	146.2	171.6	-82.4	-76.8	0	0	0	111.2	V250 S264 D268	H246-V250 HydrophobicContact CB-CG2 3.88Å; H246-S264 WeakPolarHBondContact NE2-CB 3.4Å; H246-S264 PolarHBondContact NE2-OG 3.13Å; H246-D268 WeakPolarHBondContact CA-OD2 3.23Å; H246-D268 IonicContact CE1-OD1 3.46Å; H246-D268 IonicContact CE1-OD2 2.86Å; H246-D268 IonicContact CG-OD2 2.63Å; H246-D268 IonicContact ND1-OD1 2.85Å; H246-D268 PolarHBondContact ND1-OD1 3.3Å; H246-D268 IonicContact ND1-OD2 3.51Å; H246-D268 PolarHBondContact ND1-OD2 2.68Å
247	I	96.8	Very high	95.9	Very high	114 Å²	114	46.3 Å²	46.3	59%	0.585	26%	0.263	S	S	*	.	S	Bend	trans	-90.2	-28.7	-178.3	-56.9	169.4	0	0	0	110.5	R227 D268	R227-I247 WeakPolarHBondContact CD-O 3.44Å; I247-D268 HydrophobicContact CB-CB 4.03Å; I247-D268 PolarHBondContact N-OD2 2.89Å
248	S	97.1	Very high	95.8	Very high	39 Å²	39	52.8 Å²	52.8	27%	0.273	29%	0.285	S	S	.	.	S	Bend	trans	-126.9	-172.8	179.9	-163.8	0	0	0	0	110.8	R227 V250	R227-S248 WeakPolarHBondContact CG-O 3.47Å; S248-V250 PolarHBondContact O-N 3.38Å
249	T	97.3	Very high	95.5	Very high	21 Å²	21	46.8 Å²	46.8	13%	0.129	26%	0.262	C	S	.	.			trans	-57.3	135.8	-177.7	72	0	0	0	0	111.2	A225 G266 E267	A225-T249 HydrophobicContact CB-CG2 3.69Å; T249-G266 CarbonylContact O-C 3.59Å; T249-G266 WeakPolarHBondContact O-CA 3.38Å; T249-E267 PolarHBondContact O-N 3.22Å; T249-E267 WeakPolarHBondContact OG1-CG 3.48Å; T249-E267 PolarHBondContact OG1-OE1 3.18Å; T249-E267 PolarHBondContact OG1-OE2 2.88Å
250	V	97.9	Very high	95.4	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	120.5	174.4	-175	0	0	0	0	107.6	R209 S224 I229 H246 S248 V253	R209-V250 VanDerWaalsContact CB-O 3.31Å; R209-V250 WeakPolarHBondContact CB-O 3.34Å; S224-V250 PolarHBondContact O-N 3.25Å; S224-V250 VanDerWaalsContact O-N 3.15Å; I229-V250 HydrophobicContact CD1-CG1 4.23Å; I229-V250 HydrophobicContact CD1-CG2 4.46Å; I229-V250 HydrophobicContact CG1-CB 4.46Å; I229-V250 HydrophobicContact CG1-CG1 4.04Å; I229-V250 HydrophobicContact CG1-CG2 3.92Å; H246-V250 HydrophobicContact CB-CG2 3.88Å; S248-V250 PolarHBondContact O-N 3.38Å; V250-V253 HydrophobicContact CG1-CG2 3.79Å
251	R	96.8	Very high	95.4	Very high	29 Å²	29	42.9 Å²	42.9	11%	0.109	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	-39.8	-170.4	-67.3	-60.1	-56.8	-86.1	-13.5	113.1	R209 S210 C265 E267 V292 Y293	R209-R251 VanDerWaalsContact CZ-NE 3.33Å; S210-R251 VanDerWaalsContact CB-O 3.31Å; S210-R251 WeakPolarHBondContact CB-O 3.45Å; S210-R251 PolarHBondContact OG-O 2.77Å; R251-C265 PolarHBondContact N-O 2.75Å; R251-E267 WeakPolarHBondContact CD-OE1 3.35Å; R251-E267 HydrophobicContact CG-CG 3.69Å; R251-E267 IonicContact CZ-OE1 3.63Å; R251-E267 IonicContact NE-OE1 2.72Å; R251-E267 IonicContact NH1-OE1 3.63Å; R251-E267 PolarHBondContact NH1-OE1 3.07Å; R251-V292 VanDerWaalsContact CB-O 3.31Å; R251-V292 WeakPolarHBondContact CB-O 3.33Å; R251-V292 WeakPolarHBondContact CG-O 3.45Å; R251-Y293 WeakPolarHBondContact CB-O 3.16Å
252	G	95.8	Very high	95.4	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.01	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	146.1	177.7	0	0	0	0	0	110.6	S264 C265 L295	G252-S264 WeakPolarHBondContact O-CA 3.38Å; G252-C265 VanDerWaalsContact CA-SG 3.58Å; G252-C265 PolarHBondContact N-O 3.34Å; G252-C265 PolarHBondContact N-SG 3.05Å; G252-C265 VanDerWaalsContact N-SG 3.36Å; G252-C265 PolarHBondContact O-N 3.15Å; G252-L295 VanDerWaalsContact C-CD2 3.49Å; G252-L295 VanDerWaalsContact O-CD2 3.28Å; G252-L295 WeakPolarHBondContact O-CD2 3.1Å
253	V	97.2	Very high	95.5	Very high	12 Å²	12	37.6 Å²	37.6	7%	0.073	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	137.7	172.2	177.8	0	0	0	0	107.2	A212 V221 V250 L262 F263	A212-V253 HydrophobicContact CB-CG1 4.09Å; V221-V253 HydrophobicContact CB-CG1 4.06Å; V221-V253 HydrophobicContact CG1-CG1 3.68Å; V250-V253 HydrophobicContact CG1-CG2 3.79Å; V253-L262 HydrophobicContact CG1-CD2 4.13Å; V253-L262 HydrophobicContact CG1-CG 4.2Å; V253-F263 CarbonylContact C-O 3.54Å; V253-F263 VanDerWaalsContact CA-O 3.3Å; V253-F263 WeakPolarHBondContact CA-O 3.42Å
254	A	96.5	Very high	95.6	Very high	11 Å²	11	37.2 Å²	37.2	9%	0.091	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	143.5	169.3	0	0	0	0	0	109.9	F263 L295 L297	A254-F263 PolarHBondContact N-O 2.97Å; A254-F263 PolarHBondContact O-N 3.12Å; A254-L295 HydrophobicContact CB-CD1 3.39Å; A254-L295 HydrophobicContact CB-CG 4.38Å; A254-L297 HydrophobicContact CB-CD1 4.26Å; A254-L297 HydrophobicContact CB-CG 4.41Å
255	V	96.2	Very high	95.6	Very high	23 Å²	23	32.2 Å²	32.2	14%	0.139	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	133.5	173.7	-179.2	0	0	0	0	107.6	A212 W219 V221	A212-V255 HydrophobicContact CB-CG2 4.1Å; W219-V255 HydrophobicContact CH2-CG1 4.04Å; W219-V255 HydrophobicContact CH2-CG2 4.13Å; W219-V255 HydrophobicContact CZ3-CG2 3.89Å; V221-V255 HydrophobicContact CG2-CG2 4.24Å
256	S	94.4	Very high	95.7	Very high	14 Å²	14	30.6 Å²	30.6	10%	0.098	17%	0.166	C	C	.	.			trans	-75.6	136.2	174.7	177.2	0	0	0	0	110.6	R258 S259 Y261 L297	S256-R258 PolarHBondContact OG-N 2.68Å; S256-S259 WeakPolarHBondContact CB-O 3.23Å; S256-S259 WeakPolarHBondContact CB-OG 3.38Å; S256-S259 PolarHBondContact OG-N 3.21Å; S256-S259 PolarHBondContact OG-OG 3.09Å; S256-Y261 PolarHBondContact N-O 3.13Å; S256-L297 VanDerWaalsContact CA-CD1 3.49Å
257	S	91.2	Very high	95.7	Very high	86 Å²	86	33.1 Å²	33.1	60%	0.601	18%	0.177	S	C	*	.	S	Bend	trans	-81.5	-17.7	174.8	57.1	0	0	0	0	113.8
258	R	90.9	Very high	95.6	Very high	146 Å²	146	28.8 Å²	28.8	55%	0.551	16%	0.155	S	C	*	.	S	Bend	trans	-104.2	-33.5	-174.1	-65.4	-179.4	60.3	176.9	-2.5	113.6	S256 T300 D302	S256-R258 PolarHBondContact OG-N 2.68Å; R258-T300 PolarHBondContact NH1-O 2.81Å; R258-D302 IonicContact CZ-OD1 3.86Å; R258-D302 IonicContact NE-OD1 3.89Å; R258-D302 IonicContact NH1-OD1 3.03Å; R258-D302 IonicContact NH2-OD1 2.72Å
259	S	90	Very high	95.6	Very high	26 Å²	26	31.9 Å²	31.9	18%	0.182	16%	0.164	C	C	.	.	S	Bend	trans	-119.6	148.2	-178.1	60.2	0	0	0	0	109.1	S256 Y261	S256-S259 WeakPolarHBondContact CB-O 3.23Å; S256-S259 WeakPolarHBondContact CB-OG 3.38Å; S256-S259 PolarHBondContact OG-N 3.21Å; S256-S259 PolarHBondContact OG-OG 3.09Å; S259-Y261 PolarHBondContact O-N 2.86Å; S259-Y261 VanDerWaalsContact OG-CD2 3.3Å; S259-Y261 WeakPolarHBondContact OG-CD2 3.5Å
260	P	93.9	Very high	95.5	Very high	62 Å²	62	33.5 Å²	33.5	40%	0.403	17%	0.17	S	C	.	.	S	Bend	trans	-74.6	50.1	177.2	33.7	-37.2	0	0	0	112	L276 E277	P260-L276 WeakPolarHBondContact O-CB 3.31Å; P260-L276 PolarHBondContact O-N 3.26Å; P260-L276 VanDerWaalsContact O-N 3.1Å; P260-E277 HydrophobicContact CB-CG 4.5Å
261	Y	96.1	Very high	95.5	Very high	47 Å²	47	33.5 Å²	33.5	18%	0.184	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	141.3	-175.3	-63.6	-29	0	0	0	111.6	S256 S259 W274 D275 I282 R283	S256-Y261 PolarHBondContact N-O 3.13Å; S259-Y261 PolarHBondContact O-N 2.86Å; S259-Y261 VanDerWaalsContact OG-CD2 3.3Å; S259-Y261 WeakPolarHBondContact OG-CD2 3.5Å; Y261-W274 WeakPolarHBondContact CA-O 3.38Å; Y261-D275 HydrophobicContact CE1-CB 4.47Å; Y261-I282 HydrophobicContact CD1-CD1 3.95Å; Y261-I282 HydrophobicContact CE1-CD1 3.46Å; Y261-I282 VanDerWaalsContact CE1-CD1 3.46Å; Y261-R283 PolarHBondContact OH-NH1 3.37Å
262	L	97.1	Very high	95.5	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	132.1	170.5	176.3	167.1	0	0	0	108.4	V221 I229 V253 W274 L276	V221-L262 HydrophobicContact CB-CD1 4.34Å; V221-L262 HydrophobicContact CG1-CD1 3.97Å; V221-L262 HydrophobicContact CG2-CD1 3.58Å; I229-L262 HydrophobicContact CD1-CD2 4.41Å; V253-L262 HydrophobicContact CG1-CD2 4.13Å; V253-L262 HydrophobicContact CG1-CG 4.2Å; L262-W274 HydrophobicContact CB-CB 4.13Å; L262-W274 HydrophobicContact CD2-CB 4.21Å; L262-W274 VanDerWaalsContact CD2-CD1 3.42Å; L262-W274 HydrophobicContact CD2-CG 3.94Å; L262-W274 PolarHBondContact N-O 3.37Å; L262-W274 PolarHBondContact O-N 3.22Å; L262-L276 HydrophobicContact CB-CD1 4.35Å; L262-L276 HydrophobicContact CB-CD2 3.89Å; L262-L276 HydrophobicContact CB-CG 4.14Å; L262-L276 HydrophobicContact CD1-CD2 3.98Å
263	F	97.8	Very high	95.6	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	137.1	177.1	-65.4	-97.1	0	0	0	109.4	V253 A254 K272 C273 Y285 L295 L297 L304 I318	V253-F263 CarbonylContact C-O 3.54Å; V253-F263 VanDerWaalsContact CA-O 3.3Å; V253-F263 WeakPolarHBondContact CA-O 3.42Å; A254-F263 PolarHBondContact N-O 2.97Å; A254-F263 PolarHBondContact O-N 3.12Å; F263-K272 WeakPolarHBondContact CA-O 3.12Å; F263-C273 HydrophobicContact CD1-CB 4.31Å; F263-C273 HydrophobicContact CE1-CB 4.11Å; F263-Y285 AromaticContact CD1-CE2 3.97Å; F263-Y285 HydrophobicContact CD1-CE2 3.97Å; F263-Y285 AromaticContact CE1-CE2 3.84Å; F263-Y285 HydrophobicContact CE1-CE2 3.84Å; F263-Y285 AromaticContact CE1-CZ 3.94Å; F263-Y285 WeakPolarHBondContact CE1-OH 3.35Å; F263-L295 HydrophobicContact CB-CD1 3.65Å; F263-L297 HydrophobicContact CD2-CD1 3.69Å; F263-L297 HydrophobicContact CD2-CD2 3.8Å; F263-L297 HydrophobicContact CD2-CG 4.21Å; F263-L297 HydrophobicContact CE1-CD2 4.45Å; F263-L297 HydrophobicContact CE2-CD1 3.94Å; F263-L297 HydrophobicContact CE2-CD2 3.72Å; F263-L297 HydrophobicContact CE2-CG 4.45Å; F263-L297 HydrophobicContact CG-CD2 4.21Å; F263-L297 HydrophobicContact CZ-CD2 4.06Å; F263-L304 HydrophobicContact CB-CD1 4.4Å; F263-L304 HydrophobicContact CD1-CD1 4.22Å; F263-L304 HydrophobicContact CD1-CD2 3.63Å; F263-L304 HydrophobicContact CD1-CG 4.43Å; F263-L304 HydrophobicContact CE1-CD2 4.05Å; F263-L304 HydrophobicContact CG-CD1 4.34Å; F263-L304 HydrophobicContact CG-CD2 4.48Å; F263-I318 HydrophobicContact CE1-CG1 4.2Å; F263-I318 HydrophobicContact CE1-CG2 4.24Å; F263-I318 HydrophobicContact CZ-CB 4.47Å; F263-I318 HydrophobicContact CZ-CD1 3.87Å; F263-I318 HydrophobicContact CZ-CG1 3.96Å; F263-I318 HydrophobicContact CZ-CG2 3.74Å
264	S	97.6	Very high	95.6	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	145.5	176.7	63.8	0	0	0	0	111	I229 H246 G252 V271 K272 W274 L295	I229-S264 WeakPolarHBondContact CD1-OG 3.38Å; H246-S264 WeakPolarHBondContact NE2-CB 3.4Å; H246-S264 PolarHBondContact NE2-OG 3.13Å; G252-S264 WeakPolarHBondContact O-CA 3.38Å; S264-V271 CarbonylContact O-C 3.54Å; S264-V271 VanDerWaalsContact O-CA 3.3Å; S264-V271 WeakPolarHBondContact O-CA 3.49Å; S264-K272 PolarHBondContact N-O 3.08Å; S264-K272 PolarHBondContact O-N 3.09Å; S264-W274 PolarHBondContact OG-NE1 3.41Å; S264-L295 VanDerWaalsContact C-CD2 3.5Å
265	C	97.1	Very high	95.6	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	150.2	175	79.7	0	0	0	0	110.3	R251 G252 V271 V292 L295	R251-C265 PolarHBondContact N-O 2.75Å; G252-C265 VanDerWaalsContact CA-SG 3.58Å; G252-C265 PolarHBondContact N-O 3.34Å; G252-C265 PolarHBondContact N-SG 3.05Å; G252-C265 VanDerWaalsContact N-SG 3.36Å; G252-C265 PolarHBondContact O-N 3.15Å; C265-V271 HydrophobicContact CB-CG1 4.46Å; C265-V271 HydrophobicContact CB-CG2 3.98Å; C265-V292 HydrophobicContact CB-CB 3.81Å; C265-V292 HydrophobicContact CB-CG1 3.52Å; C265-L295 HydrophobicContact CB-CB 4.37Å; C265-L295 HydrophobicContact CB-CD2 3.55Å; C265-L295 VanDerWaalsContact N-CD2 3.26Å
266	G	95.9	Very high	95.4	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	174.8	-177	0	0	0	0	0	114.5	T249 D268 K269 Q270 V292	T249-G266 CarbonylContact O-C 3.59Å; T249-G266 WeakPolarHBondContact O-CA 3.38Å; G266-D268 PolarHBondContact O-N 2.78Å; G266-K269 PolarHBondContact O-N 3.07Å; G266-Q270 PolarHBondContact N-O 3.37Å; G266-V292 PolarHBondContact O-N 2.97Å; G266-V292 VanDerWaalsContact O-N 3.07Å
267	E	96.6	Very high	95.4	Very high	64 Å²	64	38.6 Å²	38.6	30%	0.299	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-8.7	173.7	-72.4	175.5	176.6	0	0	112.9	R209 T249 R251 K269 A291	R209-E267 IonicContact NH1-OE1 3.69Å; T249-E267 PolarHBondContact O-N 3.22Å; T249-E267 WeakPolarHBondContact OG1-CG 3.48Å; T249-E267 PolarHBondContact OG1-OE1 3.18Å; T249-E267 PolarHBondContact OG1-OE2 2.88Å; R251-E267 WeakPolarHBondContact CD-OE1 3.35Å; R251-E267 HydrophobicContact CG-CG 3.69Å; R251-E267 IonicContact CZ-OE1 3.63Å; R251-E267 IonicContact NE-OE1 2.72Å; R251-E267 IonicContact NH1-OE1 3.63Å; R251-E267 PolarHBondContact NH1-OE1 3.07Å; E267-K269 PolarHBondContact O-N 3.06Å; E267-A291 HydrophobicContact CB-CB 4.03Å; E267-A291 HydrophobicContact CG-CB 3.91Å
268	D	95.2	Very high	95.5	Very high	23 Å²	23	42.1 Å²	42.1	12%	0.123	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	5.9	172.8	62.4	2.2	0	0	0	113.6	H246 I247 G266 Q270	H246-D268 WeakPolarHBondContact CA-OD2 3.23Å; H246-D268 IonicContact CE1-OD1 3.46Å; H246-D268 IonicContact CE1-OD2 2.86Å; H246-D268 IonicContact CG-OD2 2.63Å; H246-D268 IonicContact ND1-OD1 2.85Å; H246-D268 PolarHBondContact ND1-OD1 3.3Å; H246-D268 IonicContact ND1-OD2 3.51Å; H246-D268 PolarHBondContact ND1-OD2 2.68Å; I247-D268 HydrophobicContact CB-CB 4.03Å; I247-D268 PolarHBondContact N-OD2 2.89Å; G266-D268 PolarHBondContact O-N 2.78Å; D268-Q270 PolarHBondContact O-N 3.4Å; D268-Q270 VanDerWaalsContact O-N 3.17Å; D268-Q270 WeakPolarHBondContact OD1-CB 3.47Å; D268-Q270 PolarHBondContact OD1-N 2.77Å
269	K	96	Very high	95.7	Very high	104 Å²	104	38.4 Å²	38.4	45%	0.452	18%	0.183	S	C	.	.	S	Bend	trans	66.2	6.1	-177.9	-37.8	-178.8	-179.3	-171.1	0	113.4	G266 E267 L289 S290	G266-K269 PolarHBondContact O-N 3.07Å; E267-K269 PolarHBondContact O-N 3.06Å; K269-L289 WeakPolarHBondContact CD-O 3.34Å; K269-L289 WeakPolarHBondContact CE-O 3.42Å; K269-L289 PolarHBondContact NZ-O 2.92Å; K269-S290 WeakPolarHBondContact CB-O 3.45Å; K269-S290 WeakPolarHBondContact CG-O 3.47Å
270	Q	95.4	Very high	96	Very high	55 Å²	55	44.2 Å²	44.2	26%	0.257	20%	0.204	S	C	.	.			trans	-97.9	140.3	-178.3	-58.1	-173	13.7	0	0	109.8	G266 D268 K272	G266-Q270 PolarHBondContact N-O 3.37Å; D268-Q270 PolarHBondContact O-N 3.4Å; D268-Q270 VanDerWaalsContact O-N 3.17Å; D268-Q270 WeakPolarHBondContact OD1-CB 3.47Å; D268-Q270 PolarHBondContact OD1-N 2.77Å; Q270-K272 VanDerWaalsContact OE1-NZ 3.13Å
271	V	97.8	Very high	96.1	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	126.3	165.1	-175.4	0	0	0	0	106.8	S264 C265 Y285 V292 L304 T306	S264-V271 CarbonylContact O-C 3.54Å; S264-V271 VanDerWaalsContact O-CA 3.3Å; S264-V271 WeakPolarHBondContact O-CA 3.49Å; C265-V271 HydrophobicContact CB-CG1 4.46Å; C265-V271 HydrophobicContact CB-CG2 3.98Å; V271-Y285 HydrophobicContact CB-CD2 4.14Å; V271-Y285 HydrophobicContact CG1-CD2 3.86Å; V271-Y285 PolarHBondContact O-N 3.39Å; V271-V292 HydrophobicContact CG2-CB 4.43Å; V271-V292 HydrophobicContact CG2-CG1 4.12Å; V271-V292 HydrophobicContact CG2-CG2 3.98Å; V271-L304 HydrophobicContact CG1-CD2 3.75Å; V271-T306 HydrophobicContact CG1-CG2 4.03Å; V271-T306 HydrophobicContact CG2-CG2 3.99Å
272	K	97.4	Very high	96.1	Very high	11 Å²	11	44.1 Å²	44.1	5%	0.048	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	140.2	-173	-62.9	-172.9	-177.5	-160	0	110.2	G245 F263 S264 Q270 W274 V281 R283	G245-K272 PolarHBondContact O-NZ 2.71Å; F263-K272 WeakPolarHBondContact CA-O 3.12Å; S264-K272 PolarHBondContact N-O 3.08Å; S264-K272 PolarHBondContact O-N 3.09Å; Q270-K272 VanDerWaalsContact OE1-NZ 3.13Å; K272-W274 HydrophobicContact CD-CZ2 4.2Å; K272-V281 HydrophobicContact CB-CG1 4.08Å; K272-V281 HydrophobicContact CD-CG1 4.19Å; K272-V281 HydrophobicContact CD-CG2 4.03Å; K272-V281 HydrophobicContact CG-CG1 4.25Å; K272-R283 WeakPolarHBondContact CA-O 3.42Å
273	C	97.4	Very high	96	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	121.5	165.6	-168.7	0	0	0	0	107.8	F263 I282 R283 Y285	F263-C273 HydrophobicContact CD1-CB 4.31Å; F263-C273 HydrophobicContact CE1-CB 4.11Å; C273-I282 HydrophobicContact CB-CG1 4.17Å; C273-I282 WeakPolarHBondContact O-CG1 3.27Å; C273-I282 PolarHBondContact O-N 2.58Å; C273-R283 HydrophobicContact CB-CB 3.78Å; C273-R283 HydrophobicContact CB-CG 4.4Å; C273-R283 PolarHBondContact N-O 3.47Å; C273-R283 PolarHBondContact O-N 3.27Å; C273-Y285 HydrophobicContact CB-CE2 3.95Å
274	W	97.5	Very high	95.9	Very high	6 Å²	6	51.6 Å²	51.6	2%	0.023	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	132.2	175.2	-57.9	79.7	0	0	0	108.4	I229 L243 T244 Y261 L262 S264 K272 K280 V281	I229-W274 HydrophobicContact CD1-CZ2 4.08Å; L243-W274 HydrophobicContact CB-CE3 4.26Å; L243-W274 HydrophobicContact CB-CH2 4.13Å; L243-W274 HydrophobicContact CB-CZ3 3.87Å; L243-W274 HydrophobicContact CD1-CD2 4.26Å; L243-W274 HydrophobicContact CD1-CE3 3.98Å; L243-W274 HydrophobicContact CD1-CZ3 4.43Å; L243-W274 HydrophobicContact CD2-CE3 4.18Å; L243-W274 HydrophobicContact CD2-CZ3 4.17Å; L243-W274 HydrophobicContact CG-CE3 4.38Å; L243-W274 HydrophobicContact CG-CZ3 4.39Å; T244-W274 WeakPolarHBondContact O-CH2 3.45Å; Y261-W274 WeakPolarHBondContact CA-O 3.38Å; L262-W274 HydrophobicContact CB-CB 4.13Å; L262-W274 HydrophobicContact CD2-CB 4.21Å; L262-W274 VanDerWaalsContact CD2-CD1 3.42Å; L262-W274 HydrophobicContact CD2-CG 3.94Å; L262-W274 PolarHBondContact N-O 3.37Å; L262-W274 PolarHBondContact O-N 3.22Å; S264-W274 PolarHBondContact OG-NE1 3.41Å; K272-W274 HydrophobicContact CD-CZ2 4.2Å; W274-K280 WeakPolarHBondContact CA-O 3.45Å; W274-V281 HydrophobicContact CD2-CG2 3.73Å; W274-V281 HydrophobicContact CE3-CG2 3.56Å; W274-V281 HydrophobicContact CH2-CG2 3.45Å; W274-V281 VanDerWaalsContact CH2-CG2 3.45Å; W274-V281 HydrophobicContact CZ2-CG2 3.61Å; W274-V281 HydrophobicContact CZ3-CG2 3.42Å; W274-V281 VanDerWaalsContact CZ3-CG2 3.42Å
275	D	96.2	Very high	95.9	Very high	13 Å²	13	51.7 Å²	51.7	7%	0.07	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	121.8	166.9	-158.3	-40.9	0	0	0	108.7	Y261 E277 Y278 N279 K280 I282	Y261-D275 HydrophobicContact CE1-CB 4.47Å; D275-E277 VanDerWaalsContact C-N 3.3Å; D275-E277 WeakPolarHBondContact OD1-CB 3.46Å; D275-E277 PolarHBondContact OD1-N 3.27Å; D275-Y278 HydrophobicContact CB-CD2 4.08Å; D275-Y278 WeakPolarHBondContact OD2-CD2 3.36Å; D275-N279 WeakPolarHBondContact O-CA 3.3Å; D275-N279 PolarHBondContact O-N 2.78Å; D275-K280 PolarHBondContact N-O 2.9Å; D275-K280 PolarHBondContact O-N 2.93Å; D275-I282 HydrophobicContact CB-CD1 4Å; D275-I282 HydrophobicContact CB-CG1 4.29Å; D275-I282 HydrophobicContact CB-CG2 3.72Å
276	L	92.4	Very high	95.8	Very high	34 Å²	34	59.5 Å²	59.5	18%	0.178	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-20.3	-179.3	-67.8	168.3	0	0	0	112.2	W219 I231 P260 L262 N279	W219-L276 HydrophobicContact CH2-CD1 3.58Å; W219-L276 HydrophobicContact CH2-CD2 4.05Å; W219-L276 HydrophobicContact CH2-CG 4.47Å; W219-L276 HydrophobicContact CZ2-CD1 3.8Å; W219-L276 HydrophobicContact CZ2-CD2 4.38Å; I231-L276 HydrophobicContact CD1-CD2 4.28Å; P260-L276 WeakPolarHBondContact O-CB 3.31Å; P260-L276 PolarHBondContact O-N 3.26Å; P260-L276 VanDerWaalsContact O-N 3.1Å; L262-L276 HydrophobicContact CB-CD1 4.35Å; L262-L276 HydrophobicContact CB-CD2 3.89Å; L262-L276 HydrophobicContact CB-CG 4.14Å; L262-L276 HydrophobicContact CD1-CD2 3.98Å; L276-N279 PolarHBondContact O-OD1 2.98Å
277	E	93.6	Very high	95.7	Very high	134 Å²	134	60.9 Å²	60.9	63%	0.626	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-44.3	176	-62.2	-176.2	176.1	0	0	110.7	P260 D275	P260-E277 HydrophobicContact CB-CG 4.5Å; D275-E277 VanDerWaalsContact C-N 3.3Å; D275-E277 WeakPolarHBondContact OD1-CB 3.46Å; D275-E277 PolarHBondContact OD1-N 3.27Å
278	Y	94	Very high	95.7	Very high	160 Å²	160	58.2 Å²	58.2	63%	0.627	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.5	-11.8	-179.8	-58.2	-65.5	0	0	0	114.1	D275 K280	D275-Y278 HydrophobicContact CB-CD2 4.08Å; D275-Y278 WeakPolarHBondContact OD2-CD2 3.36Å; Y278-K280 PolarHBondContact O-N 3.17Å
279	N	95.3	Very high	95.8	Very high	68 Å²	68	62.8 Å²	62.8	36%	0.364	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.9	35.7	-174.9	-64.7	-61.2	0	0	0	113.6	L241 L243 D275 L276	L241-N279 HydrophobicContact CD2-CB 3.89Å; L241-N279 VanDerWaalsContact CD2-CG 3.47Å; L241-N279 WeakPolarHBondContact CD2-OD1 3.22Å; L243-N279 HydrophobicContact CD2-CB 4.12Å; D275-N279 WeakPolarHBondContact O-CA 3.3Å; D275-N279 PolarHBondContact O-N 2.78Å; L276-N279 PolarHBondContact O-OD1 2.98Å
280	K	95.1	Very high	95.8	Very high	147 Å²	147	59.2 Å²	59.2	64%	0.639	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.2	154.5	-177	-73.5	177.3	-175.3	178.8	0	111.2	W274 D275 Y278 I282	W274-K280 WeakPolarHBondContact CA-O 3.45Å; D275-K280 PolarHBondContact N-O 2.9Å; D275-K280 PolarHBondContact O-N 2.93Å; Y278-K280 PolarHBondContact O-N 3.17Å; K280-I282 PolarHBondContact O-N 2.82Å
281	V	96.9	Very high	95.9	Very high	43 Å²	43	57.1 Å²	57.1	26%	0.261	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	123.9	170.8	-175.1	0	0	0	0	108.7	K272 W274	K272-V281 HydrophobicContact CB-CG1 4.08Å; K272-V281 HydrophobicContact CD-CG1 4.19Å; K272-V281 HydrophobicContact CD-CG2 4.03Å; K272-V281 HydrophobicContact CG-CG1 4.25Å; W274-V281 HydrophobicContact CD2-CG2 3.73Å; W274-V281 HydrophobicContact CE3-CG2 3.56Å; W274-V281 HydrophobicContact CH2-CG2 3.45Å; W274-V281 VanDerWaalsContact CH2-CG2 3.45Å; W274-V281 HydrophobicContact CZ2-CG2 3.61Å; W274-V281 HydrophobicContact CZ3-CG2 3.42Å; W274-V281 VanDerWaalsContact CZ3-CG2 3.42Å
282	I	96.1	Very high	95.9	Very high	64 Å²	64	57.1 Å²	57.1	33%	0.328	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	-28.7	179.6	53	167.8	0	0	0	112.6	Y261 C273 D275 K280	Y261-I282 HydrophobicContact CD1-CD1 3.95Å; Y261-I282 HydrophobicContact CE1-CD1 3.46Å; Y261-I282 VanDerWaalsContact CE1-CD1 3.46Å; C273-I282 HydrophobicContact CB-CG1 4.17Å; C273-I282 WeakPolarHBondContact O-CG1 3.27Å; C273-I282 PolarHBondContact O-N 2.58Å; D275-I282 HydrophobicContact CB-CD1 4Å; D275-I282 HydrophobicContact CB-CG1 4.29Å; D275-I282 HydrophobicContact CB-CG2 3.72Å; K280-I282 PolarHBondContact O-N 2.82Å
283	R	95.4	Very high	95.8	Very high	57 Å²	57	58.8 Å²	58.8	22%	0.215	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	142.5	-178.1	-54.9	177.8	-177.6	92.5	7.2	111	Y261 K272 C273 I318 K321	Y261-R283 PolarHBondContact OH-NH1 3.37Å; K272-R283 WeakPolarHBondContact CA-O 3.42Å; C273-R283 HydrophobicContact CB-CB 3.78Å; C273-R283 HydrophobicContact CB-CG 4.4Å; C273-R283 PolarHBondContact N-O 3.47Å; C273-R283 PolarHBondContact O-N 3.27Å; R283-I318 WeakPolarHBondContact CD-O 3.37Å; R283-K321 HydrophobicContact CB-CD 4Å; R283-K321 HydrophobicContact CB-CG 4.11Å; R283-K321 HydrophobicContact CG-CD 4.15Å; R283-K321 HydrophobicContact CG-CG 4.3Å
284	H	96.1	Very high	95.8	Very high	100 Å²	100	60 Å²	60	46%	0.463	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	124.7	170.3	-62.9	-91.6	0	0	0	108.2
285	Y	96.6	Very high	95.8	Very high	2 Å²	2	59.9 Å²	59.9	1%	0.008	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	112.1	171	-50.1	-87	0	0	0	108.2	F263 V271 C273 L304 W316 I318 K321	F263-Y285 AromaticContact CD1-CE2 3.97Å; F263-Y285 HydrophobicContact CD1-CE2 3.97Å; F263-Y285 AromaticContact CE1-CE2 3.84Å; F263-Y285 HydrophobicContact CE1-CE2 3.84Å; F263-Y285 AromaticContact CE1-CZ 3.94Å; F263-Y285 WeakPolarHBondContact CE1-OH 3.35Å; V271-Y285 HydrophobicContact CB-CD2 4.14Å; V271-Y285 HydrophobicContact CG1-CD2 3.86Å; V271-Y285 PolarHBondContact O-N 3.39Å; C273-Y285 HydrophobicContact CB-CE2 3.95Å; Y285-L304 HydrophobicContact CD2-CD2 4.06Å; Y285-L304 HydrophobicContact CE2-CD2 3.97Å; Y285-W316 HydrophobicContact CD1-CB 4.02Å; Y285-W316 HydrophobicContact CD1-CD2 4.33Å; Y285-W316 HydrophobicContact CD1-CE3 4.25Å; Y285-W316 HydrophobicContact CD1-CG 4.25Å; Y285-W316 HydrophobicContact CE1-CB 4.39Å; Y285-W316 HydrophobicContact CG-CD2 4.46Å; Y285-W316 HydrophobicContact CG-CG 4.48Å; Y285-I318 PolarHBondContact OH-O 3.08Å; Y285-I318 VanDerWaalsContact OH-O 3.06Å; Y285-K321 HydrophobicContact CD1-CB 3.82Å; Y285-K321 HydrophobicContact CD1-CG 4.25Å; Y285-K321 HydrophobicContact CE1-CB 3.95Å; Y285-K321 HydrophobicContact CE1-CG 3.98Å
286	H	94.9	Very high	95.8	Very high	165 Å²	165	60.9 Å²	60.9	76%	0.764	30%	0.297	S	S	*	.			trans	-110.4	137.8	-176.5	-176	76.4	0	0	0	110.7	W316	H286-W316 VanDerWaalsContact O-CH2 3.24Å; H286-W316 WeakPolarHBondContact O-CH2 3.31Å; H286-W316 WeakPolarHBondContact O-CZ3 3.24Å
287	G	93.8	Very high	96	Very high	28 Å²	28	60.3 Å²	60.3	29%	0.289	29%	0.294	S	S	.	.			trans	148	-9.3	176.6	0	0	0	0	0	114.5	R314	G287-R314 PolarHBondContact O-NE 2.9Å; G287-R314 PolarHBondContact O-NH2 2.85Å
288	H	96.8	Very high	96.1	Very high	9 Å²	9	54.3 Å²	54.3	4%	0.042	27%	0.266	C	S	.	.			trans	-70.4	132.3	169.2	-75.7	-67.3	0	0	0	111.7	V292 T306 S308 D310 R314 W316	H288-V292 HydrophobicContact CB-CG2 3.9Å; H288-V292 VanDerWaalsContact CD2-CG2 3.46Å; H288-V292 WeakPolarHBondContact CD2-CG2 3.14Å; H288-T306 PolarHBondContact CE1-OG1 3.14Å; H288-T306 VanDerWaalsContact CE1-OG1 3.28Å; H288-T306 WeakPolarHBondContact NE2-CB 3.24Å; H288-T306 PolarHBondContact NE2-OG1 2.91Å; H288-S308 VanDerWaalsContact ND1-CB 3.27Å; H288-S308 WeakPolarHBondContact ND1-CB 3.32Å; H288-D310 IonicContact ND1-OD2 3.86Å; H288-R314 PolarHBondContact ND1-NH1 3.47Å; H288-W316 AromaticContact CD2-CZ2 3.8Å; H288-W316 AromaticContact NE2-CZ2 3.77Å; H288-W316 AromaticContact NE2-NE1 3.75Å
289	L	96.1	Very high	96.1	Very high	118 Å²	118	49.6 Å²	49.6	62%	0.618	26%	0.255	S	S	*	.	S	Bend	trans	-83.3	-21.9	-178.5	-70.1	86.4	0	0	0	111.9	K269 D310	K269-L289 WeakPolarHBondContact CD-O 3.34Å; K269-L289 WeakPolarHBondContact CE-O 3.42Å; K269-L289 PolarHBondContact NZ-O 2.92Å; L289-D310 HydrophobicContact CB-CB 4.05Å; L289-D310 PolarHBondContact N-OD2 2.62Å
290	S	97	Very high	96	Very high	29 Å²	29	50 Å²	50	20%	0.203	26%	0.26	C	S	.	.	S	Bend	trans	-139.5	-174.8	-176.4	-159.1	0	0	0	0	111.9	K269 S308 R309	K269-S290 WeakPolarHBondContact CB-O 3.45Å; K269-S290 WeakPolarHBondContact CG-O 3.47Å; S290-S308 PolarHBondContact O-OG 2.85Å; S290-R309 WeakPolarHBondContact OG-CG 3.42Å
291	A	96.8	Very high	96	Very high	11 Å²	11	46.5 Å²	46.5	9%	0.091	25%	0.247	C	C	.	.			trans	-56.1	135.4	-179.9	0	0	0	0	0	111.9	E267 Y293 S308 R309	E267-A291 HydrophobicContact CB-CB 4.03Å; E267-A291 HydrophobicContact CG-CB 3.91Å; A291-Y293 HydrophobicContact CB-CD2 4.49Å; A291-Y293 HydrophobicContact CB-CE2 4.07Å; A291-S308 WeakPolarHBondContact O-CA 3.17Å; A291-S308 PolarHBondContact O-OG 3.34Å; A291-R309 HydrophobicContact CB-CB 4.35Å; A291-R309 WeakPolarHBondContact O-CB 3.43Å; A291-R309 PolarHBondContact O-N 3.24Å
292	V	97.9	Very high	95.8	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	128	175.9	-168.8	0	0	0	0	108.3	R251 C265 G266 V271 H288 C307	R251-V292 VanDerWaalsContact CB-O 3.31Å; R251-V292 WeakPolarHBondContact CB-O 3.33Å; R251-V292 WeakPolarHBondContact CG-O 3.45Å; C265-V292 HydrophobicContact CB-CB 3.81Å; C265-V292 HydrophobicContact CB-CG1 3.52Å; G266-V292 PolarHBondContact O-N 2.97Å; G266-V292 VanDerWaalsContact O-N 3.07Å; V271-V292 HydrophobicContact CG2-CB 4.43Å; V271-V292 HydrophobicContact CG2-CG1 4.12Å; V271-V292 HydrophobicContact CG2-CG2 3.98Å; H288-V292 HydrophobicContact CB-CG2 3.9Å; H288-V292 VanDerWaalsContact CD2-CG2 3.46Å; H288-V292 WeakPolarHBondContact CD2-CG2 3.14Å; V292-C307 CarbonylContact C-O 2.97Å; V292-C307 WeakPolarHBondContact CA-O 3.3Å; V292-C307 WeakPolarHBondContact CG1-O 3.02Å
293	Y	96.8	Very high	95.8	Very high	46 Å²	46	46 Å²	46	18%	0.18	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	-41.5	-170.7	-89	-116.2	0	0	0	112.8	R251 A291 C307 R309	R251-Y293 WeakPolarHBondContact CB-O 3.16Å; A291-Y293 HydrophobicContact CB-CD2 4.49Å; A291-Y293 HydrophobicContact CB-CE2 4.07Å; Y293-C307 PolarHBondContact N-O 2.96Å; Y293-R309 HydrophobicContact CD2-CB 4.18Å; Y293-R309 HydrophobicContact CE2-CB 3.71Å
294	D	96.5	Very high	95.9	Very high	25 Å²	25	43.3 Å²	43.3	13%	0.134	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	158.4	-176	-161.5	11.9	0	0	0	109.4	C307 T336 V337 R338	D294-C307 HydrophobicContact CB-CB 4.46Å; D294-C307 PolarHBondContact O-N 3.44Å; D294-T336 VanDerWaalsContact OD2-CA 3.3Å; D294-T336 WeakPolarHBondContact OD2-CA 3.33Å; D294-T336 PolarHBondContact OD2-OG1 2.88Å; D294-V337 HydrophobicContact CB-CG1 4.43Å; D294-V337 PolarHBondContact OD2-N 2.86Å; D294-V337 VanDerWaalsContact OD2-N 3.17Å; D294-R338 IonicContact OD1-NH1 3.97Å; D294-R338 IonicContact OD2-CZ 3.06Å; D294-R338 IonicContact OD2-NH1 3.49Å; D294-R338 PolarHBondContact OD2-NH1 3.01Å
295	L	96.8	Very high	96	Very high	4 Å²	4	38.6 Å²	38.6	2%	0.021	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	144.8	176.3	76.4	100.6	0	0	0	109	G252 A254 F263 S264 C265 L304 V305 T306	G252-L295 VanDerWaalsContact C-CD2 3.49Å; G252-L295 VanDerWaalsContact O-CD2 3.28Å; G252-L295 WeakPolarHBondContact O-CD2 3.1Å; A254-L295 HydrophobicContact CB-CD1 3.39Å; A254-L295 HydrophobicContact CB-CG 4.38Å; F263-L295 HydrophobicContact CB-CD1 3.65Å; S264-L295 VanDerWaalsContact C-CD2 3.5Å; C265-L295 HydrophobicContact CB-CB 4.37Å; C265-L295 HydrophobicContact CB-CD2 3.55Å; C265-L295 VanDerWaalsContact N-CD2 3.26Å; L295-L304 HydrophobicContact CB-CD1 4.36Å; L295-L304 HydrophobicContact CD1-CD1 3.73Å; L295-V305 CarbonylContact C-O 3.6Å; L295-V305 WeakPolarHBondContact CA-O 3.3Å; L295-T306 HydrophobicContact CB-CG2 4.04Å
296	D	97.1	Very high	96	Very high	35 Å²	35	38.5 Å²	38.5	19%	0.187	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	148.1	174.6	-163.8	15.7	0	0	0	110.7	V305 V337 R338 C339	D296-V305 PolarHBondContact N-O 2.8Å; D296-V305 PolarHBondContact O-N 3.27Å; D296-V337 HydrophobicContact CB-CG1 4.13Å; D296-R338 VanDerWaalsContact OD2-CA 3.24Å; D296-R338 WeakPolarHBondContact OD2-CA 3.49Å; D296-C339 PolarHBondContact OD2-N 3.44Å
297	L	96.4	Very high	96.1	Very high	21 Å²	21	30.7 Å²	30.7	11%	0.11	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	139	-179.2	-70.6	168.4	0	0	0	109.6	A254 S256 F263 L304 I318	A254-L297 HydrophobicContact CB-CD1 4.26Å; A254-L297 HydrophobicContact CB-CG 4.41Å; S256-L297 VanDerWaalsContact CA-CD1 3.49Å; F263-L297 HydrophobicContact CD2-CD1 3.69Å; F263-L297 HydrophobicContact CD2-CD2 3.8Å; F263-L297 HydrophobicContact CD2-CG 4.21Å; F263-L297 HydrophobicContact CE1-CD2 4.45Å; F263-L297 HydrophobicContact CE2-CD1 3.94Å; F263-L297 HydrophobicContact CE2-CD2 3.72Å; F263-L297 HydrophobicContact CE2-CG 4.45Å; F263-L297 HydrophobicContact CG-CD2 4.21Å; F263-L297 HydrophobicContact CZ-CD2 4.06Å; L297-L304 HydrophobicContact CD2-CB 4.02Å; L297-L304 HydrophobicContact CD2-CD1 3.57Å; L297-L304 HydrophobicContact CD2-CG 4.38Å; L297-L304 HydrophobicContact CG-CD1 4.16Å; L297-I318 HydrophobicContact CD2-CD1 3.88Å
298	H	96.1	Very high	96.3	Very high	9 Å²	9	29.3 Å²	29.3	4%	0.042	16%	0.162	C	C	.	.			trans	-72.2	130.8	171.4	-168.5	-88.1	0	0	0	109.8	T300 I301 V303 C339 Q340	H298-T300 PolarHBondContact CE1-OG1 2.79Å; H298-T300 PolarHBondContact ND1-N 2.72Å; H298-T300 PolarHBondContact ND1-OG1 3.01Å; H298-T300 PolarHBondContact O-N 2.97Å; H298-I301 HydrophobicContact CB-CB 4.46Å; H298-I301 WeakPolarHBondContact CB-O 3.34Å; H298-I301 VanDerWaalsContact CE1-CD1 3.45Å; H298-I301 WeakPolarHBondContact CE1-CD1 3.49Å; H298-I301 VanDerWaalsContact CE1-CG1 3.47Å; H298-I301 WeakPolarHBondContact CE1-CG1 3.25Å; H298-I301 VanDerWaalsContact ND1-CB 3.33Å; H298-I301 WeakPolarHBondContact ND1-CB 3.19Å; H298-I301 WeakPolarHBondContact ND1-CG1 3.21Å; H298-I301 PolarHBondContact ND1-N 2.92Å; H298-V303 HydrophobicContact CB-CB 4.36Å; H298-V303 PolarHBondContact N-O 3.02Å; H298-C339 HydrophobicContact CB-CB 4.47Å; H298-Q340 PolarHBondContact NE2-O 2.87Å; H298-Q340 VanDerWaalsContact NE2-O 3.07Å
299	P	93.3	Very high	96.3	Very high	60 Å²	60	35.9 Å²	35.9	39%	0.39	19%	0.187	S	C	.	.	S	Bend	trans	-70.4	-28.7	-170.8	25.1	-34.7	0	0	0	113.8	A341	P299-A341 HydrophobicContact CG-CB 4.1Å
300	T	93.9	Very high	96.3	Very high	78 Å²	78	32.2 Å²	32.2	48%	0.479	17%	0.168	S	C	.	.	S	Bend	trans	-114.6	-10.5	-174.4	57	0	0	0	0	114.6	R258 H298 A341	R258-T300 PolarHBondContact NH1-O 2.81Å; H298-T300 PolarHBondContact CE1-OG1 2.79Å; H298-T300 PolarHBondContact ND1-N 2.72Å; H298-T300 PolarHBondContact ND1-OG1 3.01Å; H298-T300 PolarHBondContact O-N 2.97Å; T300-A341 HydrophobicContact CG2-CB 3.65Å
301	I	94.3	Very high	96.2	Very high	72 Å²	72	31.8 Å²	31.8	37%	0.369	17%	0.166	S	C	.	.	S	Bend	trans	-126.7	138.6	-176.5	-54.7	170.4	0	0	0	105.6	H298 V303 L360	H298-I301 HydrophobicContact CB-CB 4.46Å; H298-I301 WeakPolarHBondContact CB-O 3.34Å; H298-I301 VanDerWaalsContact CE1-CD1 3.45Å; H298-I301 WeakPolarHBondContact CE1-CD1 3.49Å; H298-I301 VanDerWaalsContact CE1-CG1 3.47Å; H298-I301 WeakPolarHBondContact CE1-CG1 3.25Å; H298-I301 VanDerWaalsContact ND1-CB 3.33Å; H298-I301 WeakPolarHBondContact ND1-CB 3.19Å; H298-I301 WeakPolarHBondContact ND1-CG1 3.21Å; H298-I301 PolarHBondContact ND1-N 2.92Å; I301-V303 HydrophobicContact CG2-CB 4.22Å; I301-V303 HydrophobicContact CG2-CG2 3.66Å; I301-V303 PolarHBondContact O-N 2.79Å; I301-L360 HydrophobicContact CD1-CD2 4.5Å
302	D	93.9	Very high	96.2	Very high	79 Å²	79	31.5 Å²	31.5	42%	0.422	16%	0.163	S	C	.	.	S	Bend	trans	-77.8	60.1	-178.4	-62.5	-27.7	0	0	0	111.3	R258 I318	R258-D302 IonicContact CZ-OD1 3.86Å; R258-D302 IonicContact NE-OD1 3.89Å; R258-D302 IonicContact NH1-OD1 3.03Å; R258-D302 IonicContact NH2-OD1 2.72Å; D302-I318 VanDerWaalsContact C-CD1 3.44Å; D302-I318 HydrophobicContact CB-CD1 4.21Å; D302-I318 WeakPolarHBondContact O-CB 3.48Å; D302-I318 WeakPolarHBondContact O-CG1 3.38Å; D302-I318 PolarHBondContact O-N 2.92Å
303	V	95.7	Very high	96.2	Very high	19 Å²	19	31.5 Å²	31.5	12%	0.115	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	136.2	-177.2	165.1	0	0	0	0	109	H298 I301 V305 V315 W316	H298-V303 HydrophobicContact CB-CB 4.36Å; H298-V303 PolarHBondContact N-O 3.02Å; I301-V303 HydrophobicContact CG2-CB 4.22Å; I301-V303 HydrophobicContact CG2-CG2 3.66Å; I301-V303 PolarHBondContact O-N 2.79Å; V303-V305 HydrophobicContact CG1-CG2 4.35Å; V303-V315 HydrophobicContact CG1-CG1 3.27Å; V303-W316 VanDerWaalsContact CA-O 3.32Å; V303-W316 WeakPolarHBondContact CA-O 3.13Å
304	L	97.2	Very high	96.2	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	129.6	176.1	171.1	70.7	0	0	0	109.2	F263 V271 Y285 L295 L297 T306 W316 I318	F263-L304 HydrophobicContact CB-CD1 4.4Å; F263-L304 HydrophobicContact CD1-CD1 4.22Å; F263-L304 HydrophobicContact CD1-CD2 3.63Å; F263-L304 HydrophobicContact CD1-CG 4.43Å; F263-L304 HydrophobicContact CE1-CD2 4.05Å; F263-L304 HydrophobicContact CG-CD1 4.34Å; F263-L304 HydrophobicContact CG-CD2 4.48Å; V271-L304 HydrophobicContact CG1-CD2 3.75Å; Y285-L304 HydrophobicContact CD2-CD2 4.06Å; Y285-L304 HydrophobicContact CE2-CD2 3.97Å; L295-L304 HydrophobicContact CB-CD1 4.36Å; L295-L304 HydrophobicContact CD1-CD1 3.73Å; L297-L304 HydrophobicContact CD2-CB 4.02Å; L297-L304 HydrophobicContact CD2-CD1 3.57Å; L297-L304 HydrophobicContact CD2-CG 4.38Å; L297-L304 HydrophobicContact CG-CD1 4.16Å; L304-T306 HydrophobicContact CD1-CG2 4.42Å; L304-T306 HydrophobicContact CD2-CG2 4.05Å; L304-T306 HydrophobicContact CG-CG2 3.97Å; L304-W316 HydrophobicContact CB-CB 4.31Å; L304-W316 PolarHBondContact N-O 3.17Å; L304-W316 PolarHBondContact O-N 2.98Å; L304-I318 HydrophobicContact CB-CG1 4.12Å
305	V	97.8	Very high	96.3	Very high	1 Å²	1	29.1 Å²	29.1	1%	0.006	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	138.8	173.1	-168.9	0	0	0	0	109.6	L295 D296 V303 R314 V315 V337 C339 V346	L295-V305 CarbonylContact C-O 3.6Å; L295-V305 WeakPolarHBondContact CA-O 3.3Å; D296-V305 PolarHBondContact N-O 2.8Å; D296-V305 PolarHBondContact O-N 3.27Å; V303-V305 HydrophobicContact CG1-CG2 4.35Å; V305-R314 CarbonylContact C-O 3.57Å; V305-R314 WeakPolarHBondContact CA-O 3.26Å; V305-V315 HydrophobicContact CG1-CG2 4.41Å; V305-V315 HydrophobicContact CG2-CG2 4.25Å; V305-V337 HydrophobicContact CB-CG2 4.12Å; V305-V337 HydrophobicContact CG1-CG2 3.74Å; V305-C339 WeakPolarHBondContact CG2-SG 3.34Å; V305-V346 HydrophobicContact CG1-CG1 4.01Å; V305-V346 HydrophobicContact CG2-CG2 3.97Å
306	T	97.8	Very high	96.3	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	143	-173.8	52.4	0	0	0	0	110.1	V271 H288 L295 L304 A313 R314 W316	V271-T306 HydrophobicContact CG1-CG2 4.03Å; V271-T306 HydrophobicContact CG2-CG2 3.99Å; H288-T306 PolarHBondContact CE1-OG1 3.14Å; H288-T306 VanDerWaalsContact CE1-OG1 3.28Å; H288-T306 WeakPolarHBondContact NE2-CB 3.24Å; H288-T306 PolarHBondContact NE2-OG1 2.91Å; L295-T306 HydrophobicContact CB-CG2 4.04Å; L304-T306 HydrophobicContact CD1-CG2 4.42Å; L304-T306 HydrophobicContact CD2-CG2 4.05Å; L304-T306 HydrophobicContact CG-CG2 3.97Å; T306-A313 CarbonylContact O-C 3.56Å; T306-A313 WeakPolarHBondContact O-CA 3.39Å; T306-R314 PolarHBondContact N-O 2.84Å; T306-R314 PolarHBondContact O-N 3.47Å; T306-R314 PolarHBondContact OG1-O 3.05Å; T306-R314 VanDerWaalsContact OG1-O 3.1Å; T306-W316 PolarHBondContact OG1-NE1 3.09Å
307	C	96.7	Very high	96.3	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	137.3	-179.5	-78.2	0	0	0	0	111.9	V292 Y293 D294 V334 V337	V292-C307 CarbonylContact C-O 2.97Å; V292-C307 WeakPolarHBondContact CA-O 3.3Å; V292-C307 WeakPolarHBondContact CG1-O 3.02Å; Y293-C307 PolarHBondContact N-O 2.96Å; D294-C307 HydrophobicContact CB-CB 4.46Å; D294-C307 PolarHBondContact O-N 3.44Å; C307-V334 HydrophobicContact CB-CB 3.92Å; C307-V334 HydrophobicContact CB-CG1 3.82Å; C307-V334 WeakPolarHBondContact SG-CG1 3.3Å; C307-V337 HydrophobicContact CB-CG1 4.34Å; C307-V337 WeakPolarHBondContact SG-CB 3.36Å; C307-V337 VanDerWaalsContact SG-CG1 3.57Å
308	S	97.1	Very high	96.2	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	159.6	-173.1	174.4	0	0	0	0	113.1	H288 S290 A291 D310 A311 S312 V334	H288-S308 VanDerWaalsContact ND1-CB 3.27Å; H288-S308 WeakPolarHBondContact ND1-CB 3.32Å; S290-S308 PolarHBondContact O-OG 2.85Å; A291-S308 WeakPolarHBondContact O-CA 3.17Å; A291-S308 PolarHBondContact O-OG 3.34Å; S308-D310 WeakPolarHBondContact CB-OD1 3.3Å; S308-D310 PolarHBondContact O-N 3.3Å; S308-D310 PolarHBondContact OG-N 2.58Å; S308-D310 PolarHBondContact OG-OD1 2.74Å; S308-D310 VanDerWaalsContact OG-OD1 3.14Å; S308-D310 PolarHBondContact OG-OD2 3.36Å; S308-A311 PolarHBondContact O-N 2.86Å; S308-S312 PolarHBondContact N-O 3.05Å; S308-S312 VanDerWaalsContact N-O 3.16Å; S308-V334 PolarHBondContact O-N 3.39Å; S308-V334 VanDerWaalsContact O-N 3.11Å
309	R	97.1	Very high	96	Very high	146 Å²	146	37.6 Å²	37.6	55%	0.551	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-12.4	170.5	170.2	161.9	-163.1	-156.7	3.6	113.1	S290 A291 Y293 A311 T333	S290-R309 WeakPolarHBondContact OG-CG 3.42Å; A291-R309 HydrophobicContact CB-CB 4.35Å; A291-R309 WeakPolarHBondContact O-CB 3.43Å; A291-R309 PolarHBondContact O-N 3.24Å; Y293-R309 HydrophobicContact CD2-CB 4.18Å; Y293-R309 HydrophobicContact CE2-CB 3.71Å; R309-A311 PolarHBondContact O-N 3.46Å; R309-T333 HydrophobicContact CB-CG2 3.93Å; R309-T333 HydrophobicContact CG-CG2 3.56Å
310	D	96.2	Very high	96.1	Very high	41 Å²	41	37.9 Å²	37.9	22%	0.219	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	14.7	173.3	66.2	14	0	0	0	114.1	H288 L289 S308 S312 R314	H288-D310 IonicContact ND1-OD2 3.86Å; L289-D310 HydrophobicContact CB-CB 4.05Å; L289-D310 PolarHBondContact N-OD2 2.62Å; S308-D310 WeakPolarHBondContact CB-OD1 3.3Å; S308-D310 PolarHBondContact O-N 3.3Å; S308-D310 PolarHBondContact OG-N 2.58Å; S308-D310 PolarHBondContact OG-OD1 2.74Å; S308-D310 VanDerWaalsContact OG-OD1 3.14Å; S308-D310 PolarHBondContact OG-OD2 3.36Å; D310-S312 VanDerWaalsContact CG-OG 3.29Å; D310-S312 PolarHBondContact O-N 2.94Å; D310-S312 WeakPolarHBondContact OD1-CB 3.32Å; D310-S312 PolarHBondContact OD1-N 3.21Å; D310-S312 PolarHBondContact OD1-OG 3.45Å; D310-R314 IonicContact OD1-NH1 3.68Å; D310-R314 IonicContact OD2-CZ 3.98Å; D310-R314 IonicContact OD2-NH1 2.89Å; D310-R314 PolarHBondContact OD2-NH1 2.77Å; D310-R314 IonicContact OD2-NH2 3.93Å
311	A	96.1	Very high	96.1	Very high	20 Å²	20	39.1 Å²	39.1	17%	0.165	18%	0.183	C	C	.	.	S	Bend	trans	62	17.4	-179.3	0	0	0	0	0	114.6	S308 R309 H330 N332	S308-A311 PolarHBondContact O-N 2.86Å; R309-A311 PolarHBondContact O-N 3.46Å; A311-H330 WeakPolarHBondContact CB-O 3.28Å; A311-N332 WeakPolarHBondContact CA-O 3.16Å; A311-N332 VanDerWaalsContact CB-O 3.24Å; A311-N332 WeakPolarHBondContact CB-O 3.36Å
312	S	95.6	Very high	96.2	Very high	5 Å²	5	38.1 Å²	38.1	4%	0.035	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	148.7	174.1	73.2	0	0	0	0	112	S308 D310 R314	S308-S312 PolarHBondContact N-O 3.05Å; S308-S312 VanDerWaalsContact N-O 3.16Å; D310-S312 VanDerWaalsContact CG-OG 3.29Å; D310-S312 PolarHBondContact O-N 2.94Å; D310-S312 WeakPolarHBondContact OD1-CB 3.32Å; D310-S312 PolarHBondContact OD1-N 3.21Å; D310-S312 PolarHBondContact OD1-OG 3.45Å; S312-R314 PolarHBondContact OG-NH1 3.33Å
313	A	97.2	Very high	96.3	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.008	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	136.4	160	0	0	0	0	0	108.6	T306 L327 T348	T306-A313 CarbonylContact O-C 3.56Å; T306-A313 WeakPolarHBondContact O-CA 3.39Å; A313-L327 HydrophobicContact CB-CB 4.12Å; A313-L327 HydrophobicContact CB-CD1 4.18Å; A313-L327 PolarHBondContact N-O 2.97Å; A313-L327 VanDerWaalsContact N-O 3.1Å; A313-L327 WeakPolarHBondContact O-CA 3.47Å; A313-L327 VanDerWaalsContact O-CB 3.31Å; A313-L327 WeakPolarHBondContact O-CB 3.3Å; A313-L327 PolarHBondContact O-N 3.25Å; A313-T348 HydrophobicContact CB-CG2 3.95Å
314	R	97.6	Very high	96.3	Very high	17 Å²	17	40 Å²	40	6%	0.064	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	139.4	179.7	-73	-175.2	175.3	78.9	6.4	110.9	G287 H288 V305 T306 D310 S312 W316 N323 H325 T326	G287-R314 PolarHBondContact O-NE 2.9Å; G287-R314 PolarHBondContact O-NH2 2.85Å; H288-R314 PolarHBondContact ND1-NH1 3.47Å; V305-R314 CarbonylContact C-O 3.57Å; V305-R314 WeakPolarHBondContact CA-O 3.26Å; T306-R314 PolarHBondContact N-O 2.84Å; T306-R314 PolarHBondContact O-N 3.47Å; T306-R314 PolarHBondContact OG1-O 3.05Å; T306-R314 VanDerWaalsContact OG1-O 3.1Å; D310-R314 IonicContact OD1-NH1 3.68Å; D310-R314 IonicContact OD2-CZ 3.98Å; D310-R314 IonicContact OD2-NH1 2.89Å; D310-R314 PolarHBondContact OD2-NH1 2.77Å; D310-R314 IonicContact OD2-NH2 3.93Å; S312-R314 PolarHBondContact OG-NH1 3.33Å; R314-W316 HydrophobicContact CB-CZ2 3.78Å; R314-W316 VanDerWaalsContact CD-CZ2 3.4Å; R314-W316 HydrophobicContact CG-CZ2 4.24Å; R314-N323 WeakPolarHBondContact CD-ND2 3.3Å; R314-H325 WeakPolarHBondContact CA-O 3.22Å; R314-T326 HydrophobicContact CG-CG2 4.18Å
315	V	97.8	Very high	96.2	Very high	3 Å²	3	42.5 Å²	42.5	2%	0.018	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	118.2	178.9	-178.7	0	0	0	0	107.8	V303 V305 N323 V324 H325 L327 L360	V303-V315 HydrophobicContact CG1-CG1 3.27Å; V305-V315 HydrophobicContact CG1-CG2 4.41Å; V305-V315 HydrophobicContact CG2-CG2 4.25Å; V315-N323 PolarHBondContact O-OD1 2.63Å; V315-N323 VanDerWaalsContact O-OD1 3.13Å; V315-V324 HydrophobicContact CG1-CB 4.44Å; V315-V324 PolarHBondContact O-N 3.12Å; V315-H325 HydrophobicContact CB-CB 4.05Å; V315-H325 HydrophobicContact CG2-CB 4.06Å; V315-H325 PolarHBondContact N-O 3.19Å; V315-L327 HydrophobicContact CG2-CD1 3.94Å; V315-L327 HydrophobicContact CG2-CG 4.1Å; V315-L360 HydrophobicContact CB-CD1 4.41Å; V315-L360 HydrophobicContact CG1-CD1 3.71Å; V315-L360 HydrophobicContact CG2-CD1 3.81Å
316	W	97.6	Very high	96.1	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.008	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	137.5	-176.2	-51.8	91.8	0	0	0	110.3	Y285 H286 H288 V303 L304 T306 R314 A322 N323	Y285-W316 HydrophobicContact CD1-CB 4.02Å; Y285-W316 HydrophobicContact CD1-CD2 4.33Å; Y285-W316 HydrophobicContact CD1-CE3 4.25Å; Y285-W316 HydrophobicContact CD1-CG 4.25Å; Y285-W316 HydrophobicContact CE1-CB 4.39Å; Y285-W316 HydrophobicContact CG-CD2 4.46Å; Y285-W316 HydrophobicContact CG-CG 4.48Å; H286-W316 VanDerWaalsContact O-CH2 3.24Å; H286-W316 WeakPolarHBondContact O-CH2 3.31Å; H286-W316 WeakPolarHBondContact O-CZ3 3.24Å; H288-W316 AromaticContact CD2-CZ2 3.8Å; H288-W316 AromaticContact NE2-CZ2 3.77Å; H288-W316 AromaticContact NE2-NE1 3.75Å; V303-W316 VanDerWaalsContact CA-O 3.32Å; V303-W316 WeakPolarHBondContact CA-O 3.13Å; L304-W316 HydrophobicContact CB-CB 4.31Å; L304-W316 PolarHBondContact N-O 3.17Å; L304-W316 PolarHBondContact O-N 2.98Å; T306-W316 PolarHBondContact OG1-NE1 3.09Å; R314-W316 HydrophobicContact CB-CZ2 3.78Å; R314-W316 VanDerWaalsContact CD-CZ2 3.4Å; R314-W316 HydrophobicContact CG-CZ2 4.24Å; W316-A322 WeakPolarHBondContact CA-O 3.28Å; W316-N323 HydrophobicContact CE3-CB 3.85Å; W316-N323 HydrophobicContact CH2-CB 4.15Å; W316-N323 HydrophobicContact CZ3-CB 3.62Å
317	D	96.3	Very high	96.1	Very high	39 Å²	39	45.2 Å²	45.2	21%	0.209	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	122.6	161.8	170.8	3.3	0	0	0	108.8	R319 T320 K321 A322 V324	D317-R319 VanDerWaalsContact C-N 3.25Å; D317-R319 PolarHBondContact O-N 2.81Å; D317-R319 PolarHBondContact OD1-N 3.26Å; D317-T320 WeakPolarHBondContact CB-OG1 3.23Å; D317-T320 WeakPolarHBondContact OD2-CB 3.33Å; D317-T320 WeakPolarHBondContact OD2-CG2 3.34Å; D317-T320 PolarHBondContact OD2-OG1 3.26Å; D317-K321 VanDerWaalsContact O-CA 3.3Å; D317-K321 WeakPolarHBondContact O-CA 3.41Å; D317-K321 PolarHBondContact O-N 3.26Å; D317-A322 PolarHBondContact N-O 2.99Å; D317-A322 VanDerWaalsContact N-O 3.07Å; D317-V324 HydrophobicContact CB-CG2 4.08Å
318	I	94.1	Very high	96	Very high	13 Å²	13	49.8 Å²	49.8	7%	0.067	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-36	-176.2	-67.9	173.9	0	0	0	111.5	F263 R283 Y285 L297 D302 L304	F263-I318 HydrophobicContact CE1-CG1 4.2Å; F263-I318 HydrophobicContact CE1-CG2 4.24Å; F263-I318 HydrophobicContact CZ-CB 4.47Å; F263-I318 HydrophobicContact CZ-CD1 3.87Å; F263-I318 HydrophobicContact CZ-CG1 3.96Å; F263-I318 HydrophobicContact CZ-CG2 3.74Å; R283-I318 WeakPolarHBondContact CD-O 3.37Å; Y285-I318 PolarHBondContact OH-O 3.08Å; Y285-I318 VanDerWaalsContact OH-O 3.06Å; L297-I318 HydrophobicContact CD2-CD1 3.88Å; D302-I318 VanDerWaalsContact C-CD1 3.44Å; D302-I318 HydrophobicContact CB-CD1 4.21Å; D302-I318 WeakPolarHBondContact O-CB 3.48Å; D302-I318 WeakPolarHBondContact O-CG1 3.38Å; D302-I318 PolarHBondContact O-N 2.92Å; L304-I318 HydrophobicContact CB-CG1 4.12Å
319	R	93.1	Very high	95.8	Very high	193 Å²	193	51.3 Å²	51.3	73%	0.728	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-50.3	-173.7	-174.7	175.1	60.9	119	1.7	111.8	D317	D317-R319 VanDerWaalsContact C-N 3.25Å; D317-R319 PolarHBondContact O-N 2.81Å; D317-R319 PolarHBondContact OD1-N 3.26Å
320	T	94.3	Very high	95.8	Very high	66 Å²	66	44.9 Å²	44.9	41%	0.405	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-19	-175	62.1	0	0	0	0	113.1	D317 A322	D317-T320 WeakPolarHBondContact CB-OG1 3.23Å; D317-T320 WeakPolarHBondContact OD2-CB 3.33Å; D317-T320 WeakPolarHBondContact OD2-CG2 3.34Å; D317-T320 PolarHBondContact OD2-OG1 3.26Å; T320-A322 PolarHBondContact O-N 3.24Å; T320-A322 PolarHBondContact OG1-N 3.32Å
321	K	95.2	Very high	95.8	Very high	104 Å²	104	48.8 Å²	48.8	45%	0.452	27%	0.271	S	S	.	.			trans	65.4	6.5	-172.2	-44.2	158.6	-69.5	-177.3	0	113.7	R283 Y285 D317	R283-K321 HydrophobicContact CB-CD 4Å; R283-K321 HydrophobicContact CB-CG 4.11Å; R283-K321 HydrophobicContact CG-CD 4.15Å; R283-K321 HydrophobicContact CG-CG 4.3Å; Y285-K321 HydrophobicContact CD1-CB 3.82Å; Y285-K321 HydrophobicContact CD1-CG 4.25Å; Y285-K321 HydrophobicContact CE1-CB 3.95Å; Y285-K321 HydrophobicContact CE1-CG 3.98Å; D317-K321 VanDerWaalsContact O-CA 3.3Å; D317-K321 WeakPolarHBondContact O-CA 3.41Å; D317-K321 PolarHBondContact O-N 3.26Å
322	A	95.3	Very high	95.9	Very high	51 Å²	51	51.4 Å²	51.4	42%	0.421	28%	0.282	S	S	.	.			trans	-72.7	144.1	178.5	0	0	0	0	0	110	W316 D317 T320 V324	W316-A322 WeakPolarHBondContact CA-O 3.28Å; D317-A322 PolarHBondContact N-O 2.99Å; D317-A322 VanDerWaalsContact N-O 3.07Å; T320-A322 PolarHBondContact O-N 3.24Å; T320-A322 PolarHBondContact OG1-N 3.32Å; A322-V324 PolarHBondContact O-N 3.42Å
323	N	96.1	Very high	95.9	Very high	59 Å²	59	51.9 Å²	51.9	32%	0.316	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	114.6	168.1	-176.5	5.7	0	0	0	108.2	R314 V315 W316 H325 T326	R314-N323 WeakPolarHBondContact CD-ND2 3.3Å; V315-N323 PolarHBondContact O-OD1 2.63Å; V315-N323 VanDerWaalsContact O-OD1 3.13Å; W316-N323 HydrophobicContact CE3-CB 3.85Å; W316-N323 HydrophobicContact CH2-CB 4.15Å; W316-N323 HydrophobicContact CZ3-CB 3.62Å; N323-H325 VanDerWaalsContact OD1-C 3.27Å; N323-H325 PolarHBondContact OD1-N 2.83Å; N323-H325 PolarHBondContact OD1-O 2.73Å; N323-T326 PolarHBondContact ND2-OG1 2.98Å
324	V	95.5	Very high	95.9	Very high	78 Å²	78	51.9 Å²	51.9	47%	0.473	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	-50.4	179.1	-175.5	0	0	0	0	109.8	V315 D317 A322	V315-V324 HydrophobicContact CG1-CB 4.44Å; V315-V324 PolarHBondContact O-N 3.12Å; D317-V324 HydrophobicContact CB-CG2 4.08Å; A322-V324 PolarHBondContact O-N 3.42Å
325	H	96.3	Very high	95.9	Very high	54 Å²	54	51.5 Å²	51.5	25%	0.25	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	135.5	-179.1	-67.3	-59.8	0	0	0	111.8	R314 V315 N323 L327 L360	R314-H325 WeakPolarHBondContact CA-O 3.22Å; V315-H325 HydrophobicContact CB-CB 4.05Å; V315-H325 HydrophobicContact CG2-CB 4.06Å; V315-H325 PolarHBondContact N-O 3.19Å; N323-H325 VanDerWaalsContact OD1-C 3.27Å; N323-H325 PolarHBondContact OD1-N 2.83Å; N323-H325 PolarHBondContact OD1-O 2.73Å; H325-L327 HydrophobicContact CB-CD2 4.22Å; H325-L360 PolarHBondContact CD2-O 2.67Å; H325-L360 PolarHBondContact NE2-O 2.93Å
326	T	96.3	Very high	95.8	Very high	58 Å²	58	51.5 Å²	51.5	36%	0.356	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	102.1	165.1	-51.5	0	0	0	0	107.8	R314 N323 T328	R314-T326 HydrophobicContact CG-CG2 4.18Å; N323-T326 PolarHBondContact ND2-OG1 2.98Å; T326-T328 HydrophobicContact CG2-CG2 3.76Å; T326-T328 PolarHBondContact O-N 2.85Å; T326-T328 VanDerWaalsContact O-N 3.08Å
327	L	96.2	Very high	95.8	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	94.6	178.2	-54	177.7	0	0	0	108.4	A313 V315 H325 V346 W358	A313-L327 HydrophobicContact CB-CB 4.12Å; A313-L327 HydrophobicContact CB-CD1 4.18Å; A313-L327 PolarHBondContact N-O 2.97Å; A313-L327 VanDerWaalsContact N-O 3.1Å; A313-L327 WeakPolarHBondContact O-CA 3.47Å; A313-L327 VanDerWaalsContact O-CB 3.31Å; A313-L327 WeakPolarHBondContact O-CB 3.3Å; A313-L327 PolarHBondContact O-N 3.25Å; V315-L327 HydrophobicContact CG2-CD1 3.94Å; V315-L327 HydrophobicContact CG2-CG 4.1Å; H325-L327 HydrophobicContact CB-CD2 4.22Å; L327-V346 HydrophobicContact CD1-CG1 4.05Å; L327-W358 HydrophobicContact CB-CD2 4.01Å; L327-W358 HydrophobicContact CB-CE3 3.83Å; L327-W358 HydrophobicContact CB-CH2 3.87Å; L327-W358 HydrophobicContact CB-CZ2 4.04Å; L327-W358 HydrophobicContact CB-CZ3 3.76Å; L327-W358 HydrophobicContact CD1-CB 4.3Å; L327-W358 HydrophobicContact CD1-CD2 4.01Å; L327-W358 HydrophobicContact CD1-CE3 4.39Å; L327-W358 HydrophobicContact CD1-CG 3.96Å; L327-W358 HydrophobicContact CD2-CD2 4.22Å; L327-W358 HydrophobicContact CD2-CE3 3.77Å; L327-W358 HydrophobicContact CD2-CZ3 4.28Å; L327-W358 HydrophobicContact CG-CD2 4.3Å; L327-W358 HydrophobicContact CG-CE3 4.2Å
328	T	95	Very high	95.9	Very high	96 Å²	96	52.3 Å²	52.3	59%	0.589	29%	0.285	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102	144.6	180	56.8	0	0	0	0	111.1	T326 W358	T326-T328 HydrophobicContact CG2-CG2 3.76Å; T326-T328 PolarHBondContact O-N 2.85Å; T326-T328 VanDerWaalsContact O-N 3.08Å; T328-W358 VanDerWaalsContact O-CH2 3.32Å; T328-W358 WeakPolarHBondContact O-CH2 3.39Å
329	G	93.1	Very high	95.9	Very high	31 Å²	31	52.1 Å²	52.1	32%	0.32	29%	0.285	S	S	.	.			trans	149.3	-21.2	171.8	0	0	0	0	0	114.3	R356	G329-R356 VanDerWaalsContact C-NH2 3.33Å; G329-R356 PolarHBondContact O-NH2 3.1Å
330	H	96.9	Very high	96	Very high	12 Å²	12	44.1 Å²	44.1	6%	0.056	26%	0.256	C	S	.	.			trans	-61.1	146.5	164.7	-78.2	-63.5	0	0	0	110.3	A311 V334 T348 S350 D352 T354	A311-H330 WeakPolarHBondContact CB-O 3.28Å; H330-V334 HydrophobicContact CB-CG2 4.04Å; H330-T348 PolarHBondContact NE2-OG1 3.07Å; H330-S350 WeakPolarHBondContact ND1-CB 3.34Å; H330-D352 VanDerWaalsContact CA-OD2 3.31Å; H330-D352 WeakPolarHBondContact CA-OD2 3.39Å; H330-D352 WeakPolarHBondContact CB-OD2 3.17Å; H330-D352 IonicContact CG-OD2 3.52Å; H330-D352 IonicContact ND1-OD1 3.52Å; H330-D352 PolarHBondContact ND1-OD1 2.77Å; H330-D352 IonicContact ND1-OD2 3.97Å; H330-D352 PolarHBondContact ND1-OD2 2.89Å; H330-T354 PolarHBondContact CE1-OG1 3.29Å; H330-T354 PolarHBondContact ND1-OG1 3.12Å
331	T	96.6	Very high	96	Very high	123 Å²	123	43.1 Å²	43.1	76%	0.755	25%	0.254	S	S	*	.	S	Bend	trans	-97.5	-13.6	-179.2	61.5	0	0	0	0	112.5	D352	T331-D352 PolarHBondContact N-OD2 3.16Å; T331-D352 WeakPolarHBondContact OG1-CB 3.31Å
332	N	97.1	Very high	95.9	Very high	75 Å²	75	40.3 Å²	40.3	40%	0.401	25%	0.251	S	S	.	.	S	Bend	trans	-138.3	-178.8	-179.7	-156	-7.4	0	0	0	110.7	A311 V334 S350 H351 D352	A311-N332 WeakPolarHBondContact CA-O 3.16Å; A311-N332 VanDerWaalsContact CB-O 3.24Å; A311-N332 WeakPolarHBondContact CB-O 3.36Å; N332-V334 PolarHBondContact O-N 2.8Å; N332-S350 PolarHBondContact O-OG 3.11Å; N332-S350 VanDerWaalsContact O-OG 3.05Å; N332-H351 HydrophobicContact CB-CB 4.32Å; N332-D352 HydrophobicContact CB-CB 3.84Å
333	T	96.8	Very high	95.6	Very high	15 Å²	15	43.1 Å²	43.1	9%	0.092	26%	0.255	C	S	.	.			trans	-54.8	126.6	-175	59.2	0	0	0	0	112.5	R309 A335 S350 H351	R309-T333 HydrophobicContact CB-CG2 3.93Å; R309-T333 HydrophobicContact CG-CG2 3.56Å; T333-A335 PolarHBondContact O-N 2.75Å; T333-S350 WeakPolarHBondContact O-CA 3.32Å; T333-S350 PolarHBondContact O-OG 2.9Å; T333-H351 PolarHBondContact O-CD2 2.83Å; T333-H351 PolarHBondContact O-N 2.9Å; T333-H351 WeakPolarHBondContact OG1-CB 3.37Å; T333-H351 PolarHBondContact OG1-CD2 2.85Å; T333-H351 VanDerWaalsContact OG1-CG 3.23Å
334	V	97.8	Very high	95.5	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	115.2	175.5	-165.9	0	0	0	0	107.7	C307 S308 H330 N332 T348 G349	C307-V334 HydrophobicContact CB-CB 3.92Å; C307-V334 HydrophobicContact CB-CG1 3.82Å; C307-V334 WeakPolarHBondContact SG-CG1 3.3Å; S308-V334 PolarHBondContact O-N 3.39Å; S308-V334 VanDerWaalsContact O-N 3.11Å; H330-V334 HydrophobicContact CB-CG2 4.04Å; N332-V334 PolarHBondContact O-N 2.8Å; V334-T348 HydrophobicContact CG1-CG2 4.3Å; V334-G349 WeakPolarHBondContact CG1-O 3.22Å
335	A	96.4	Very high	95.5	Very high	10 Å²	10	38.3 Å²	38.3	8%	0.083	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	-36.3	-170.8	0	0	0	0	0	112.4	T333 G349 V376	T333-A335 PolarHBondContact O-N 2.75Å; A335-G349 PolarHBondContact N-O 3.35Å; A335-V376 WeakPolarHBondContact CB-O 3.4Å
336	T	96.9	Very high	95.5	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.012	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	151	-170.8	-177.8	0	0	0	0	111.6	D294 T348 G349 R377 L379	D294-T336 VanDerWaalsContact OD2-CA 3.3Å; D294-T336 WeakPolarHBondContact OD2-CA 3.33Å; D294-T336 PolarHBondContact OD2-OG1 2.88Å; T336-T348 WeakPolarHBondContact O-CA 3.33Å; T336-G349 PolarHBondContact N-O 3.1Å; T336-G349 PolarHBondContact O-N 3.35Å; T336-R377 WeakPolarHBondContact CB-O 3.32Å; T336-L379 HydrophobicContact CG2-CB 4.05Å; T336-L379 HydrophobicContact CG2-CD1 3.85Å; T336-L379 HydrophobicContact CG2-CG 3.68Å
337	V	97.2	Very high	95.5	Very high	0 Å²	0	33 Å²	33	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	142.1	172.4	49.5	0	0	0	0	110.9	D294 D296 V305 C307 V346 I347 T348	D294-V337 HydrophobicContact CB-CG1 4.43Å; D294-V337 PolarHBondContact OD2-N 2.86Å; D294-V337 VanDerWaalsContact OD2-N 3.17Å; D296-V337 HydrophobicContact CB-CG1 4.13Å; V305-V337 HydrophobicContact CB-CG2 4.12Å; V305-V337 HydrophobicContact CG1-CG2 3.74Å; C307-V337 HydrophobicContact CB-CG1 4.34Å; C307-V337 WeakPolarHBondContact SG-CB 3.36Å; C307-V337 VanDerWaalsContact SG-CG1 3.57Å; V337-V346 HydrophobicContact CG2-CG1 3.93Å; V337-I347 CarbonylContact C-O 3.58Å; V337-I347 WeakPolarHBondContact CA-O 3.34Å; V337-T348 HydrophobicContact CB-CG2 4.33Å; V337-T348 HydrophobicContact CG2-CG2 4.25Å
338	R	97.1	Very high	95.6	Very high	58 Å²	58	33 Å²	33	22%	0.219	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	139.9	165	-64.6	-65.2	175.3	-103.2	3.9	110.9	D294 D296 I347 L379 L381	D294-R338 IonicContact OD1-NH1 3.97Å; D294-R338 IonicContact OD2-CZ 3.06Å; D294-R338 IonicContact OD2-NH1 3.49Å; D294-R338 PolarHBondContact OD2-NH1 3.01Å; D296-R338 VanDerWaalsContact OD2-CA 3.24Å; D296-R338 WeakPolarHBondContact OD2-CA 3.49Å; R338-I347 PolarHBondContact N-O 2.87Å; R338-I347 PolarHBondContact O-N 3.29Å; R338-L379 HydrophobicContact CG-CB 4.04Å; R338-L379 PolarHBondContact NE-O 2.9Å; R338-L381 HydrophobicContact CB-CD1 4.03Å; R338-L381 HydrophobicContact CB-CD2 4.35Å; R338-L381 HydrophobicContact CB-CG 3.95Å; R338-L381 HydrophobicContact CG-CG 4.44Å
339	C	95.9	Very high	95.7	Very high	9 Å²	9	28.5 Å²	28.5	6%	0.061	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	143.9	176.8	-62	0	0	0	0	110.3	D296 H298 V305 Q345 L381	D296-C339 PolarHBondContact OD2-N 3.44Å; H298-C339 HydrophobicContact CB-CB 4.47Å; V305-C339 WeakPolarHBondContact CG2-SG 3.34Å; C339-Q345 CarbonylContact C-O 3.57Å; C339-Q345 VanDerWaalsContact CA-O 3.27Å; C339-Q345 WeakPolarHBondContact CA-O 3.44Å; C339-L381 WeakPolarHBondContact O-CD1 3.07Å
340	Q	94.9	Very high	95.9	Very high	25 Å²	25	27 Å²	27	12%	0.117	15%	0.154	C	C	.	.			trans	-143.3	156.4	172.6	53.2	169.9	21.6	0	0	110.4	H298 A342 E343 P344 Q345 I347 L381	H298-Q340 PolarHBondContact NE2-O 2.87Å; H298-Q340 VanDerWaalsContact NE2-O 3.07Å; Q340-A342 WeakPolarHBondContact CG-O 3.42Å; Q340-A342 PolarHBondContact NE2-O 2.8Å; Q340-E343 PolarHBondContact NE2-O 3.08Å; Q340-E343 VanDerWaalsContact NE2-O 3.15Å; Q340-P344 VanDerWaalsContact CG-O 3.23Å; Q340-P344 WeakPolarHBondContact CG-O 3.49Å; Q340-P344 PolarHBondContact NE2-O 2.68Å; Q340-Q345 PolarHBondContact N-O 2.8Å; Q340-Q345 WeakPolarHBondContact O-CA 3.37Å; Q340-I347 HydrophobicContact CG-CD1 4.37Å; Q340-L381 HydrophobicContact CB-CD1 3.85Å; Q340-L381 HydrophobicContact CG-CD1 4.39Å
341	A	93	Very high	95.9	Very high	45 Å²	45	28.6 Å²	28.6	37%	0.372	16%	0.161	S	C	.	.	S	Bend	trans	-71.1	-36.1	178.4	0	0	0	0	0	112.8	P299 T300 Q345	P299-A341 HydrophobicContact CG-CB 4.1Å; T300-A341 HydrophobicContact CG2-CB 3.65Å; A341-Q345 PolarHBondContact O-NE2 3.5Å
342	A	93.5	Very high	95.9	Very high	45 Å²	45	23.7 Å²	23.7	37%	0.372	13%	0.131	S	C	.	.	S	Bend	trans	-76.2	155.5	177.7	0	0	0	0	0	110.9	Q340 P344 Q345 Y386	Q340-A342 WeakPolarHBondContact CG-O 3.42Å; Q340-A342 PolarHBondContact NE2-O 2.8Å; A342-P344 CarbonylContact O-C 3.58Å; A342-Q345 WeakPolarHBondContact O-CA 3.31Å; A342-Q345 PolarHBondContact O-N 3.32Å; A342-Y386 HydrophobicContact CB-CE2 3.79Å
343	E	89.9	Confident	95.8	Very high	110 Å²	110	21.8 Å²	21.8	51%	0.514	12%	0.123	S	C	.	.	S	Bend	trans	-64.9	155.6	170.4	-66.3	-172.6	179.6	0	0	110.8	Q340 R366 Y386	Q340-E343 PolarHBondContact NE2-O 3.08Å; Q340-E343 VanDerWaalsContact NE2-O 3.15Å; E343-R366 IonicContact OE2-NH1 3.96Å; E343-R366 PolarHBondContact OE2-NH1 3.1Å; E343-Y386 PolarHBondContact O-OH 2.81Å
344	P	93.9	Very high	95.8	Very high	3 Å²	3	22 Å²	22	2%	0.019	13%	0.125	C	C	.	.	S	Bend	cis	-60.4	130.6	-28.1	28.4	-34.6	0	0	0	110.7	Q340 A342 V346 I347 L357 F401	Q340-P344 VanDerWaalsContact CG-O 3.23Å; Q340-P344 WeakPolarHBondContact CG-O 3.49Å; Q340-P344 PolarHBondContact NE2-O 2.68Å; A342-P344 CarbonylContact O-C 3.58Å; P344-V346 PolarHBondContact O-N 3.35Å; P344-I347 HydrophobicContact CG-CG1 4.41Å; P344-L357 HydrophobicContact CB-CB 3.95Å; P344-L357 HydrophobicContact CB-CD2 4.49Å; P344-L357 HydrophobicContact CG-CB 4.05Å; P344-L357 HydrophobicContact CG-CD1 4.13Å; P344-L357 HydrophobicContact CG-CD2 3.84Å; P344-L357 HydrophobicContact CG-CG 4.22Å; P344-F401 HydrophobicContact CG-CD1 3.52Å; P344-F401 HydrophobicContact CG-CE1 3.55Å
345	Q	94.1	Very high	95.8	Very high	34 Å²	34	22 Å²	22	16%	0.159	13%	0.125	C	C	.	.			trans	-74	-26.9	-169.7	-71.6	-180	-33	0	0	113.8	C339 Q340 A341 A342 L360	C339-Q345 CarbonylContact C-O 3.57Å; C339-Q345 VanDerWaalsContact CA-O 3.27Å; C339-Q345 WeakPolarHBondContact CA-O 3.44Å; Q340-Q345 PolarHBondContact N-O 2.8Å; Q340-Q345 WeakPolarHBondContact O-CA 3.37Å; A341-Q345 PolarHBondContact O-NE2 3.5Å; A342-Q345 WeakPolarHBondContact O-CA 3.31Å; A342-Q345 PolarHBondContact O-N 3.32Å; Q345-L360 HydrophobicContact CB-CB 4.2Å
346	V	96.7	Very high	95.8	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	129.2	-179.8	177.7	0	0	0	0	109.3	V305 L327 V337 P344 T348 W358 L360	V305-V346 HydrophobicContact CG1-CG1 4.01Å; V305-V346 HydrophobicContact CG2-CG2 3.97Å; L327-V346 HydrophobicContact CD1-CG1 4.05Å; V337-V346 HydrophobicContact CG2-CG1 3.93Å; P344-V346 PolarHBondContact O-N 3.35Å; V346-T348 HydrophobicContact CG1-CG2 4.16Å; V346-W358 HydrophobicContact CB-CB 4.15Å; V346-W358 PolarHBondContact O-N 3.01Å; V346-L360 HydrophobicContact CG2-CD1 4.05Å
347	I	97.2	Very high	95.8	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.005	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	130.7	175.6	-55.4	119.3	0	0	0	108.3	V337 R338 Q340 P344 I355 R356 L357 L379 L381 F388 F401	V337-I347 CarbonylContact C-O 3.58Å; V337-I347 WeakPolarHBondContact CA-O 3.34Å; R338-I347 PolarHBondContact N-O 2.87Å; R338-I347 PolarHBondContact O-N 3.29Å; Q340-I347 HydrophobicContact CG-CD1 4.37Å; P344-I347 HydrophobicContact CG-CG1 4.41Å; I347-I355 HydrophobicContact CG2-CG2 3.71Å; I347-R356 WeakPolarHBondContact CA-O 3.17Å; I347-L357 HydrophobicContact CB-CD2 4.14Å; I347-L357 HydrophobicContact CG1-CD2 3.48Å; I347-L357 VanDerWaalsContact CG1-CD2 3.48Å; I347-L357 HydrophobicContact CG2-CD2 3.75Å; I347-L379 HydrophobicContact CB-CD1 4.39Å; I347-L379 HydrophobicContact CG2-CD1 3.63Å; I347-L379 HydrophobicContact CG2-CD2 4.46Å; I347-L381 HydrophobicContact CD1-CD2 3.72Å; I347-F388 HydrophobicContact CG2-CE2 4.38Å; I347-F401 HydrophobicContact CD1-CE1 3.71Å; I347-F401 HydrophobicContact CD1-CZ 3.45Å; I347-F401 VanDerWaalsContact CD1-CZ 3.45Å; I347-F401 HydrophobicContact CG1-CE1 3.98Å; I347-F401 HydrophobicContact CG1-CZ 4.2Å
348	T	97.5	Very high	95.8	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	141.3	178.1	61.5	0	0	0	0	111.5	A313 H330 V334 T336 V337 V346 I355 R356 W358	A313-T348 HydrophobicContact CB-CG2 3.95Å; H330-T348 PolarHBondContact NE2-OG1 3.07Å; V334-T348 HydrophobicContact CG1-CG2 4.3Å; T336-T348 WeakPolarHBondContact O-CA 3.33Å; V337-T348 HydrophobicContact CB-CG2 4.33Å; V337-T348 HydrophobicContact CG2-CG2 4.25Å; V346-T348 HydrophobicContact CG1-CG2 4.16Å; T348-I355 CarbonylContact O-C 3.56Å; T348-I355 VanDerWaalsContact O-CA 3.3Å; T348-I355 WeakPolarHBondContact O-CA 3.31Å; T348-I355 WeakPolarHBondContact O-CG2 3.49Å; T348-R356 PolarHBondContact N-O 3.31Å; T348-R356 PolarHBondContact O-N 3.06Å; T348-W358 PolarHBondContact OG1-NE1 3.27Å
349	G	97.1	Very high	95.7	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	136.3	173.9	0	0	0	0	0	110	V334 A335 T336	V334-G349 WeakPolarHBondContact CG1-O 3.22Å; A335-G349 PolarHBondContact N-O 3.35Å; T336-G349 PolarHBondContact N-O 3.1Å; T336-G349 PolarHBondContact O-N 3.35Å
350	S	97.3	Very high	95.6	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	161.1	-174.2	173.2	0	0	0	0	113.2	H330 N332 T333 D352 S353 T354 V376	H330-S350 WeakPolarHBondContact ND1-CB 3.34Å; N332-S350 PolarHBondContact O-OG 3.11Å; N332-S350 VanDerWaalsContact O-OG 3.05Å; T333-S350 WeakPolarHBondContact O-CA 3.32Å; T333-S350 PolarHBondContact O-OG 2.9Å; S350-D352 VanDerWaalsContact CB-OD1 3.23Å; S350-D352 WeakPolarHBondContact CB-OD1 3.49Å; S350-D352 PolarHBondContact O-N 3.25Å; S350-D352 VanDerWaalsContact OG-CG 3.27Å; S350-D352 PolarHBondContact OG-N 3.39Å; S350-D352 PolarHBondContact OG-OD1 3.46Å; S350-D352 PolarHBondContact OG-OD2 3.01Å; S350-S353 PolarHBondContact O-N 2.62Å; S350-T354 PolarHBondContact N-O 3.04Å; S350-V376 CarbonylContact C-O 3.55Å; S350-V376 PolarHBondContact O-N 2.89Å
351	H	96.8	Very high	95.5	Very high	45 Å²	45	29.4 Å²	29.4	21%	0.208	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-8.1	170.2	-74	-94.3	0	0	0	113.7	N332 T333 S353 S375	N332-H351 HydrophobicContact CB-CB 4.32Å; T333-H351 PolarHBondContact O-CD2 2.83Å; T333-H351 PolarHBondContact O-N 2.9Å; T333-H351 WeakPolarHBondContact OG1-CB 3.37Å; T333-H351 PolarHBondContact OG1-CD2 2.85Å; T333-H351 VanDerWaalsContact OG1-CG 3.23Å; H351-S353 PolarHBondContact O-N 3.43Å; H351-S375 VanDerWaalsContact ND1-CB 3.28Å; H351-S375 WeakPolarHBondContact ND1-CB 3.36Å
352	D	96.4	Very high	95.4	Very high	21 Å²	21	29.7 Å²	29.7	11%	0.112	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	7.8	169.4	66.5	15.2	0	0	0	113.7	H330 T331 N332 S350 T354	H330-D352 VanDerWaalsContact CA-OD2 3.31Å; H330-D352 WeakPolarHBondContact CA-OD2 3.39Å; H330-D352 WeakPolarHBondContact CB-OD2 3.17Å; H330-D352 IonicContact CG-OD2 3.52Å; H330-D352 IonicContact ND1-OD1 3.52Å; H330-D352 PolarHBondContact ND1-OD1 2.77Å; H330-D352 IonicContact ND1-OD2 3.97Å; H330-D352 PolarHBondContact ND1-OD2 2.89Å; T331-D352 PolarHBondContact N-OD2 3.16Å; T331-D352 WeakPolarHBondContact OG1-CB 3.31Å; N332-D352 HydrophobicContact CB-CB 3.84Å; S350-D352 VanDerWaalsContact CB-OD1 3.23Å; S350-D352 WeakPolarHBondContact CB-OD1 3.49Å; S350-D352 PolarHBondContact O-N 3.25Å; S350-D352 VanDerWaalsContact OG-CG 3.27Å; S350-D352 PolarHBondContact OG-N 3.39Å; S350-D352 PolarHBondContact OG-OD1 3.46Å; S350-D352 PolarHBondContact OG-OD2 3.01Å; D352-T354 VanDerWaalsContact CG-OG1 3.22Å; D352-T354 PolarHBondContact O-N 2.83Å; D352-T354 WeakPolarHBondContact OD1-CA 3.31Å; D352-T354 WeakPolarHBondContact OD1-CB 3.38Å; D352-T354 PolarHBondContact OD1-N 2.59Å; D352-T354 PolarHBondContact OD1-OG1 2.87Å; D352-T354 PolarHBondContact OD2-OG1 3.39Å
353	S	95.8	Very high	95.4	Very high	35 Å²	35	28.3 Å²	28.3	25%	0.245	16%	0.155	C	C	.	.	S	Bend	trans	65	12.3	-177.4	68.2	0	0	0	0	115.2	S350 H351 K374	S350-S353 PolarHBondContact O-N 2.62Å; H351-S353 PolarHBondContact O-N 3.43Å; S353-K374 WeakPolarHBondContact CA-O 3.33Å; S353-K374 WeakPolarHBondContact CB-O 3.31Å
354	T	96.7	Very high	95.6	Very high	19 Å²	19	30.3 Å²	30.3	12%	0.117	16%	0.162	C	C	.	.			trans	-107.1	150.9	176.6	75.4	0	0	0	0	111.9	H330 S350 D352 T368 L369 T370	H330-T354 PolarHBondContact CE1-OG1 3.29Å; H330-T354 PolarHBondContact ND1-OG1 3.12Å; S350-T354 PolarHBondContact N-O 3.04Å; D352-T354 VanDerWaalsContact CG-OG1 3.22Å; D352-T354 PolarHBondContact O-N 2.83Å; D352-T354 WeakPolarHBondContact OD1-CA 3.31Å; D352-T354 WeakPolarHBondContact OD1-CB 3.38Å; D352-T354 PolarHBondContact OD1-N 2.59Å; D352-T354 PolarHBondContact OD1-OG1 2.87Å; D352-T354 PolarHBondContact OD2-OG1 3.39Å; T354-T368 HydrophobicContact CG2-CG2 4.41Å; T354-L369 WeakPolarHBondContact CA-O 3.39Å; T354-T370 HydrophobicContact CG2-CG2 4.04Å
355	I	97.6	Very high	95.6	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	134.8	167.1	-56.7	167.2	0	0	0	106.8	I347 T348 L369 V376 L379 F388 W399	I347-I355 HydrophobicContact CG2-CG2 3.71Å; T348-I355 CarbonylContact O-C 3.56Å; T348-I355 VanDerWaalsContact O-CA 3.3Å; T348-I355 WeakPolarHBondContact O-CA 3.31Å; T348-I355 WeakPolarHBondContact O-CG2 3.49Å; I355-L369 HydrophobicContact CB-CB 4.17Å; I355-L369 HydrophobicContact CB-CD1 4.34Å; I355-L369 HydrophobicContact CG2-CD1 4.35Å; I355-L369 PolarHBondContact N-O 2.98Å; I355-L369 PolarHBondContact O-N 3.13Å; I355-V376 HydrophobicContact CD1-CG1 4.29Å; I355-V376 HydrophobicContact CD1-CG2 4.39Å; I355-V376 HydrophobicContact CG1-CB 4.4Å; I355-V376 HydrophobicContact CG1-CG1 4.06Å; I355-V376 HydrophobicContact CG1-CG2 3.98Å; I355-L379 HydrophobicContact CD1-CD2 4.09Å; I355-L379 HydrophobicContact CG1-CD2 4.43Å; I355-L379 HydrophobicContact CG2-CD2 4.31Å; I355-F388 HydrophobicContact CD1-CE2 4.45Å; I355-F388 HydrophobicContact CG2-CE2 4.28Å; I355-W399 HydrophobicContact CD1-CZ2 4.1Å
356	R	96.9	Very high	95.6	Very high	44 Å²	44	35.7 Å²	35.7	17%	0.166	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	130.6	177.3	-72.2	-176.8	175.4	-128.7	-1.8	110.4	G329 I347 T348 W358 T365 T368	G329-R356 VanDerWaalsContact C-NH2 3.33Å; G329-R356 PolarHBondContact O-NH2 3.1Å; I347-R356 WeakPolarHBondContact CA-O 3.17Å; T348-R356 PolarHBondContact N-O 3.31Å; T348-R356 PolarHBondContact O-N 3.06Å; R356-W358 HydrophobicContact CB-CZ2 3.9Å; R356-W358 HydrophobicContact CG-CZ2 4.36Å; R356-T365 HydrophobicContact CB-CG2 3.86Å; R356-T365 HydrophobicContact CG-CG2 3.84Å; R356-T365 PolarHBondContact NH1-OG1 3.27Å; R356-T368 HydrophobicContact CG-CG2 4.28Å
357	L	97	Very high	95.4	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	121.1	170	-57.3	-179.1	0	0	0	107.2	P344 I347 T365 R366 A367 F388 F401	P344-L357 HydrophobicContact CB-CB 3.95Å; P344-L357 HydrophobicContact CB-CD2 4.49Å; P344-L357 HydrophobicContact CG-CB 4.05Å; P344-L357 HydrophobicContact CG-CD1 4.13Å; P344-L357 HydrophobicContact CG-CD2 3.84Å; P344-L357 HydrophobicContact CG-CG 4.22Å; I347-L357 HydrophobicContact CB-CD2 4.14Å; I347-L357 HydrophobicContact CG1-CD2 3.48Å; I347-L357 VanDerWaalsContact CG1-CD2 3.48Å; I347-L357 HydrophobicContact CG2-CD2 3.75Å; L357-T365 CarbonylContact O-C 3.59Å; L357-R366 PolarHBondContact O-N 3.4Å; L357-A367 HydrophobicContact CB-CB 4.29Å; L357-A367 HydrophobicContact CD1-CB 4.1Å; L357-A367 HydrophobicContact CG-CB 4.42Å; L357-A367 PolarHBondContact N-O 2.82Å; L357-A367 PolarHBondContact O-N 3.47Å; L357-F388 HydrophobicContact CD2-CE1 4.28Å; L357-F388 HydrophobicContact CD2-CZ 4.17Å; L357-F401 HydrophobicContact CD2-CE1 4.17Å
358	W	96.6	Very high	95.4	Very high	3 Å²	3	39.8 Å²	39.8	1%	0.011	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	144.5	-174.8	-58.6	88.2	0	0	0	111.3	L327 T328 V346 T348 R356 T365	L327-W358 HydrophobicContact CB-CD2 4.01Å; L327-W358 HydrophobicContact CB-CE3 3.83Å; L327-W358 HydrophobicContact CB-CH2 3.87Å; L327-W358 HydrophobicContact CB-CZ2 4.04Å; L327-W358 HydrophobicContact CB-CZ3 3.76Å; L327-W358 HydrophobicContact CD1-CB 4.3Å; L327-W358 HydrophobicContact CD1-CD2 4.01Å; L327-W358 HydrophobicContact CD1-CE3 4.39Å; L327-W358 HydrophobicContact CD1-CG 3.96Å; L327-W358 HydrophobicContact CD2-CD2 4.22Å; L327-W358 HydrophobicContact CD2-CE3 3.77Å; L327-W358 HydrophobicContact CD2-CZ3 4.28Å; L327-W358 HydrophobicContact CG-CD2 4.3Å; L327-W358 HydrophobicContact CG-CE3 4.2Å; T328-W358 VanDerWaalsContact O-CH2 3.32Å; T328-W358 WeakPolarHBondContact O-CH2 3.39Å; V346-W358 HydrophobicContact CB-CB 4.15Å; V346-W358 PolarHBondContact O-N 3.01Å; T348-W358 PolarHBondContact OG1-NE1 3.27Å; R356-W358 HydrophobicContact CB-CZ2 3.9Å; R356-W358 HydrophobicContact CG-CZ2 4.36Å; W358-T365 WeakPolarHBondContact CH2-OG1 3.37Å; W358-T365 WeakPolarHBondContact CZ3-OG1 3.41Å
359	D	94.6	Very high	95.3	Very high	59 Å²	59	40.5 Å²	40.5	32%	0.316	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	118.5	160.1	177.1	7	0	0	0	108.3	I361 A362 G363 K364	D359-I361 VanDerWaalsContact C-N 3.32Å; D359-I361 PolarHBondContact OD1-N 3.07Å; D359-A362 HydrophobicContact CB-CB 4.41Å; D359-A362 VanDerWaalsContact OD2-CB 3.25Å; D359-A362 WeakPolarHBondContact OD2-CB 3.24Å; D359-G363 VanDerWaalsContact O-CA 3.3Å; D359-G363 WeakPolarHBondContact O-CA 3.47Å; D359-G363 PolarHBondContact O-N 3.3Å; D359-K364 PolarHBondContact N-O 2.97Å; D359-K364 PolarHBondContact O-N 3.06Å
360	L	93.3	Very high	95.2	Very high	16 Å²	16	45 Å²	45	8%	0.084	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-30.1	-178.5	-172.3	62.2	0	0	0	112.1	I301 V315 H325 Q345 V346	I301-L360 HydrophobicContact CD1-CD2 4.5Å; V315-L360 HydrophobicContact CB-CD1 4.41Å; V315-L360 HydrophobicContact CG1-CD1 3.71Å; V315-L360 HydrophobicContact CG2-CD1 3.81Å; H325-L360 PolarHBondContact CD2-O 2.67Å; H325-L360 PolarHBondContact NE2-O 2.93Å; Q345-L360 HydrophobicContact CB-CB 4.2Å; V346-L360 HydrophobicContact CG2-CD1 4.05Å
361	I	93	Very high	95.1	Very high	137 Å²	137	48.7 Å²	48.7	70%	0.703	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-48.4	-176	-60.1	170.5	0	0	0	109.8	D359	D359-I361 VanDerWaalsContact C-N 3.32Å; D359-I361 PolarHBondContact OD1-N 3.07Å
362	A	92.8	Very high	95	Very high	51 Å²	51	46.8 Å²	46.8	42%	0.421	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-20.5	178.7	0	0	0	0	0	113.2	D359 K364	D359-A362 HydrophobicContact CB-CB 4.41Å; D359-A362 VanDerWaalsContact OD2-CB 3.25Å; D359-A362 WeakPolarHBondContact OD2-CB 3.24Å; A362-K364 HydrophobicContact CB-CB 4.4Å; A362-K364 HydrophobicContact CB-CG 4.45Å; A362-K364 PolarHBondContact O-N 2.93Å
363	G	92.3	Very high	94.9	Very high	17 Å²	17	54.4 Å²	54.4	18%	0.175	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.3	24	-172.8	0	0	0	0	0	113.4	D359	D359-G363 VanDerWaalsContact O-CA 3.3Å; D359-G363 WeakPolarHBondContact O-CA 3.47Å; D359-G363 PolarHBondContact O-N 3.3Å
364	K	93.8	Very high	94.9	Very high	152 Å²	152	58.1 Å²	58.1	66%	0.661	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.9	153.2	-176.9	-68.8	-179.3	-176.6	175.8	0	111.3	D359 A362 R366	D359-K364 PolarHBondContact N-O 2.97Å; D359-K364 PolarHBondContact O-N 3.06Å; A362-K364 HydrophobicContact CB-CB 4.4Å; A362-K364 HydrophobicContact CB-CG 4.45Å; A362-K364 PolarHBondContact O-N 2.93Å; K364-R366 PolarHBondContact O-N 2.75Å
365	T	94.6	Very high	94.8	Very high	39 Å²	39	58.4 Å²	58.4	24%	0.239	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	123.3	172.7	-50.8	0	0	0	0	109.5	R356 L357 W358 A367	R356-T365 HydrophobicContact CB-CG2 3.86Å; R356-T365 HydrophobicContact CG-CG2 3.84Å; R356-T365 PolarHBondContact NH1-OG1 3.27Å; L357-T365 CarbonylContact O-C 3.59Å; W358-T365 WeakPolarHBondContact CH2-OG1 3.37Å; W358-T365 WeakPolarHBondContact CZ3-OG1 3.41Å; T365-A367 VanDerWaalsContact CG2-O 3.31Å; T365-A367 WeakPolarHBondContact CG2-O 3.31Å
366	R	92.8	Very high	94.8	Very high	111 Å²	111	58.4 Å²	58.4	42%	0.419	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	-47	173.6	178.8	176.5	170.9	168.5	-3.4	111.4	E343 L357 K364 D403	E343-R366 IonicContact OE2-NH1 3.96Å; E343-R366 PolarHBondContact OE2-NH1 3.1Å; L357-R366 PolarHBondContact O-N 3.4Å; K364-R366 PolarHBondContact O-N 2.75Å; R366-D403 IonicContact CZ-OD1 3.98Å; R366-D403 IonicContact NE-OD1 3.94Å; R366-D403 IonicContact NH2-OD1 3.97Å; R366-D403 PolarHBondContact NH2-OD1 3.14Å
367	A	94.1	Very high	94.8	Very high	21 Å²	21	60 Å²	60	17%	0.174	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	143.7	179.5	0	0	0	0	0	111.2	L357 T365	L357-A367 HydrophobicContact CB-CB 4.29Å; L357-A367 HydrophobicContact CD1-CB 4.1Å; L357-A367 HydrophobicContact CG-CB 4.42Å; L357-A367 PolarHBondContact N-O 2.82Å; L357-A367 PolarHBondContact O-N 3.47Å; T365-A367 VanDerWaalsContact CG2-O 3.31Å; T365-A367 WeakPolarHBondContact CG2-O 3.31Å
368	T	95.7	Very high	94.7	Very high	65 Å²	65	60.1 Å²	60.1	40%	0.399	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	117.9	174.7	-52.7	0	0	0	0	108.6	T354 R356 T370	T354-T368 HydrophobicContact CG2-CG2 4.41Å; R356-T368 HydrophobicContact CG-CG2 4.28Å; T368-T370 HydrophobicContact CG2-CG2 4.01Å
369	L	95.9	Very high	94.8	Very high	16 Å²	16	60 Å²	60	8%	0.084	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	117.5	179.8	-48.7	174.1	0	0	0	108.9	T354 I355 F388 W399 G404	T354-L369 WeakPolarHBondContact CA-O 3.39Å; I355-L369 HydrophobicContact CB-CB 4.17Å; I355-L369 HydrophobicContact CB-CD1 4.34Å; I355-L369 HydrophobicContact CG2-CD1 4.35Å; I355-L369 PolarHBondContact N-O 2.98Å; I355-L369 PolarHBondContact O-N 3.13Å; L369-F388 HydrophobicContact CD1-CZ 3.76Å; L369-W399 HydrophobicContact CB-CH2 3.83Å; L369-W399 HydrophobicContact CB-CZ2 4.45Å; L369-W399 HydrophobicContact CB-CZ3 4.04Å; L369-W399 HydrophobicContact CD1-CD2 3.96Å; L369-W399 HydrophobicContact CD1-CE3 3.78Å; L369-W399 HydrophobicContact CD1-CG 4.49Å; L369-W399 HydrophobicContact CD1-CH2 4.2Å; L369-W399 HydrophobicContact CD1-CZ2 4.46Å; L369-W399 HydrophobicContact CD1-CZ3 3.89Å; L369-W399 HydrophobicContact CD2-CZ3 4.14Å; L369-W399 HydrophobicContact CG-CH2 4.49Å; L369-W399 HydrophobicContact CG-CZ3 4.25Å; L369-G404 VanDerWaalsContact CD2-O 3.3Å; L369-G404 WeakPolarHBondContact CD2-O 3.39Å
370	T	95.7	Very high	94.9	Very high	93 Å²	93	57.9 Å²	57.9	57%	0.571	30%	0.296	S	S	*	.			trans	-114.1	21.1	-172.6	60.7	0	0	0	0	112.9	T354 T368 H372	T354-T370 HydrophobicContact CG2-CG2 4.04Å; T368-T370 HydrophobicContact CG2-CG2 4.01Å; T370-H372 VanDerWaalsContact C-N 3.34Å; T370-H372 PolarHBondContact O-N 2.68Å
371	N	94.1	Very high	95	Very high	78 Å²	78	59 Å²	59	42%	0.417	30%	0.302	S	S	.	.			trans	-75.8	-23.8	-172.4	-62.3	-17.9	0	0	0	112.7	K397 W399	N371-K397 HydrophobicContact CB-CD 4.39Å; N371-K397 PolarHBondContact O-NZ 2.8Å; N371-W399 HydrophobicContact CB-CH2 3.66Å; N371-W399 HydrophobicContact CB-CZ2 4.38Å; N371-W399 WeakPolarHBondContact ND2-CH2 3.28Å; N371-W399 WeakPolarHBondContact ND2-CZ3 3.3Å
372	H	95	Very high	95.1	Very high	5 Å²	5	53.1 Å²	53.1	2%	0.023	27%	0.272	C	S	.	.			trans	-73.1	141.9	179	-72.9	-67.8	0	0	0	111.2	T370 V376 S390 D394 W399	T370-H372 VanDerWaalsContact C-N 3.34Å; T370-H372 PolarHBondContact O-N 2.68Å; H372-V376 HydrophobicContact CB-CG2 3.89Å; H372-V376 VanDerWaalsContact CD2-CG2 3.43Å; H372-V376 WeakPolarHBondContact CD2-CG2 3.42Å; H372-S390 PolarHBondContact CE1-OG 3.3Å; H372-S390 PolarHBondContact NE2-OG 2.69Å; H372-D394 IonicContact ND1-OD1 3.82Å; H372-D394 PolarHBondContact ND1-OD1 2.86Å; H372-D394 IonicContact ND1-OD2 2.7Å; H372-W399 AromaticContact NE2-CZ2 3.95Å
373	K	94.6	Very high	95.1	Very high	181 Å²	181	54.5 Å²	54.5	79%	0.787	28%	0.276	S	S	*	.	S	Bend	trans	-93.5	-23.8	178.2	-64.8	-177	178.6	-177.6	0	112.4	D394	K373-D394 PolarHBondContact N-OD2 3.28Å
374	K	95.7	Very high	95	Very high	114 Å²	114	61.8 Å²	61.8	50%	0.496	30%	0.298	S	S	.	.	S	Bend	trans	-119.9	174.5	-178.1	-66.8	-175.6	-174	171.8	0	110.1	S353 V376 S392 A393 D394	S353-K374 WeakPolarHBondContact CA-O 3.33Å; S353-K374 WeakPolarHBondContact CB-O 3.31Å; K374-V376 PolarHBondContact O-N 2.77Å; K374-S392 VanDerWaalsContact C-OG 3.26Å; K374-S392 WeakPolarHBondContact CB-OG 3.46Å; K374-S392 PolarHBondContact O-OG 3.49Å; K374-S392 VanDerWaalsContact O-OG 3.12Å; K374-A393 HydrophobicContact CB-CB 4.43Å; K374-A393 HydrophobicContact CD-CB 3.7Å; K374-A393 PolarHBondContact NZ-O 3.31Å; K374-A393 VanDerWaalsContact NZ-O 3.15Å; K374-D394 HydrophobicContact CD-CB 4.45Å; K374-D394 HydrophobicContact CG-CB 4.48Å
375	S	95.5	Very high	94.9	Very high	24 Å²	24	58.8 Å²	58.8	17%	0.168	29%	0.287	C	S	.	.			trans	-53.6	130.6	178.6	58.1	0	0	0	0	112.3	H351 S392	H351-S375 VanDerWaalsContact ND1-CB 3.28Å; H351-S375 WeakPolarHBondContact ND1-CB 3.36Å; S375-S392 VanDerWaalsContact O-CB 3.3Å; S375-S392 WeakPolarHBondContact O-CB 3.3Å; S375-S392 PolarHBondContact O-OG 3.23Å
376	V	96.9	Very high	94.8	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	114	170.2	-177.2	0	0	0	0	107.4	A335 S350 I355 H372 K374 L379	A335-V376 WeakPolarHBondContact CB-O 3.4Å; S350-V376 CarbonylContact C-O 3.55Å; S350-V376 PolarHBondContact O-N 2.89Å; I355-V376 HydrophobicContact CD1-CG1 4.29Å; I355-V376 HydrophobicContact CD1-CG2 4.39Å; I355-V376 HydrophobicContact CG1-CB 4.4Å; I355-V376 HydrophobicContact CG1-CG1 4.06Å; I355-V376 HydrophobicContact CG1-CG2 3.98Å; H372-V376 HydrophobicContact CB-CG2 3.89Å; H372-V376 VanDerWaalsContact CD2-CG2 3.43Å; H372-V376 WeakPolarHBondContact CD2-CG2 3.42Å; K374-V376 PolarHBondContact O-N 2.77Å; V376-L379 HydrophobicContact CG1-CD2 4.36Å
377	R	96.4	Very high	94.9	Very high	77 Å²	77	57 Å²	57	29%	0.291	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	-24.9	-174.3	-75.2	179.2	174.3	-122.7	-1.3	113.3	T336 G391 I417 N418	T336-R377 WeakPolarHBondContact CB-O 3.32Å; R377-G391 PolarHBondContact N-O 3.16Å; R377-G391 VanDerWaalsContact N-O 3.08Å; R377-I417 WeakPolarHBondContact CB-O 3.17Å; R377-I417 WeakPolarHBondContact CD-O 3.31Å; R377-N418 PolarHBondContact NH1-OD1 3.27Å; R377-N418 VanDerWaalsContact NH1-OD1 3.08Å
378	T	96.4	Very high	95.1	Very high	3 Å²	3	56.1 Å²	56.1	2%	0.018	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	145.2	-173	-178.3	0	0	0	0	111.4	S390 G391 I417 N418 L420	T378-S390 WeakPolarHBondContact O-CA 3.41Å; T378-G391 PolarHBondContact O-N 2.6Å; T378-I417 HydrophobicContact CG2-CG2 3.94Å; T378-N418 WeakPolarHBondContact CB-O 3.43Å; T378-L420 HydrophobicContact CG2-CB 4.22Å; T378-L420 HydrophobicContact CG2-CD1 3.92Å; T378-L420 HydrophobicContact CG2-CG 3.6Å; T378-L420 PolarHBondContact OG1-N 2.92Å
379	L	96.8	Very high	95.1	Very high	2 Å²	2	53 Å²	53	1%	0.01	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	144	175.9	-71.2	170.7	0	0	0	108	T336 R338 I347 I355 V376 F388 A389	T336-L379 HydrophobicContact CG2-CB 4.05Å; T336-L379 HydrophobicContact CG2-CD1 3.85Å; T336-L379 HydrophobicContact CG2-CG 3.68Å; R338-L379 HydrophobicContact CG-CB 4.04Å; R338-L379 PolarHBondContact NE-O 2.9Å; I347-L379 HydrophobicContact CB-CD1 4.39Å; I347-L379 HydrophobicContact CG2-CD1 3.63Å; I347-L379 HydrophobicContact CG2-CD2 4.46Å; I355-L379 HydrophobicContact CD1-CD2 4.09Å; I355-L379 HydrophobicContact CG1-CD2 4.43Å; I355-L379 HydrophobicContact CG2-CD2 4.31Å; V376-L379 HydrophobicContact CG1-CD2 4.36Å; L379-F388 HydrophobicContact CD2-CD2 4.19Å; L379-F388 HydrophobicContact CD2-CE2 4.24Å; L379-A389 WeakPolarHBondContact CA-O 3.34Å
380	V	96.7	Very high	95.2	Very high	14 Å²	14	52.2 Å²	52.2	9%	0.085	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	137.3	175.7	66.4	0	0	0	0	109.6	F388 A389 L420 V422 L428	V380-F388 CarbonylContact O-C 3.53Å; V380-F388 WeakPolarHBondContact O-CA 3.41Å; V380-F388 WeakPolarHBondContact O-CB 3.43Å; V380-A389 HydrophobicContact CG1-CB 3.79Å; V380-A389 PolarHBondContact N-O 2.93Å; V380-A389 PolarHBondContact O-N 2.81Å; V380-L420 HydrophobicContact CB-CB 3.94Å; V380-L420 HydrophobicContact CG1-CB 3.62Å; V380-L420 HydrophobicContact CG1-CD1 4.08Å; V380-L420 HydrophobicContact CG1-CG 4.49Å; V380-V422 HydrophobicContact CB-CG2 4.26Å; V380-V422 HydrophobicContact CG1-CG2 3.61Å; V380-V422 HydrophobicContact CG2-CB 3.92Å; V380-V422 HydrophobicContact CG2-CG2 3.61Å; V380-L428 HydrophobicContact CG1-CD1 4.01Å
381	L	96.3	Very high	95.1	Very high	40 Å²	40	47.8 Å²	47.8	21%	0.209	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	141.1	174	-57.9	178.4	0	0	0	108.6	R338 C339 Q340 I347 F388 F401	R338-L381 HydrophobicContact CB-CD1 4.03Å; R338-L381 HydrophobicContact CB-CD2 4.35Å; R338-L381 HydrophobicContact CB-CG 3.95Å; R338-L381 HydrophobicContact CG-CG 4.44Å; C339-L381 WeakPolarHBondContact O-CD1 3.07Å; Q340-L381 HydrophobicContact CB-CD1 3.85Å; Q340-L381 HydrophobicContact CG-CD1 4.39Å; I347-L381 HydrophobicContact CD1-CD2 3.72Å; L381-F388 HydrophobicContact CD2-CB 3.8Å; L381-F401 HydrophobicContact CD2-CE2 4.02Å; L381-F401 HydrophobicContact CD2-CZ 3.78Å
382	H	95.1	Very high	95.2	Very high	13 Å²	13	44.1 Å²	44.1	6%	0.06	20%	0.2	C	C	.	.			trans	-80.4	135.3	168.3	-174	-65.7	0	0	0	109	R384 Q385 T387 V422 W442	H382-R384 PolarHBondContact ND1-N 2.92Å; H382-Q385 HydrophobicContact CB-CB 4.34Å; H382-Q385 PolarHBondContact CE1-N 3.28Å; H382-Q385 PolarHBondContact ND1-N 2.76Å; H382-T387 WeakPolarHBondContact CB-O 3.39Å; H382-T387 PolarHBondContact N-O 3.27Å; H382-V422 HydrophobicContact CB-CG1 4.46Å; H382-W442 HydrophobicContact CB-CH2 4.17Å; H382-W442 HydrophobicContact CB-CZ2 3.75Å; H382-W442 AromaticContact CD2-CD1 3.5Å; H382-W442 VanDerWaalsContact CD2-CD1 3.5Å; H382-W442 AromaticContact CD2-CD2 3.6Å; H382-W442 AromaticContact CD2-CE2 3.48Å; H382-W442 VanDerWaalsContact CD2-CE2 3.48Å; H382-W442 AromaticContact CD2-CG 3.64Å; H382-W442 AromaticContact CD2-NE1 3.38Å; H382-W442 PolarHBondContact CD2-NE1 3.21Å; H382-W442 AromaticContact NE2-CD1 3.88Å
383	P	92	Very high	95	Very high	80 Å²	80	44.4 Å²	44.4	52%	0.519	20%	0.203	S	C	.	.	S	Bend	trans	-71.4	-34.5	-173.3	26.1	-35.6	0	0	0	114.1
384	R	90.8	Very high	94.7	Very high	169 Å²	169	37.1 Å²	37.1	64%	0.638	17%	0.173	S	C	*	.	S	Bend	trans	-100.9	-50.7	-179.4	-57.8	178.9	173.8	133.4	1.2	114.3	H382 S424 D425	H382-R384 PolarHBondContact ND1-N 2.92Å; R384-S424 PolarHBondContact NH1-O 2.93Å; R384-S424 PolarHBondContact NH1-OG 2.89Å; R384-S424 PolarHBondContact NH2-OG 2.78Å; R384-D425 IonicContact NH1-OD1 3.54Å
385	Q	90.9	Very high	94.6	Very high	89 Å²	89	33.6 Å²	33.6	42%	0.416	16%	0.16	S	C	.	.	S	Bend	trans	-77.1	136.3	178.3	-58.1	176.4	27	0	0	110.7	H382 T387	H382-Q385 HydrophobicContact CB-CB 4.34Å; H382-Q385 PolarHBondContact CE1-N 3.28Å; H382-Q385 PolarHBondContact ND1-N 2.76Å; Q385-T387 WeakPolarHBondContact CB-OG1 3.35Å; Q385-T387 PolarHBondContact O-N 3.36Å
386	Y	93.8	Very high	94.6	Very high	103 Å²	103	32.5 Å²	32.5	40%	0.404	15%	0.152	S	C	.	.	S	Bend	trans	-78.5	61.6	179.6	-171.1	-121.6	0	0	0	111.5	A342 E343 F401	A342-Y386 HydrophobicContact CB-CE2 3.79Å; E343-Y386 PolarHBondContact O-OH 2.81Å; Y386-F401 HydrophobicContact CD1-CB 3.47Å; Y386-F401 VanDerWaalsContact CD1-CB 3.47Å; Y386-F401 HydrophobicContact CD1-CG 4.5Å; Y386-F401 HydrophobicContact CD2-CB 4.11Å; Y386-F401 AromaticContact CD2-CD2 3.86Å; Y386-F401 HydrophobicContact CD2-CD2 3.86Å; Y386-F401 HydrophobicContact CD2-CG 4.4Å; Y386-F401 HydrophobicContact CE1-CB 3.12Å; Y386-F401 HydrophobicContact CE1-CG 4.27Å; Y386-F401 HydrophobicContact CE2-CB 3.78Å; Y386-F401 AromaticContact CE2-CD2 3.92Å; Y386-F401 HydrophobicContact CE2-CD2 3.92Å; Y386-F401 HydrophobicContact CE2-CG 4.12Å; Y386-F401 HydrophobicContact CG-CB 3.97Å; Y386-F401 HydrophobicContact CG-CD2 4.16Å; Y386-F401 PolarHBondContact O-N 3.13Å
387	T	95.6	Very high	94.6	Very high	11 Å²	11	33.3 Å²	33.3	7%	0.067	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	154.3	-172.4	52	0	0	0	0	109.7	H382 Q385 W399 I407 W442	H382-T387 WeakPolarHBondContact CB-O 3.39Å; H382-T387 PolarHBondContact N-O 3.27Å; Q385-T387 WeakPolarHBondContact CB-OG1 3.35Å; Q385-T387 PolarHBondContact O-N 3.36Å; T387-W399 CarbonylContact C-O 3.56Å; T387-W399 VanDerWaalsContact CA-O 3.22Å; T387-W399 WeakPolarHBondContact CA-O 3.41Å; T387-W399 WeakPolarHBondContact CB-O 3.3Å; T387-I407 HydrophobicContact CG2-CD1 3.6Å; T387-W442 VanDerWaalsContact OG1-CZ2 3.28Å; T387-W442 WeakPolarHBondContact OG1-CZ2 3.34Å
388	F	96.6	Very high	94.6	Very high	1 Å²	1	30 Å²	30	0%	0.004	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	155.4	175.8	71.9	-84.8	0	0	0	111.1	I347 I355 L357 L369 L379 V380 L381 Q398 W399 F401	I347-F388 HydrophobicContact CG2-CE2 4.38Å; I355-F388 HydrophobicContact CD1-CE2 4.45Å; I355-F388 HydrophobicContact CG2-CE2 4.28Å; L357-F388 HydrophobicContact CD2-CE1 4.28Å; L357-F388 HydrophobicContact CD2-CZ 4.17Å; L369-F388 HydrophobicContact CD1-CZ 3.76Å; L379-F388 HydrophobicContact CD2-CD2 4.19Å; L379-F388 HydrophobicContact CD2-CE2 4.24Å; V380-F388 CarbonylContact O-C 3.53Å; V380-F388 WeakPolarHBondContact O-CA 3.41Å; V380-F388 WeakPolarHBondContact O-CB 3.43Å; L381-F388 HydrophobicContact CD2-CB 3.8Å; F388-Q398 WeakPolarHBondContact O-CA 3.42Å; F388-W399 HydrophobicContact CD1-CB 3.71Å; F388-W399 HydrophobicContact CD2-CB 4.25Å; F388-W399 AromaticContact CD2-CD1 3.71Å; F388-W399 HydrophobicContact CD2-CG 4.26Å; F388-W399 HydrophobicContact CE1-CB 3.29Å; F388-W399 AromaticContact CE1-CG 3.99Å; F388-W399 HydrophobicContact CE1-CG 3.99Å; F388-W399 HydrophobicContact CE2-CB 3.85Å; F388-W399 AromaticContact CE2-CD1 3.28Å; F388-W399 AromaticContact CE2-CG 3.65Å; F388-W399 HydrophobicContact CE2-CG 3.65Å; F388-W399 AromaticContact CE2-NE1 3.96Å; F388-W399 HydrophobicContact CG-CB 4.19Å; F388-W399 HydrophobicContact CZ-CB 3.36Å; F388-W399 AromaticContact CZ-CD1 3.67Å; F388-W399 HydrophobicContact CZ-CD2 4.29Å; F388-W399 AromaticContact CZ-CG 3.51Å; F388-W399 HydrophobicContact CZ-CG 3.51Å; F388-W399 PolarHBondContact N-O 2.89Å; F388-W399 PolarHBondContact O-N 2.83Å; F388-F401 HydrophobicContact CB-CE2 4Å; F388-F401 HydrophobicContact CB-CZ 3.81Å; F388-F401 AromaticContact CD1-CD1 3.84Å; F388-F401 HydrophobicContact CD1-CD1 3.84Å; F388-F401 HydrophobicContact CD1-CD2 4.25Å; F388-F401 AromaticContact CD1-CE1 3.25Å; F388-F401 HydrophobicContact CD1-CE1 3.25Å; F388-F401 AromaticContact CD1-CE2 3.72Å; F388-F401 HydrophobicContact CD1-CE2 3.72Å; F388-F401 HydrophobicContact CD1-CG 4.3Å; F388-F401 AromaticContact CD1-CZ 3.18Å; F388-F401 HydrophobicContact CD1-CZ 3.18Å; F388-F401 AromaticContact CE1-CD1 3.89Å; F388-F401 HydrophobicContact CE1-CD1 3.89Å; F388-F401 AromaticContact CE1-CE1 3.46Å; F388-F401 HydrophobicContact CE1-CE1 3.46Å; F388-F401 VanDerWaalsContact CE1-CE1 3.46Å; F388-F401 AromaticContact CE1-CZ 3.91Å; F388-F401 HydrophobicContact CE1-CZ 3.91Å; F388-F401 HydrophobicContact CG-CE1 4.18Å; F388-F401 HydrophobicContact CG-CE2 4.29Å; F388-F401 AromaticContact CG-CZ 3.75Å; F388-F401 HydrophobicContact CG-CZ 3.75Å
389	A	96.8	Very high	94.6	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	150	173.9	0	0	0	0	0	110.6	L379 V380 I396 K397 Q398 L420 W442	L379-A389 WeakPolarHBondContact CA-O 3.34Å; V380-A389 HydrophobicContact CG1-CB 3.79Å; V380-A389 PolarHBondContact N-O 2.93Å; V380-A389 PolarHBondContact O-N 2.81Å; A389-I396 HydrophobicContact CB-CG2 4.42Å; A389-K397 CarbonylContact C-O 3.55Å; A389-K397 VanDerWaalsContact CA-O 3.28Å; A389-K397 WeakPolarHBondContact CA-O 3.45Å; A389-Q398 HydrophobicContact CB-CG 4.22Å; A389-L420 HydrophobicContact CB-CD1 4.29Å; A389-W442 HydrophobicContact CB-CH2 3.49Å; A389-W442 VanDerWaalsContact CB-CH2 3.49Å; A389-W442 HydrophobicContact CB-CZ3 3.45Å; A389-W442 VanDerWaalsContact CB-CZ3 3.45Å
390	S	96.6	Very high	94.5	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	132.5	178.6	59.9	0	0	0	0	109.7	H372 T378 I396 K397 W399	H372-S390 PolarHBondContact CE1-OG 3.3Å; H372-S390 PolarHBondContact NE2-OG 2.69Å; T378-S390 WeakPolarHBondContact O-CA 3.41Å; S390-I396 WeakPolarHBondContact O-CA 3.47Å; S390-K397 PolarHBondContact N-O 3.47Å; S390-K397 PolarHBondContact O-N 3.15Å; S390-K397 PolarHBondContact OG-O 2.99Å; S390-W399 PolarHBondContact OG-NE1 3.23Å
391	G	95.2	Very high	94.3	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	125.8	179.9	0	0	0	0	0	110.7	R377 T378 L420	R377-G391 PolarHBondContact N-O 3.16Å; R377-G391 VanDerWaalsContact N-O 3.08Å; T378-G391 PolarHBondContact O-N 2.6Å; G391-L420 VanDerWaalsContact N-CD1 3.33Å
392	S	94.6	Very high	94	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	170.3	168.5	-177.6	0	0	0	0	109.4	K374 S375 D394 N395 I417	K374-S392 VanDerWaalsContact C-OG 3.26Å; K374-S392 WeakPolarHBondContact CB-OG 3.46Å; K374-S392 PolarHBondContact O-OG 3.49Å; K374-S392 VanDerWaalsContact O-OG 3.12Å; S375-S392 VanDerWaalsContact O-CB 3.3Å; S375-S392 WeakPolarHBondContact O-CB 3.3Å; S375-S392 PolarHBondContact O-OG 3.23Å; S392-D394 WeakPolarHBondContact CB-OD1 3.49Å; S392-D394 PolarHBondContact O-N 3.48Å; S392-D394 PolarHBondContact OG-OD1 3.14Å; S392-N395 PolarHBondContact N-O 2.79Å; S392-I417 WeakPolarHBondContact O-CD1 3.48Å
393	A	91.1	Very high	93.7	Very high	11 Å²	11	38.6 Å²	38.6	9%	0.091	19%	0.189	C	C	.	.	S	Bend	trans	-76.3	3	179.8	0	0	0	0	0	113.6	K374 A415 I416	K374-A393 HydrophobicContact CB-CB 4.43Å; K374-A393 HydrophobicContact CD-CB 3.7Å; K374-A393 PolarHBondContact NZ-O 3.31Å; K374-A393 VanDerWaalsContact NZ-O 3.15Å; A393-A415 WeakPolarHBondContact CA-O 3.11Å; A393-I416 HydrophobicContact CB-CB 4.21Å; A393-I416 HydrophobicContact CB-CG1 3.9Å; A393-I416 HydrophobicContact CB-CG2 4.34Å
394	D	89	Confident	93.7	Very high	28 Å²	28	35 Å²	35	15%	0.15	17%	0.166	C	C	.	.	S	Bend	trans	-96.5	-65	170.6	59	-11.3	0	0	0	110.6	H372 K373 K374 S392	H372-D394 IonicContact ND1-OD1 3.82Å; H372-D394 PolarHBondContact ND1-OD1 2.86Å; H372-D394 IonicContact ND1-OD2 2.7Å; K373-D394 PolarHBondContact N-OD2 3.28Å; K374-D394 HydrophobicContact CD-CB 4.45Å; K374-D394 HydrophobicContact CG-CB 4.48Å; S392-D394 WeakPolarHBondContact CB-OD1 3.49Å; S392-D394 PolarHBondContact O-N 3.48Å; S392-D394 PolarHBondContact OG-OD1 3.14Å
395	N	92.8	Very high	93.8	Very high	41 Å²	41	30 Å²	30	22%	0.219	16%	0.158	C	C	.	.			trans	-150.7	164.6	177.5	-71	-49.9	0	0	0	110.7	S392 N409 S411	S392-N395 PolarHBondContact N-O 2.79Å; N395-N409 WeakPolarHBondContact CB-OD1 3.45Å; N395-N409 PolarHBondContact ND2-ND2 3.3Å; N395-N409 VanDerWaalsContact ND2-ND2 3.13Å; N395-S411 WeakPolarHBondContact OD1-CA 3.27Å; N395-S411 WeakPolarHBondContact OD1-CB 3.19Å
396	I	96.2	Very high	93.9	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	135.3	165.5	-58.9	164.7	0	0	0	107.7	A389 S390 N409 L410 I417 L420 L428	A389-I396 HydrophobicContact CB-CG2 4.42Å; S390-I396 WeakPolarHBondContact O-CA 3.47Å; I396-N409 PolarHBondContact O-OD1 2.85Å; I396-L410 HydrophobicContact CB-CB 3.89Å; I396-L410 HydrophobicContact CG2-CB 4.24Å; I396-L410 PolarHBondContact N-O 2.84Å; I396-L410 VanDerWaalsContact N-O 3.12Å; I396-L410 PolarHBondContact O-N 3.07Å; I396-I417 HydrophobicContact CD1-CD1 3.71Å; I396-I417 HydrophobicContact CG1-CD1 3.3Å; I396-L420 HydrophobicContact CD1-CD2 3.91Å; I396-L420 HydrophobicContact CG1-CD2 4.26Å; I396-L420 HydrophobicContact CG2-CD1 4.27Å; I396-L420 HydrophobicContact CG2-CD2 4.47Å; I396-L428 HydrophobicContact CG2-CD2 4.21Å
397	K	96.3	Very high	93.9	Very high	17 Å²	17	29.2 Å²	29.2	7%	0.074	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	141.1	178.4	-65	-178.5	-170.5	162.1	0	111	N371 A389 S390 W399 F406	N371-K397 HydrophobicContact CB-CD 4.39Å; N371-K397 PolarHBondContact O-NZ 2.8Å; A389-K397 CarbonylContact C-O 3.55Å; A389-K397 VanDerWaalsContact CA-O 3.28Å; A389-K397 WeakPolarHBondContact CA-O 3.45Å; S390-K397 PolarHBondContact N-O 3.47Å; S390-K397 PolarHBondContact O-N 3.15Å; S390-K397 PolarHBondContact OG-O 2.99Å; K397-W399 HydrophobicContact CB-CZ2 4.08Å; K397-W399 HydrophobicContact CD-CZ2 4.11Å; K397-W399 PolarHBondContact O-NE1 3.31Å; K397-F406 HydrophobicContact CB-CD2 4.49Å; K397-F406 HydrophobicContact CB-CE2 4.04Å; K397-F406 HydrophobicContact CD-CD2 4.42Å; K397-F406 HydrophobicContact CD-CE2 3.92Å; K397-F406 HydrophobicContact CG-CE2 3.93Å
398	Q	96.3	Very high	93.7	Very high	6 Å²	6	30.7 Å²	30.7	3%	0.028	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	143.5	173.6	-76.8	175	-13.3	0	0	111	F388 A389 I407 Q408 L410 W442	F388-Q398 WeakPolarHBondContact O-CA 3.42Å; A389-Q398 HydrophobicContact CB-CG 4.22Å; Q398-I407 HydrophobicContact CB-CB 4.42Å; Q398-I407 PolarHBondContact O-N 3.21Å; Q398-Q408 HydrophobicContact CB-CB 4.49Å; Q398-Q408 PolarHBondContact N-O 3.4Å; Q398-L410 HydrophobicContact CG-CD1 3.85Å; Q398-W442 HydrophobicContact CG-CH2 4.12Å; Q398-W442 HydrophobicContact CG-CZ2 4.2Å; Q398-W442 HydrophobicContact CG-CZ3 4.37Å; Q398-W442 VanDerWaalsContact NE2-CD2 3.27Å; Q398-W442 PolarHBondContact NE2-O 3.25Å; Q398-W442 PolarHBondContact OE1-O 3.18Å
399	W	96.3	Very high	93.5	Very high	1 Å²	1	33.4 Å²	33.4	0%	0.004	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	147.6	-172.4	-50.3	91.6	0	0	0	110.3	I355 L369 N371 H372 T387 F388 S390 K397 G404 S405 F406	I355-W399 HydrophobicContact CD1-CZ2 4.1Å; L369-W399 HydrophobicContact CB-CH2 3.83Å; L369-W399 HydrophobicContact CB-CZ2 4.45Å; L369-W399 HydrophobicContact CB-CZ3 4.04Å; L369-W399 HydrophobicContact CD1-CD2 3.96Å; L369-W399 HydrophobicContact CD1-CE3 3.78Å; L369-W399 HydrophobicContact CD1-CG 4.49Å; L369-W399 HydrophobicContact CD1-CH2 4.2Å; L369-W399 HydrophobicContact CD1-CZ2 4.46Å; L369-W399 HydrophobicContact CD1-CZ3 3.89Å; L369-W399 HydrophobicContact CD2-CZ3 4.14Å; L369-W399 HydrophobicContact CG-CH2 4.49Å; L369-W399 HydrophobicContact CG-CZ3 4.25Å; N371-W399 HydrophobicContact CB-CH2 3.66Å; N371-W399 HydrophobicContact CB-CZ2 4.38Å; N371-W399 WeakPolarHBondContact ND2-CH2 3.28Å; N371-W399 WeakPolarHBondContact ND2-CZ3 3.3Å; H372-W399 AromaticContact NE2-CZ2 3.95Å; T387-W399 CarbonylContact C-O 3.56Å; T387-W399 VanDerWaalsContact CA-O 3.22Å; T387-W399 WeakPolarHBondContact CA-O 3.41Å; T387-W399 WeakPolarHBondContact CB-O 3.3Å; F388-W399 HydrophobicContact CD1-CB 3.71Å; F388-W399 HydrophobicContact CD2-CB 4.25Å; F388-W399 AromaticContact CD2-CD1 3.71Å; F388-W399 HydrophobicContact CD2-CG 4.26Å; F388-W399 HydrophobicContact CE1-CB 3.29Å; F388-W399 AromaticContact CE1-CG 3.99Å; F388-W399 HydrophobicContact CE1-CG 3.99Å; F388-W399 HydrophobicContact CE2-CB 3.85Å; F388-W399 AromaticContact CE2-CD1 3.28Å; F388-W399 AromaticContact CE2-CG 3.65Å; F388-W399 HydrophobicContact CE2-CG 3.65Å; F388-W399 AromaticContact CE2-NE1 3.96Å; F388-W399 HydrophobicContact CG-CB 4.19Å; F388-W399 HydrophobicContact CZ-CB 3.36Å; F388-W399 AromaticContact CZ-CD1 3.67Å; F388-W399 HydrophobicContact CZ-CD2 4.29Å; F388-W399 AromaticContact CZ-CG 3.51Å; F388-W399 HydrophobicContact CZ-CG 3.51Å; F388-W399 PolarHBondContact N-O 2.89Å; F388-W399 PolarHBondContact O-N 2.83Å; S390-W399 PolarHBondContact OG-NE1 3.23Å; K397-W399 HydrophobicContact CB-CZ2 4.08Å; K397-W399 HydrophobicContact CD-CZ2 4.11Å; K397-W399 PolarHBondContact O-NE1 3.31Å; W399-G404 VanDerWaalsContact CE3-O 3.32Å; W399-S405 CarbonylContact C-O 3.53Å; W399-S405 VanDerWaalsContact CA-O 3.26Å; W399-S405 WeakPolarHBondContact CA-O 3.35Å; W399-F406 HydrophobicContact CE3-CB 4.08Å; W399-F406 HydrophobicContact CE3-CD2 4.33Å; W399-F406 HydrophobicContact CZ3-CB 4.04Å; W399-F406 HydrophobicContact CZ3-CD2 4.28Å
400	M	94.9	Very high	93.3	Very high	90 Å²	90	33.5 Å²	33.5	44%	0.443	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	136.4	174.4	-165.5	171	-91.1	0	0	110.1	G404 S405 I407	M400-G404 CarbonylContact O-C 3.59Å; M400-G404 WeakPolarHBondContact O-CA 3.47Å; M400-G404 PolarHBondContact O-N 2.89Å; M400-S405 WeakPolarHBondContact CB-OG 3.49Å; M400-S405 PolarHBondContact N-O 3.06Å; M400-S405 PolarHBondContact O-N 2.87Å; M400-I407 HydrophobicContact CB-CD1 3.76Å; M400-I407 HydrophobicContact CB-CG1 3.9Å; M400-I407 HydrophobicContact CE-CD1 4.27Å
401	F	92.7	Very high	93	Very high	10 Å²	10	37.1 Å²	37.1	4%	0.044	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	158.1	167.7	-68.4	-57.7	0	0	0	111.2	P344 I347 L357 L381 Y386 F388	P344-F401 HydrophobicContact CG-CD1 3.52Å; P344-F401 HydrophobicContact CG-CE1 3.55Å; I347-F401 HydrophobicContact CD1-CE1 3.71Å; I347-F401 HydrophobicContact CD1-CZ 3.45Å; I347-F401 VanDerWaalsContact CD1-CZ 3.45Å; I347-F401 HydrophobicContact CG1-CE1 3.98Å; I347-F401 HydrophobicContact CG1-CZ 4.2Å; L357-F401 HydrophobicContact CD2-CE1 4.17Å; L381-F401 HydrophobicContact CD2-CE2 4.02Å; L381-F401 HydrophobicContact CD2-CZ 3.78Å; Y386-F401 HydrophobicContact CD1-CB 3.47Å; Y386-F401 VanDerWaalsContact CD1-CB 3.47Å; Y386-F401 HydrophobicContact CD1-CG 4.5Å; Y386-F401 HydrophobicContact CD2-CB 4.11Å; Y386-F401 AromaticContact CD2-CD2 3.86Å; Y386-F401 HydrophobicContact CD2-CD2 3.86Å; Y386-F401 HydrophobicContact CD2-CG 4.4Å; Y386-F401 HydrophobicContact CE1-CB 3.12Å; Y386-F401 HydrophobicContact CE1-CG 4.27Å; Y386-F401 HydrophobicContact CE2-CB 3.78Å; Y386-F401 AromaticContact CE2-CD2 3.92Å; Y386-F401 HydrophobicContact CE2-CD2 3.92Å; Y386-F401 HydrophobicContact CE2-CG 4.12Å; Y386-F401 HydrophobicContact CG-CB 3.97Å; Y386-F401 HydrophobicContact CG-CD2 4.16Å; Y386-F401 PolarHBondContact O-N 3.13Å; F388-F401 HydrophobicContact CB-CE2 4Å; F388-F401 HydrophobicContact CB-CZ 3.81Å; F388-F401 AromaticContact CD1-CD1 3.84Å; F388-F401 HydrophobicContact CD1-CD1 3.84Å; F388-F401 HydrophobicContact CD1-CD2 4.25Å; F388-F401 AromaticContact CD1-CE1 3.25Å; F388-F401 HydrophobicContact CD1-CE1 3.25Å; F388-F401 AromaticContact CD1-CE2 3.72Å; F388-F401 HydrophobicContact CD1-CE2 3.72Å; F388-F401 HydrophobicContact CD1-CG 4.3Å; F388-F401 AromaticContact CD1-CZ 3.18Å; F388-F401 HydrophobicContact CD1-CZ 3.18Å; F388-F401 AromaticContact CE1-CD1 3.89Å; F388-F401 HydrophobicContact CE1-CD1 3.89Å; F388-F401 AromaticContact CE1-CE1 3.46Å; F388-F401 HydrophobicContact CE1-CE1 3.46Å; F388-F401 VanDerWaalsContact CE1-CE1 3.46Å; F388-F401 AromaticContact CE1-CZ 3.91Å; F388-F401 HydrophobicContact CE1-CZ 3.91Å; F388-F401 HydrophobicContact CG-CE1 4.18Å; F388-F401 HydrophobicContact CG-CE2 4.29Å; F388-F401 AromaticContact CG-CZ 3.75Å; F388-F401 HydrophobicContact CG-CZ 3.75Å
402	P	91.4	Very high	92.6	Very high	46 Å²	46	38.4 Å²	38.4	30%	0.299	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	cis	-90.7	-24.1	5.8	33	-32.9	0	0	0	114.7	G404	P402-G404 VanDerWaalsContact C-N 3.31Å; P402-G404 PolarHBondContact O-N 3.25Å
403	D	87.8	Confident	92.5	Very high	106 Å²	106	38.7 Å²	38.7	57%	0.567	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-3.1	-170.9	-56.4	-36.7	0	0	0	113.5	R366	R366-D403 IonicContact CZ-OD1 3.98Å; R366-D403 IonicContact NE-OD1 3.94Å; R366-D403 IonicContact NH2-OD1 3.97Å; R366-D403 PolarHBondContact NH2-OD1 3.14Å
404	G	91.3	Very high	92.4	Very high	4 Å²	4	45 Å²	45	4%	0.041	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	75.5	40.8	-179.5	0	0	0	0	0	112.5	L369 W399 M400 P402	L369-G404 VanDerWaalsContact CD2-O 3.3Å; L369-G404 WeakPolarHBondContact CD2-O 3.39Å; W399-G404 VanDerWaalsContact CE3-O 3.32Å; M400-G404 CarbonylContact O-C 3.59Å; M400-G404 WeakPolarHBondContact O-CA 3.47Å; M400-G404 PolarHBondContact O-N 2.89Å; P402-G404 VanDerWaalsContact C-N 3.31Å; P402-G404 PolarHBondContact O-N 3.25Å
405	S	93.1	Very high	92.6	Very high	66 Å²	66	44.3 Å²	44.3	46%	0.462	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	140.7	178.3	74	0	0	0	0	110.6	W399 M400 I407	W399-S405 CarbonylContact C-O 3.53Å; W399-S405 VanDerWaalsContact CA-O 3.26Å; W399-S405 WeakPolarHBondContact CA-O 3.35Å; M400-S405 WeakPolarHBondContact CB-OG 3.49Å; M400-S405 PolarHBondContact N-O 3.06Å; M400-S405 PolarHBondContact O-N 2.87Å; S405-I407 PolarHBondContact O-N 3.19Å
406	F	94.6	Very high	92.7	Very high	100 Å²	100	45.5 Å²	45.5	44%	0.439	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	122.3	-177.9	174.3	-103.7	0	0	0	110.5	K397 W399 Q408 N409	K397-F406 HydrophobicContact CB-CD2 4.49Å; K397-F406 HydrophobicContact CB-CE2 4.04Å; K397-F406 HydrophobicContact CD-CD2 4.42Å; K397-F406 HydrophobicContact CD-CE2 3.92Å; K397-F406 HydrophobicContact CG-CE2 3.93Å; W399-F406 HydrophobicContact CE3-CB 4.08Å; W399-F406 HydrophobicContact CE3-CD2 4.33Å; W399-F406 HydrophobicContact CZ3-CB 4.04Å; W399-F406 HydrophobicContact CZ3-CD2 4.28Å; F406-Q408 WeakPolarHBondContact CE2-O 3.5Å; F406-N409 HydrophobicContact CZ-CB 4Å
407	I	92.4	Very high	92.7	Very high	74 Å²	74	45.5 Å²	45.5	38%	0.379	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	-62.1	179.7	-58	164.8	0	0	0	110.2	T387 Q398 M400 S405	T387-I407 HydrophobicContact CG2-CD1 3.6Å; Q398-I407 HydrophobicContact CB-CB 4.42Å; Q398-I407 PolarHBondContact O-N 3.21Å; M400-I407 HydrophobicContact CB-CD1 3.76Å; M400-I407 HydrophobicContact CB-CG1 3.9Å; M400-I407 HydrophobicContact CE-CD1 4.27Å; S405-I407 PolarHBondContact O-N 3.19Å
408	Q	91.6	Very high	92.7	Very high	42 Å²	42	45.7 Å²	45.7	20%	0.196	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	148.1	-166.8	-174.4	172.4	-8.6	0	0	112.4	Q398 F406 L410 T444	Q398-Q408 HydrophobicContact CB-CB 4.49Å; Q398-Q408 PolarHBondContact N-O 3.4Å; F406-Q408 WeakPolarHBondContact CE2-O 3.5Å; Q408-L410 HydrophobicContact CB-CD1 4.44Å; Q408-L410 HydrophobicContact CG-CD1 4.09Å; Q408-T444 VanDerWaalsContact NE2-C 3.32Å; Q408-T444 PolarHBondContact NE2-O 3.21Å
409	N	93.7	Very high	92.7	Very high	59 Å²	59	45.8 Å²	45.8	32%	0.316	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	122.2	168.1	-161.7	38.8	0	0	0	110	N395 I396 F406	N395-N409 WeakPolarHBondContact CB-OD1 3.45Å; N395-N409 PolarHBondContact ND2-ND2 3.3Å; N395-N409 VanDerWaalsContact ND2-ND2 3.13Å; I396-N409 PolarHBondContact O-OD1 2.85Å; F406-N409 HydrophobicContact CZ-CB 4Å
410	L	92.2	Very high	92.7	Very high	2 Å²	2	46 Å²	46	1%	0.01	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	98.7	171.4	-78.5	76.5	0	0	0	107.6	I396 Q398 Q408 L428 W440	I396-L410 HydrophobicContact CB-CB 3.89Å; I396-L410 HydrophobicContact CG2-CB 4.24Å; I396-L410 PolarHBondContact N-O 2.84Å; I396-L410 VanDerWaalsContact N-O 3.12Å; I396-L410 PolarHBondContact O-N 3.07Å; Q398-L410 HydrophobicContact CG-CD1 3.85Å; Q408-L410 HydrophobicContact CB-CD1 4.44Å; Q408-L410 HydrophobicContact CG-CD1 4.09Å; L410-L428 HydrophobicContact CD2-CD2 3.75Å; L410-W440 HydrophobicContact CB-CE3 4.34Å; L410-W440 HydrophobicContact CB-CZ3 4.46Å; L410-W440 HydrophobicContact CD2-CB 4.01Å; L410-W440 HydrophobicContact CD2-CD2 4.15Å; L410-W440 HydrophobicContact CD2-CE3 4.08Å; L410-W440 HydrophobicContact CD2-CG 4.11Å; L410-W440 HydrophobicContact CG-CE3 4.46Å
411	S	89	Confident	92.8	Very high	75 Å²	75	41.9 Å²	41.9	52%	0.524	24%	0.24	S	C	.	.			trans	-103.4	148.1	179.7	57.7	0	0	0	0	111.7	N395	N395-S411 WeakPolarHBondContact OD1-CA 3.27Å; N395-S411 WeakPolarHBondContact OD1-CB 3.19Å
412	G	86.4	Confident	93	Very high	28 Å²	28	42.2 Å²	42.2	29%	0.289	24%	0.242	S	C	.	.			trans	135.1	-18.8	175	0	0	0	0	0	113.7	N414	G412-N414 PolarHBondContact O-N 2.75Å
413	H	92.6	Very high	93.2	Very high	6 Å²	6	40 Å²	40	3%	0.028	23%	0.228	C	C	.	.			trans	-87.6	87.3	171.8	-155.2	164.3	0	0	0	110.5	A415 I417 S430 A432 T436 W440	H413-A415 PolarHBondContact O-N 3.38Å; H413-I417 HydrophobicContact CB-CD1 4.24Å; H413-S430 PolarHBondContact CE1-O 3.22Å; H413-S430 PolarHBondContact ND1-OG 2.72Å; H413-A432 VanDerWaalsContact NE2-CB 3.25Å; H413-A432 WeakPolarHBondContact NE2-CB 3.39Å; H413-T436 PolarHBondContact CE1-O 2.78Å; H413-T436 PolarHBondContact NE2-O 3.27Å; H413-T436 PolarHBondContact NE2-OG1 3.17Å; H413-W440 HydrophobicContact CB-CZ2 3.96Å
414	N	90.1	Very high	93.4	Very high	144 Å²	144	35.7 Å²	35.7	77%	0.77	21%	0.206	S	C	*	.			trans	-83.3	58.5	-177.5	-63.3	-17	0	0	0	111.9	G412	G412-N414 PolarHBondContact O-N 2.75Å
415	A	93.5	Very high	93.3	Very high	12 Å²	12	39.5 Å²	39.5	10%	0.099	23%	0.226	C	C	.	.	S	Bend	trans	-147.9	170.6	-179.7	0	0	0	0	0	111.5	A393 H413 I417 A432	A393-A415 WeakPolarHBondContact CA-O 3.11Å; H413-A415 PolarHBondContact O-N 3.38Å; A415-I417 PolarHBondContact O-N 3.49Å; A415-A432 HydrophobicContact CB-CB 3.52Å
416	I	95.3	Very high	93.3	Very high	67 Å²	67	36.6 Å²	36.6	34%	0.344	21%	0.206	S	C	.	.			trans	-77.5	105.7	174.9	-58.3	171.9	0	0	0	108.2	A393 N418 A432 D433	A393-I416 HydrophobicContact CB-CB 4.21Å; A393-I416 HydrophobicContact CB-CG1 3.9Å; A393-I416 HydrophobicContact CB-CG2 4.34Å; I416-N418 PolarHBondContact O-N 3.23Å; I416-A432 CarbonylContact O-C 3.58Å; I416-A432 VanDerWaalsContact O-CA 3.22Å; I416-A432 WeakPolarHBondContact O-CA 3.34Å; I416-A432 WeakPolarHBondContact O-CB 3.48Å; I416-D433 HydrophobicContact CB-CB 4.01Å; I416-D433 HydrophobicContact CG2-CB 4.45Å; I416-D433 PolarHBondContact O-N 3.24Å
417	I	96.2	Very high	93.3	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	122.8	-179.8	-54.8	174.8	0	0	0	108.9	R377 T378 S392 I396 H413 A415 T419 L420	R377-I417 WeakPolarHBondContact CB-O 3.17Å; R377-I417 WeakPolarHBondContact CD-O 3.31Å; T378-I417 HydrophobicContact CG2-CG2 3.94Å; S392-I417 WeakPolarHBondContact O-CD1 3.48Å; I396-I417 HydrophobicContact CD1-CD1 3.71Å; I396-I417 HydrophobicContact CG1-CD1 3.3Å; H413-I417 HydrophobicContact CB-CD1 4.24Å; A415-I417 PolarHBondContact O-N 3.49Å; I417-T419 WeakPolarHBondContact CG2-O 3.32Å; I417-L420 HydrophobicContact CG2-CD2 4.18Å; I417-L420 HydrophobicContact CG2-CG 4.41Å
418	N	95.7	Very high	93.5	Very high	22 Å²	22	28.3 Å²	28.3	12%	0.118	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	-27.6	176.9	-70.8	-40.6	0	0	0	112.2	R377 T378 I416 G431 D433 I466	R377-N418 PolarHBondContact NH1-OD1 3.27Å; R377-N418 VanDerWaalsContact NH1-OD1 3.08Å; T378-N418 WeakPolarHBondContact CB-O 3.43Å; I416-N418 PolarHBondContact O-N 3.23Å; N418-G431 PolarHBondContact N-O 2.8Å; N418-D433 PolarHBondContact ND2-OD1 3.17Å; N418-I466 WeakPolarHBondContact CB-O 3.14Å; N418-I466 PolarHBondContact ND2-O 2.91Å
419	T	96.1	Very high	93.8	Very high	8 Å²	8	26.3 Å²	26.3	5%	0.049	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	145	-172.3	-174.7	0	0	0	0	112.5	I417 G431 I466 C469	I417-T419 WeakPolarHBondContact CG2-O 3.32Å; T419-G431 PolarHBondContact N-O 3.42Å; T419-G431 PolarHBondContact O-N 3.38Å; T419-I466 HydrophobicContact CG2-CG2 3.79Å; T419-C469 HydrophobicContact CG2-CB 3.99Å; T419-C469 WeakPolarHBondContact CG2-SG 3.35Å; T419-C469 PolarHBondContact OG1-N 3.25Å; T419-C469 PolarHBondContact OG1-SG 3.41Å
420	L	96.9	Very high	93.9	Very high	4 Å²	4	23.5 Å²	23.5	2%	0.021	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	137.3	168.4	-67.1	173.3	0	0	0	109	T378 V380 A389 G391 I396 I417 L428 V429 S430	T378-L420 HydrophobicContact CG2-CB 4.22Å; T378-L420 HydrophobicContact CG2-CD1 3.92Å; T378-L420 HydrophobicContact CG2-CG 3.6Å; T378-L420 PolarHBondContact OG1-N 2.92Å; V380-L420 HydrophobicContact CB-CB 3.94Å; V380-L420 HydrophobicContact CG1-CB 3.62Å; V380-L420 HydrophobicContact CG1-CD1 4.08Å; V380-L420 HydrophobicContact CG1-CG 4.49Å; A389-L420 HydrophobicContact CB-CD1 4.29Å; G391-L420 VanDerWaalsContact N-CD1 3.33Å; I396-L420 HydrophobicContact CD1-CD2 3.91Å; I396-L420 HydrophobicContact CG1-CD2 4.26Å; I396-L420 HydrophobicContact CG2-CD1 4.27Å; I396-L420 HydrophobicContact CG2-CD2 4.47Å; I417-L420 HydrophobicContact CG2-CD2 4.18Å; I417-L420 HydrophobicContact CG2-CG 4.41Å; L420-L428 HydrophobicContact CB-CD1 4.22Å; L420-L428 HydrophobicContact CD2-CD1 4.1Å; L420-V429 VanDerWaalsContact CA-O 3.26Å; L420-V429 WeakPolarHBondContact CA-O 3.17Å; L420-S430 VanDerWaalsContact CD2-CB 3.48Å
421	A	96.1	Very high	94.1	Very high	5 Å²	5	23.4 Å²	23.4	4%	0.041	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	141.1	172.2	0	0	0	0	0	109.3	L428 V429 F471	A421-L428 CarbonylContact O-C 3.6Å; A421-L428 WeakPolarHBondContact O-CA 3.18Å; A421-V429 HydrophobicContact CB-CB 4.32Å; A421-V429 PolarHBondContact N-O 3.37Å; A421-V429 VanDerWaalsContact N-O 3.07Å; A421-V429 PolarHBondContact O-N 3.41Å; A421-F471 HydrophobicContact CB-CD2 3.9Å; A421-F471 HydrophobicContact CB-CE2 3.99Å
422	V	96.4	Very high	94.4	Very high	16 Å²	16	19.9 Å²	19.9	10%	0.097	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	134.4	-179.2	172.8	0	0	0	0	108.8	V380 H382 V427 L428 W442 F471	V380-V422 HydrophobicContact CB-CG2 4.26Å; V380-V422 HydrophobicContact CG1-CG2 3.61Å; V380-V422 HydrophobicContact CG2-CB 3.92Å; V380-V422 HydrophobicContact CG2-CG2 3.61Å; H382-V422 HydrophobicContact CB-CG1 4.46Å; V422-V427 WeakPolarHBondContact CA-O 3.49Å; V422-L428 HydrophobicContact CG2-CB 4.39Å; V422-L428 HydrophobicContact CG2-CD1 3.43Å; V422-L428 VanDerWaalsContact CG2-CD1 3.43Å; V422-W442 HydrophobicContact CG2-CE3 3.96Å; V422-W442 HydrophobicContact CG2-CZ3 3.66Å; V422-F471 VanDerWaalsContact C-CD2 3.49Å; V422-F471 WeakPolarHBondContact O-CD2 3.31Å
423	N	95.2	Very high	94.8	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.005	12%	0.12	C	C	.	.			trans	-92.2	147.8	168.6	-179.6	-16	0	0	0	108.8	D425 G426 V427 F471 E475	N423-D425 PolarHBondContact O-N 3.31Å; N423-D425 PolarHBondContact OD1-N 2.84Å; N423-G426 PolarHBondContact O-N 2.61Å; N423-V427 HydrophobicContact CB-CB 4.07Å; N423-V427 PolarHBondContact N-O 2.88Å; N423-F471 HydrophobicContact CB-CD2 4.04Å; N423-F471 HydrophobicContact CB-CE1 4.25Å; N423-F471 HydrophobicContact CB-CE2 3.75Å; N423-F471 HydrophobicContact CB-CG 4.4Å; N423-F471 HydrophobicContact CB-CZ 3.85Å; N423-E475 PolarHBondContact ND2-O 2.91Å; N423-E475 WeakPolarHBondContact OD1-CB 3.48Å; N423-E475 PolarHBondContact OD1-OE2 3.29Å
424	S	92.8	Very high	94.9	Very high	14 Å²	14	24.6 Å²	24.6	10%	0.098	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-23.7	173.6	82.1	0	0	0	0	114.7	R384 G426 E475	R384-S424 PolarHBondContact NH1-O 2.93Å; R384-S424 PolarHBondContact NH1-OG 2.89Å; R384-S424 PolarHBondContact NH2-OG 2.78Å; S424-G426 PolarHBondContact O-N 2.84Å; S424-E475 WeakPolarHBondContact CB-OE1 3.47Å; S424-E475 WeakPolarHBondContact CB-OE2 3.33Å; S424-E475 VanDerWaalsContact N-CD 3.31Å; S424-E475 PolarHBondContact N-OE1 2.88Å; S424-E475 PolarHBondContact N-OE2 2.89Å; S424-E475 PolarHBondContact OG-OE2 2.94Å
425	D	90.4	Very high	95	Very high	85 Å²	85	17.7 Å²	17.7	46%	0.455	10%	0.099	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-2.6	173.8	-66.5	-21.4	0	0	0	113.4	H192 R384 N423	H192-D425 PolarHBondContact CE1-O 3.37Å; R384-D425 IonicContact NH1-OD1 3.54Å; N423-D425 PolarHBondContact O-N 3.31Å; N423-D425 PolarHBondContact OD1-N 2.84Å
426	G	91.7	Very high	95	Very high	5 Å²	5	18.4 Å²	18.4	5%	0.052	10%	0.102	C	C	.	.	S	Bend	trans	87.4	19.5	177.8	0	0	0	0	0	113.4	N423 S424 W442	N423-G426 PolarHBondContact O-N 2.61Å; S424-G426 PolarHBondContact O-N 2.84Å; G426-W442 WeakPolarHBondContact O-CA 3.41Å; G426-W442 WeakPolarHBondContact O-CB 3.45Å; G426-W442 PolarHBondContact O-N 3.32Å
427	V	95.3	Very high	95.1	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	9%	0.086	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	121.4	167.6	179.9	0	0	0	0	109.2	H192 V422 N423 M439 F448 F471	H192-V427 HydrophobicContact CB-CG2 4.14Å; H192-V427 WeakPolarHBondContact ND1-CG2 3.29Å; V422-V427 WeakPolarHBondContact CA-O 3.49Å; N423-V427 HydrophobicContact CB-CB 4.07Å; N423-V427 PolarHBondContact N-O 2.88Å; V427-M439 HydrophobicContact CG1-CE 3.7Å; V427-F448 HydrophobicContact CG1-CE1 4.12Å; V427-F448 HydrophobicContact CG1-CZ 3.89Å; V427-F448 HydrophobicContact CG2-CZ 4.35Å; V427-F471 HydrophobicContact CG1-CZ 4.39Å
428	L	96.5	Very high	95.1	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	126.9	171.5	169.7	72.8	0	0	0	109.6	V380 I396 L410 L420 A421 V422 M439 W440 W442	V380-L428 HydrophobicContact CG1-CD1 4.01Å; I396-L428 HydrophobicContact CG2-CD2 4.21Å; L410-L428 HydrophobicContact CD2-CD2 3.75Å; L420-L428 HydrophobicContact CB-CD1 4.22Å; L420-L428 HydrophobicContact CD2-CD1 4.1Å; A421-L428 CarbonylContact O-C 3.6Å; A421-L428 WeakPolarHBondContact O-CA 3.18Å; V422-L428 HydrophobicContact CG2-CB 4.39Å; V422-L428 HydrophobicContact CG2-CD1 3.43Å; V422-L428 VanDerWaalsContact CG2-CD1 3.43Å; L428-M439 CarbonylContact O-C 3.58Å; L428-M439 WeakPolarHBondContact O-CA 3.38Å; L428-W440 HydrophobicContact CB-CB 4.15Å; L428-W440 HydrophobicContact CD2-CB 4.34Å; L428-W440 HydrophobicContact CD2-CG 4.45Å; L428-W440 PolarHBondContact N-O 3.4Å; L428-W440 PolarHBondContact O-N 3.47Å; L428-W442 HydrophobicContact CB-CE3 4.13Å; L428-W442 HydrophobicContact CD1-CE3 4.45Å; L428-W442 HydrophobicContact CD1-CZ3 4.22Å; L428-W442 HydrophobicContact CD2-CE3 4.26Å; L428-W442 HydrophobicContact CD2-CZ3 4.34Å
429	V	97	Very high	95	Very high	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	135.5	172	-177.4	0	0	0	0	108.7	L420 A421 M437 M439 F471 L478	L420-V429 VanDerWaalsContact CA-O 3.26Å; L420-V429 WeakPolarHBondContact CA-O 3.17Å; A421-V429 HydrophobicContact CB-CB 4.32Å; A421-V429 PolarHBondContact N-O 3.37Å; A421-V429 VanDerWaalsContact N-O 3.07Å; A421-V429 PolarHBondContact O-N 3.41Å; V429-M437 HydrophobicContact CG1-CG 3.65Å; V429-M437 HydrophobicContact CG1-SD 3.55Å; V429-M437 VanDerWaalsContact CG1-SD 3.55Å; V429-M439 HydrophobicContact CB-SD 3.89Å; V429-M439 HydrophobicContact CG1-SD 3.77Å; V429-M439 HydrophobicContact CG2-CE 3.44Å; V429-M439 VanDerWaalsContact CG2-CE 3.44Å; V429-M439 HydrophobicContact CG2-SD 3.39Å; V429-M439 WeakPolarHBondContact CG2-SD 3.33Å; V429-F471 HydrophobicContact CG2-CE1 4.28Å; V429-F471 HydrophobicContact CG2-CE2 3.68Å; V429-F471 HydrophobicContact CG2-CZ 3.34Å; V429-L478 HydrophobicContact CB-CD1 4.41Å; V429-L478 HydrophobicContact CG1-CD1 4.34Å; V429-L478 HydrophobicContact CG1-CD2 4.02Å; V429-L478 HydrophobicContact CG2-CD1 3.78Å; V429-L478 HydrophobicContact CG2-CD2 3.8Å; V429-L478 HydrophobicContact CG2-CG 4.42Å
430	S	96.8	Very high	95	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	120.8	166.6	63.9	0	0	0	0	110.6	H413 L420 M437 H438 W440	H413-S430 PolarHBondContact CE1-O 3.22Å; H413-S430 PolarHBondContact ND1-OG 2.72Å; L420-S430 VanDerWaalsContact CD2-CB 3.48Å; S430-M437 CarbonylContact O-C 3.48Å; S430-M437 VanDerWaalsContact O-CA 3.28Å; S430-M437 WeakPolarHBondContact O-CA 3.45Å; S430-H438 PolarHBondContact N-O 3.03Å; S430-H438 PolarHBondContact O-N 2.65Å; S430-H438 PolarHBondContact OG-O 3.29Å; S430-W440 PolarHBondContact OG-NE1 3.45Å
431	G	96.5	Very high	94.9	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	132.7	176.5	0	0	0	0	0	111.2	N418 T419	N418-G431 PolarHBondContact N-O 2.8Å; T419-G431 PolarHBondContact N-O 3.42Å; T419-G431 PolarHBondContact O-N 3.38Å
432	A	96	Very high	94.7	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	164.8	-176.5	0	0	0	0	0	114	H413 A415 I416 N434 G435 T436 I466	H413-A432 VanDerWaalsContact NE2-CB 3.25Å; H413-A432 WeakPolarHBondContact NE2-CB 3.39Å; A415-A432 HydrophobicContact CB-CB 3.52Å; I416-A432 CarbonylContact O-C 3.58Å; I416-A432 VanDerWaalsContact O-CA 3.22Å; I416-A432 WeakPolarHBondContact O-CA 3.34Å; I416-A432 WeakPolarHBondContact O-CB 3.48Å; A432-N434 VanDerWaalsContact CB-OD1 3.27Å; A432-N434 WeakPolarHBondContact CB-OD1 3.48Å; A432-N434 PolarHBondContact O-N 3.06Å; A432-G435 PolarHBondContact O-N 3.05Å; A432-G435 VanDerWaalsContact O-N 3.13Å; A432-T436 PolarHBondContact N-O 3.3Å; A432-I466 PolarHBondContact O-N 2.98Å
433	D	94.1	Very high	94.5	Very high	63 Å²	63	19 Å²	19	34%	0.337	10%	0.096	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-15.3	-175.3	-147.2	41	0	0	0	114	I416 N418 G465	I416-D433 HydrophobicContact CB-CB 4.01Å; I416-D433 HydrophobicContact CG2-CB 4.45Å; I416-D433 PolarHBondContact O-N 3.24Å; N418-D433 PolarHBondContact ND2-OD1 3.17Å; D433-G465 WeakPolarHBondContact O-CA 3.15Å
434	N	93.5	Very high	94.2	Very high	70 Å²	70	19.1 Å²	19.1	37%	0.374	10%	0.096	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	6.3	175.2	66.8	-18.6	0	0	0	113	A432 T436 S464	A432-N434 VanDerWaalsContact CB-OD1 3.27Å; A432-N434 WeakPolarHBondContact CB-OD1 3.48Å; A432-N434 PolarHBondContact O-N 3.06Å; N434-T436 VanDerWaalsContact C-N 3.29Å; N434-T436 PolarHBondContact ND2-OG1 2.88Å; N434-T436 VanDerWaalsContact ND2-OG1 3.13Å; N434-T436 PolarHBondContact O-N 3Å; N434-T436 PolarHBondContact OD1-N 3.32Å; N434-T436 VanDerWaalsContact OD1-N 3.09Å; N434-T436 PolarHBondContact OD1-OG1 2.96Å; N434-S464 CarbonylContact C-O 3.59Å; N434-S464 WeakPolarHBondContact CA-O 3.35Å
435	G	92.3	Very high	94	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.098	C	C	.	.	S	Bend	trans	81.3	0.9	-179.5	0	0	0	0	0	115.1	A432 A453 S464	A432-G435 PolarHBondContact O-N 3.05Å; A432-G435 VanDerWaalsContact O-N 3.13Å; G435-A453 PolarHBondContact O-N 3.23Å; G435-S464 WeakPolarHBondContact CA-OG 3.38Å; G435-S464 PolarHBondContact N-O 3.23Å; G435-S464 VanDerWaalsContact N-O 3.13Å
436	T	95.3	Very high	94.1	Very high	26 Å²	26	17 Å²	17	16%	0.16	8%	0.084	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	134.5	170.8	58.1	0	0	0	0	110.6	H413 A432 N434	H413-T436 PolarHBondContact CE1-O 2.78Å; H413-T436 PolarHBondContact NE2-O 3.27Å; H413-T436 PolarHBondContact NE2-OG1 3.17Å; A432-T436 PolarHBondContact N-O 3.3Å; N434-T436 VanDerWaalsContact C-N 3.29Å; N434-T436 PolarHBondContact ND2-OG1 2.88Å; N434-T436 VanDerWaalsContact ND2-OG1 3.13Å; N434-T436 PolarHBondContact O-N 3Å; N434-T436 PolarHBondContact OD1-N 3.32Å; N434-T436 VanDerWaalsContact OD1-N 3.09Å; N434-T436 PolarHBondContact OD1-OG1 2.96Å
437	M	95.6	Very high	94.1	Very high	1 Å²	1	17.9 Å²	17.9	1%	0.005	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	133.1	170.9	-170.7	162.9	67.6	0	0	108.7	V429 S430 M439 I451 I466 L478 T480 Y490	V429-M437 HydrophobicContact CG1-CG 3.65Å; V429-M437 HydrophobicContact CG1-SD 3.55Å; V429-M437 VanDerWaalsContact CG1-SD 3.55Å; S430-M437 CarbonylContact O-C 3.48Å; S430-M437 VanDerWaalsContact O-CA 3.28Å; S430-M437 WeakPolarHBondContact O-CA 3.45Å; M437-M439 HydrophobicContact CG-SD 4.41Å; M437-I451 HydrophobicContact CB-CB 4.33Å; M437-I451 HydrophobicContact CE-CB 4.34Å; M437-I451 HydrophobicContact CE-CD1 3.85Å; M437-I451 HydrophobicContact CE-CG2 4.4Å; M437-I451 PolarHBondContact N-O 3.06Å; M437-I451 PolarHBondContact O-N 2.97Å; M437-I466 HydrophobicContact CB-CD1 3.73Å; M437-I466 HydrophobicContact CG-CD1 4.33Å; M437-I466 HydrophobicContact SD-CD1 4.28Å; M437-L478 HydrophobicContact CE-CD2 3.88Å; M437-L478 HydrophobicContact SD-CD2 3.85Å; M437-T480 HydrophobicContact CE-CG2 4.45Å; M437-T480 HydrophobicContact SD-CG2 3.79Å; M437-Y490 HydrophobicContact CE-CD1 4.21Å; M437-Y490 HydrophobicContact CE-CD2 4.07Å; M437-Y490 HydrophobicContact CE-CE1 4.01Å; M437-Y490 HydrophobicContact CE-CE2 3.86Å; M437-Y490 HydrophobicContact CE-CG 4.26Å
438	H	95.9	Very high	94	Very high	14 Å²	14	20.1 Å²	20.1	7%	0.065	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	138.2	175.7	-71.7	21.5	0	0	0	109.1	S430 W440 N447	S430-H438 PolarHBondContact N-O 3.03Å; S430-H438 PolarHBondContact O-N 2.65Å; S430-H438 PolarHBondContact OG-O 3.29Å; H438-W440 HydrophobicContact CB-CZ2 3.68Å; H438-W440 AromaticContact CD2-CZ2 3.75Å; H438-W440 PolarHBondContact O-NE1 3.01Å; H438-N447 PolarHBondContact CD2-ND2 3.01Å
439	M	95.4	Very high	93.8	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	128.5	178.9	-51.7	-65.2	-83.5	0	0	108.8	W195 V427 L428 V429 M437 N447 F448 Q449 L478	W195-M439 HydrophobicContact CB-CE 4.35Å; W195-M439 HydrophobicContact CD2-CE 3.86Å; W195-M439 HydrophobicContact CG-CE 3.58Å; V427-M439 HydrophobicContact CG1-CE 3.7Å; L428-M439 CarbonylContact O-C 3.58Å; L428-M439 WeakPolarHBondContact O-CA 3.38Å; V429-M439 HydrophobicContact CB-SD 3.89Å; V429-M439 HydrophobicContact CG1-SD 3.77Å; V429-M439 HydrophobicContact CG2-CE 3.44Å; V429-M439 VanDerWaalsContact CG2-CE 3.44Å; V429-M439 HydrophobicContact CG2-SD 3.39Å; V429-M439 WeakPolarHBondContact CG2-SD 3.33Å; M437-M439 HydrophobicContact CG-SD 4.41Å; M439-N447 WeakPolarHBondContact O-CA 3.37Å; M439-N447 PolarHBondContact O-OD1 3.46Å; M439-F448 HydrophobicContact CB-CD1 4.32Å; M439-F448 HydrophobicContact CB-CD2 4.49Å; M439-F448 HydrophobicContact CB-CE1 3.69Å; M439-F448 HydrophobicContact CB-CE2 3.87Å; M439-F448 HydrophobicContact CB-CZ 3.43Å; M439-F448 VanDerWaalsContact CB-CZ 3.43Å; M439-F448 HydrophobicContact CG-CZ 4.42Å; M439-F448 WeakPolarHBondContact O-CD1 3.49Å; M439-F448 PolarHBondContact O-N 3.14Å; M439-F448 VanDerWaalsContact O-N 3.13Å; M439-Q449 HydrophobicContact CB-CB 4.04Å; M439-Q449 HydrophobicContact CG-CB 4.15Å; M439-Q449 PolarHBondContact N-O 3.42Å; M439-L478 HydrophobicContact CE-CD2 4.18Å; M439-L478 HydrophobicContact SD-CD2 4.37Å
440	W	94.9	Very high	93.7	Very high	4 Å²	4	29.9 Å²	29.9	2%	0.015	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	144	-171	-49.2	80.6	0	0	0	110.3	L410 H413 L428 S430 H438 Y446 N447	L410-W440 HydrophobicContact CB-CE3 4.34Å; L410-W440 HydrophobicContact CB-CZ3 4.46Å; L410-W440 HydrophobicContact CD2-CB 4.01Å; L410-W440 HydrophobicContact CD2-CD2 4.15Å; L410-W440 HydrophobicContact CD2-CE3 4.08Å; L410-W440 HydrophobicContact CD2-CG 4.11Å; L410-W440 HydrophobicContact CG-CE3 4.46Å; H413-W440 HydrophobicContact CB-CZ2 3.96Å; L428-W440 HydrophobicContact CB-CB 4.15Å; L428-W440 HydrophobicContact CD2-CB 4.34Å; L428-W440 HydrophobicContact CD2-CG 4.45Å; L428-W440 PolarHBondContact N-O 3.4Å; L428-W440 PolarHBondContact O-N 3.47Å; S430-W440 PolarHBondContact OG-NE1 3.45Å; H438-W440 HydrophobicContact CB-CZ2 3.68Å; H438-W440 AromaticContact CD2-CZ2 3.75Å; H438-W440 PolarHBondContact O-NE1 3.01Å; W440-Y446 CarbonylContact C-O 3.5Å; W440-Y446 VanDerWaalsContact CA-O 3.29Å; W440-Y446 WeakPolarHBondContact CA-O 3.24Å; W440-N447 HydrophobicContact CD2-CB 4.17Å; W440-N447 HydrophobicContact CE3-CB 3.68Å; W440-N447 HydrophobicContact CH2-CB 3.97Å; W440-N447 HydrophobicContact CZ2-CB 4.4Å; W440-N447 HydrophobicContact CZ3-CB 3.61Å
441	D	94.4	Very high	93.5	Very high	3 Å²	3	31.1 Å²	31.1	2%	0.016	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	121.1	162.6	177.7	26.6	0	0	0	109	P189 Q190 H192 R443 T444 G445 Y446	P189-D441 WeakPolarHBondContact CA-OD2 3.46Å; P189-D441 WeakPolarHBondContact CB-OD2 3.34Å; Q190-D441 PolarHBondContact N-OD2 3.36Å; H192-D441 IonicContact NE2-OD1 3.29Å; H192-D441 PolarHBondContact NE2-OD1 2.89Å; D441-R443 VanDerWaalsContact C-N 3.32Å; D441-R443 PolarHBondContact O-N 3.04Å; D441-T444 WeakPolarHBondContact CB-OG1 3.48Å; D441-T444 PolarHBondContact O-N 3.38Å; D441-T444 WeakPolarHBondContact OD2-CG2 3.45Å; D441-T444 PolarHBondContact OD2-OG1 2.91Å; D441-G445 VanDerWaalsContact O-CA 3.26Å; D441-G445 WeakPolarHBondContact O-CA 3.46Å; D441-G445 PolarHBondContact O-N 3.34Å; D441-Y446 PolarHBondContact N-O 3.19Å
442	W	93.7	Very high	93.4	Very high	4 Å²	4	36.9 Å²	36.9	2%	0.015	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-41.6	-174.8	178.3	-97	0	0	0	112.2	H382 T387 A389 Q398 V422 G426 L428	H382-W442 HydrophobicContact CB-CH2 4.17Å; H382-W442 HydrophobicContact CB-CZ2 3.75Å; H382-W442 AromaticContact CD2-CD1 3.5Å; H382-W442 VanDerWaalsContact CD2-CD1 3.5Å; H382-W442 AromaticContact CD2-CD2 3.6Å; H382-W442 AromaticContact CD2-CE2 3.48Å; H382-W442 VanDerWaalsContact CD2-CE2 3.48Å; H382-W442 AromaticContact CD2-CG 3.64Å; H382-W442 AromaticContact CD2-NE1 3.38Å; H382-W442 PolarHBondContact CD2-NE1 3.21Å; H382-W442 AromaticContact NE2-CD1 3.88Å; T387-W442 VanDerWaalsContact OG1-CZ2 3.28Å; T387-W442 WeakPolarHBondContact OG1-CZ2 3.34Å; A389-W442 HydrophobicContact CB-CH2 3.49Å; A389-W442 VanDerWaalsContact CB-CH2 3.49Å; A389-W442 HydrophobicContact CB-CZ3 3.45Å; A389-W442 VanDerWaalsContact CB-CZ3 3.45Å; Q398-W442 HydrophobicContact CG-CH2 4.12Å; Q398-W442 HydrophobicContact CG-CZ2 4.2Å; Q398-W442 HydrophobicContact CG-CZ3 4.37Å; Q398-W442 VanDerWaalsContact NE2-CD2 3.27Å; Q398-W442 PolarHBondContact NE2-O 3.25Å; Q398-W442 PolarHBondContact OE1-O 3.18Å; V422-W442 HydrophobicContact CG2-CE3 3.96Å; V422-W442 HydrophobicContact CG2-CZ3 3.66Å; G426-W442 WeakPolarHBondContact O-CA 3.41Å; G426-W442 WeakPolarHBondContact O-CB 3.45Å; G426-W442 PolarHBondContact O-N 3.32Å; L428-W442 HydrophobicContact CB-CE3 4.13Å; L428-W442 HydrophobicContact CD1-CE3 4.45Å; L428-W442 HydrophobicContact CD1-CZ3 4.22Å; L428-W442 HydrophobicContact CD2-CE3 4.26Å; L428-W442 HydrophobicContact CD2-CZ3 4.34Å
443	R	90.9	Very high	92.8	Very high	110 Å²	110	37 Å²	37	42%	0.415	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-35.3	-173.5	178.6	175.3	55.8	80.1	2.1	113	K188 D441	K188-R443 PolarHBondContact O-NH1 3.42Å; K188-R443 VanDerWaalsContact O-NH1 3.14Å; K188-R443 PolarHBondContact O-NH2 3.24Å; D441-R443 VanDerWaalsContact C-N 3.32Å; D441-R443 PolarHBondContact O-N 3.04Å
444	T	89	Confident	92.4	Very high	3 Å²	3	37.6 Å²	37.6	2%	0.018	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.3	-15.5	-171.1	62	0	0	0	0	113.2	P187 P189 Q408 D441 Y446	P187-T444 HydrophobicContact CG-CG2 4.09Å; P187-T444 WeakPolarHBondContact O-CG2 3.46Å; P189-T444 HydrophobicContact CB-CG2 4.06Å; P189-T444 WeakPolarHBondContact CB-OG1 3.49Å; Q408-T444 VanDerWaalsContact NE2-C 3.32Å; Q408-T444 PolarHBondContact NE2-O 3.21Å; D441-T444 WeakPolarHBondContact CB-OG1 3.48Å; D441-T444 PolarHBondContact O-N 3.38Å; D441-T444 WeakPolarHBondContact OD2-CG2 3.45Å; D441-T444 PolarHBondContact OD2-OG1 2.91Å; T444-Y446 PolarHBondContact O-N 3.17Å; T444-Y446 WeakPolarHBondContact OG1-CB 3.14Å; T444-Y446 PolarHBondContact OG1-N 3.28Å
445	G	89.7	Confident	92.3	Very high	13 Å²	13	36 Å²	36	13%	0.134	18%	0.177	C	C	.	.			trans	66.1	19.5	-170.8	0	0	0	0	0	113.4	D441	D441-G445 VanDerWaalsContact O-CA 3.26Å; D441-G445 WeakPolarHBondContact O-CA 3.46Å; D441-G445 PolarHBondContact O-N 3.34Å
446	Y	91.4	Very high	92.2	Very high	40 Å²	40	38 Å²	38	16%	0.157	19%	0.186	C	C	.	.			trans	-75.3	125	177.5	179.4	-110.6	0	0	0	110.6	P189 W440 D441 T444 F448 I503 N504 W505	P189-Y446 HydrophobicContact CB-CD1 4.1Å; P189-Y446 HydrophobicContact CB-CG 4.13Å; P189-Y446 HydrophobicContact CG-CD1 4.06Å; P189-Y446 HydrophobicContact CG-CG 4.08Å; W440-Y446 CarbonylContact C-O 3.5Å; W440-Y446 VanDerWaalsContact CA-O 3.29Å; W440-Y446 WeakPolarHBondContact CA-O 3.24Å; D441-Y446 PolarHBondContact N-O 3.19Å; T444-Y446 PolarHBondContact O-N 3.17Å; T444-Y446 WeakPolarHBondContact OG1-CB 3.14Å; T444-Y446 PolarHBondContact OG1-N 3.28Å; Y446-F448 HydrophobicContact CD1-CB 3.86Å; Y446-F448 HydrophobicContact CE1-CB 3.7Å; Y446-F448 PolarHBondContact O-N 3.26Å; Y446-I503 HydrophobicContact CD1-CG2 4.07Å; Y446-I503 HydrophobicContact CE1-CG2 3.55Å; Y446-N504 WeakPolarHBondContact CE2-O 3.48Å; Y446-N504 WeakPolarHBondContact OH-CA 3.43Å; Y446-N504 PolarHBondContact OH-N 3.02Å; Y446-N504 PolarHBondContact OH-O 3.36Å; Y446-W505 AromaticContact CD2-CE3 3.56Å; Y446-W505 HydrophobicContact CD2-CE3 3.56Å; Y446-W505 AromaticContact CD2-CZ3 3.8Å; Y446-W505 HydrophobicContact CD2-CZ3 3.8Å; Y446-W505 HydrophobicContact CE2-CE3 4.14Å; Y446-W505 HydrophobicContact CG-CE3 4.09Å; Y446-W505 HydrophobicContact CG-CZ3 4.18Å
447	N	92.8	Very high	91.8	Very high	24 Å²	24	43 Å²	43	13%	0.128	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	104.6	171.3	-177.4	-10	0	0	0	109.4	H438 M439 W440 Q449 R450	H438-N447 PolarHBondContact CD2-ND2 3.01Å; M439-N447 WeakPolarHBondContact O-CA 3.37Å; M439-N447 PolarHBondContact O-OD1 3.46Å; W440-N447 HydrophobicContact CD2-CB 4.17Å; W440-N447 HydrophobicContact CE3-CB 3.68Å; W440-N447 HydrophobicContact CH2-CB 3.97Å; W440-N447 HydrophobicContact CZ2-CB 4.4Å; W440-N447 HydrophobicContact CZ3-CB 3.61Å; N447-Q449 PolarHBondContact OD1-N 2.65Å; N447-Q449 PolarHBondContact OD1-O 2.97Å; N447-R450 PolarHBondContact ND2-NE 3.39Å; N447-R450 VanDerWaalsContact ND2-NE 3.16Å
448	F	92.1	Very high	91.5	Very high	48 Å²	48	47.2 Å²	47.2	21%	0.211	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	-23.1	-179.4	67.3	-91.8	0	0	0	112.7	H192 V427 M439 Y446	H192-F448 HydrophobicContact CB-CD1 4.43Å; H192-F448 HydrophobicContact CB-CD2 4.35Å; H192-F448 HydrophobicContact CB-CE1 4.01Å; H192-F448 HydrophobicContact CB-CE2 3.93Å; H192-F448 HydrophobicContact CB-CZ 3.74Å; V427-F448 HydrophobicContact CG1-CE1 4.12Å; V427-F448 HydrophobicContact CG1-CZ 3.89Å; V427-F448 HydrophobicContact CG2-CZ 4.35Å; M439-F448 HydrophobicContact CB-CD1 4.32Å; M439-F448 HydrophobicContact CB-CD2 4.49Å; M439-F448 HydrophobicContact CB-CE1 3.69Å; M439-F448 HydrophobicContact CB-CE2 3.87Å; M439-F448 HydrophobicContact CB-CZ 3.43Å; M439-F448 VanDerWaalsContact CB-CZ 3.43Å; M439-F448 HydrophobicContact CG-CZ 4.42Å; M439-F448 WeakPolarHBondContact O-CD1 3.49Å; M439-F448 PolarHBondContact O-N 3.14Å; M439-F448 VanDerWaalsContact O-N 3.13Å; Y446-F448 HydrophobicContact CD1-CB 3.86Å; Y446-F448 HydrophobicContact CE1-CB 3.7Å; Y446-F448 PolarHBondContact O-N 3.26Å
449	Q	92.7	Very high	91.2	Very high	34 Å²	34	47.3 Å²	47.3	16%	0.159	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	135.4	-178.2	-163.2	-175.2	11.9	0	0	112.9	W195 M439 N447 I451	W195-Q449 PolarHBondContact O-NE2 3.48Å; M439-Q449 HydrophobicContact CB-CB 4.04Å; M439-Q449 HydrophobicContact CG-CB 4.15Å; M439-Q449 PolarHBondContact N-O 3.42Å; N447-Q449 PolarHBondContact OD1-N 2.65Å; N447-Q449 PolarHBondContact OD1-O 2.97Å; Q449-I451 HydrophobicContact CG-CD1 4.43Å; Q449-I451 HydrophobicContact CG-CG1 4.06Å
450	R	94.4	Very high	91.1	Very high	171 Å²	171	52.6 Å²	52.6	65%	0.645	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.2	126.4	171.7	-60.1	-177.4	-177	177.7	-0.7	108.9	N447	N447-R450 PolarHBondContact ND2-NE 3.39Å; N447-R450 VanDerWaalsContact ND2-NE 3.16Å
451	I	93.7	Very high	90.7	Very high	25 Å²	25	58.8 Å²	58.8	13%	0.128	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	133.4	178.7	-58.1	176.4	0	0	0	106.9	W195 M437 Q449 Y490	W195-I451 HydrophobicContact CB-CD1 4.27Å; M437-I451 HydrophobicContact CB-CB 4.33Å; M437-I451 HydrophobicContact CE-CB 4.34Å; M437-I451 HydrophobicContact CE-CD1 3.85Å; M437-I451 HydrophobicContact CE-CG2 4.4Å; M437-I451 PolarHBondContact N-O 3.06Å; M437-I451 PolarHBondContact O-N 2.97Å; Q449-I451 HydrophobicContact CG-CD1 4.43Å; Q449-I451 HydrophobicContact CG-CG1 4.06Å; I451-Y490 HydrophobicContact CD1-CD1 4.3Å; I451-Y490 HydrophobicContact CD1-CE1 4.23Å; I451-Y490 HydrophobicContact CG2-CE1 4.03Å
452	H	93.1	Very high	90.4	Very high	121 Å²	121	63.3 Å²	63.3	56%	0.56	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.2	112.3	166	-177.4	-98	0	0	0	106.5	A454	H452-A454 PolarHBondContact O-N 3.05Å
453	A	83	Confident	90.3	Very high	2 Å²	2	66.4 Å²	66.4	2%	0.017	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-65	126.4	-178.9	0	0	0	0	0	108.9	G435 S464 K488	G435-A453 PolarHBondContact O-N 3.23Å; A453-S464 PolarHBondContact O-OG 3.24Å; A453-K488 HydrophobicContact CB-CD 4.47Å
454	A	87.1	Confident	90.3	Very high	77 Å²	77	61.3 Å²	61.3	64%	0.636	35%	0.353	S	S	*	.	P	Polyproline II helix	trans	-72.5	134.3	172.9	0	0	0	0	0	108.7	H452 K488	H452-A454 PolarHBondContact O-N 3.05Å; A454-K488 PolarHBondContact O-NZ 2.81Å
455	V	90.9	Very high	90.6	Very high	37 Å²	37	61.2 Å²	61.2	22%	0.224	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-68.4	152.1	179.1	-64.9	0	0	0	0	111.2
456	Q	89.4	Confident	90.9	Very high	41 Å²	41	60.6 Å²	60.6	19%	0.192	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-64.8	152.8	173.4	77.5	-176.7	-11.7	0	0	111.7	G458 S459 D484 T486	Q456-G458 PolarHBondContact O-N 2.98Å; Q456-S459 WeakPolarHBondContact O-CB 3.42Å; Q456-S459 PolarHBondContact O-N 3.49Å; Q456-S459 VanDerWaalsContact O-N 3.12Å; Q456-D484 HydrophobicContact CG-CB 4.09Å; Q456-D484 PolarHBondContact N-OD2 3.42Å; Q456-D484 VanDerWaalsContact N-OD2 3.09Å; Q456-D484 PolarHBondContact NE2-O 2.89Å; Q456-D484 PolarHBondContact OE1-O 3.47Å; Q456-T486 HydrophobicContact CB-CG2 3.86Å; Q456-T486 HydrophobicContact CG-CG2 4.31Å
457	P	88.7	Confident	91.1	Very high	131 Å²	131	60.1 Å²	60.1	85%	0.851	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	129.2	171.4	-25	34.7	0	0	0	112
458	G	87.9	Confident	91.3	Very high	89 Å²	89	59.6 Å²	59.6	92%	0.918	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.9	-2.4	-179.3	0	0	0	0	0	115.3	Q456	Q456-G458 PolarHBondContact O-N 2.98Å
459	S	90.8	Very high	91.5	Very high	17 Å²	17	57.7 Å²	57.7	12%	0.119	34%	0.337	C	S	.	.	S	Bend	trans	-93.8	151.3	169.3	-166.3	0	0	0	0	110.3	Q456 E463	Q456-S459 WeakPolarHBondContact O-CB 3.42Å; Q456-S459 PolarHBondContact O-N 3.49Å; Q456-S459 VanDerWaalsContact O-N 3.12Å; S459-E463 WeakPolarHBondContact CA-OE2 3.44Å; S459-E463 WeakPolarHBondContact CB-OE2 3.38Å; S459-E463 VanDerWaalsContact OG-CB 3.31Å; S459-E463 WeakPolarHBondContact OG-CB 3.34Å; S459-E463 PolarHBondContact OG-OE2 3.21Å
460	L	91.8	Very high	91.7	Very high	110 Å²	110	59 Å²	59	58%	0.576	35%	0.345	S	S	*	.			trans	-80.7	151.6	177.5	-174.4	59.3	0	0	0	110.3	S462 E463	L460-S462 WeakPolarHBondContact CD2-OG 3.5Å; L460-S462 WeakPolarHBondContact CG-OG 2.98Å; L460-S462 PolarHBondContact O-N 3.47Å; L460-S462 VanDerWaalsContact O-N 3.12Å; L460-E463 HydrophobicContact CB-CG 4.14Å; L460-E463 PolarHBondContact N-OE2 3.44Å; L460-E463 WeakPolarHBondContact O-CB 3.49Å; L460-E463 PolarHBondContact O-N 2.85Å
461	D	87.7	Confident	91.8	Very high	135 Å²	135	51.4 Å²	51.4	72%	0.722	32%	0.317	S	S	*	.	G	3₁₀ helix	trans	-57.8	-30.1	176.9	-66.9	-29.8	0	0	0	112.7	E463 S464	D461-E463 VanDerWaalsContact C-N 3.26Å; D461-E463 PolarHBondContact O-N 3.4Å; D461-S464 WeakPolarHBondContact O-CB 2.92Å; D461-S464 PolarHBondContact O-N 3.02Å
462	S	88.6	Confident	91.9	Very high	97 Å²	97	50.4 Å²	50.4	68%	0.678	31%	0.311	S	S	*	.	G	3₁₀ helix	trans	-74.8	-12.4	175.6	65.8	0	0	0	0	114.2	L460	L460-S462 WeakPolarHBondContact CD2-OG 3.5Å; L460-S462 WeakPolarHBondContact CG-OG 2.98Å; L460-S462 PolarHBondContact O-N 3.47Å; L460-S462 VanDerWaalsContact O-N 3.12Å
463	E	89.7	Confident	91.8	Very high	69 Å²	69	50 Å²	50	32%	0.322	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-86.6	5	173.6	-65.7	179.5	146.9	0	0	111.9	S459 L460 D461 G465 A483 D484	S459-E463 WeakPolarHBondContact CA-OE2 3.44Å; S459-E463 WeakPolarHBondContact CB-OE2 3.38Å; S459-E463 VanDerWaalsContact OG-CB 3.31Å; S459-E463 WeakPolarHBondContact OG-CB 3.34Å; S459-E463 PolarHBondContact OG-OE2 3.21Å; L460-E463 HydrophobicContact CB-CG 4.14Å; L460-E463 PolarHBondContact N-OE2 3.44Å; L460-E463 WeakPolarHBondContact O-CB 3.49Å; L460-E463 PolarHBondContact O-N 2.85Å; D461-E463 VanDerWaalsContact C-N 3.26Å; D461-E463 PolarHBondContact O-N 3.4Å; E463-G465 PolarHBondContact O-N 3.43Å; E463-A483 CarbonylContact O-C 3.5Å; E463-A483 WeakPolarHBondContact O-CB 3.35Å; E463-D484 PolarHBondContact O-N 3.01Å
464	S	91.6	Very high	92.3	Very high	4 Å²	4	53.2 Å²	53.2	3%	0.028	33%	0.332	C	S	.	.			trans	-70.9	110.7	168.9	-162.2	0	0	0	0	109.7	N434 G435 A453 D461	N434-S464 CarbonylContact C-O 3.59Å; N434-S464 WeakPolarHBondContact CA-O 3.35Å; G435-S464 WeakPolarHBondContact CA-OG 3.38Å; G435-S464 PolarHBondContact N-O 3.23Å; G435-S464 VanDerWaalsContact N-O 3.13Å; A453-S464 PolarHBondContact O-OG 3.24Å; D461-S464 WeakPolarHBondContact O-CB 2.92Å; D461-S464 PolarHBondContact O-N 3.02Å
465	G	94.7	Very high	92.5	Very high	1 Å²	1	51.5 Å²	51.5	1%	0.01	31%	0.311	C	S	.	.			trans	-164.2	138.4	-178.1	0	0	0	0	0	111.3	D433 E463 E482 A483	D433-G465 WeakPolarHBondContact O-CA 3.15Å; E463-G465 PolarHBondContact O-N 3.43Å; G465-E482 CarbonylContact O-C 3.34Å; G465-E482 WeakPolarHBondContact O-CA 3.43Å; G465-A483 PolarHBondContact O-N 3.37Å
466	I	96.7	Very high	92.5	Very high	0 Å²	0	52 Å²	52	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	122	177.1	-57.1	169.2	0	0	0	107.6	N418 T419 A432 M437 E482	N418-I466 WeakPolarHBondContact CB-O 3.14Å; N418-I466 PolarHBondContact ND2-O 2.91Å; T419-I466 HydrophobicContact CG2-CG2 3.79Å; A432-I466 PolarHBondContact O-N 2.98Å; M437-I466 HydrophobicContact CB-CD1 3.73Å; M437-I466 HydrophobicContact CG-CD1 4.33Å; M437-I466 HydrophobicContact SD-CD1 4.28Å; I466-E482 HydrophobicContact CG1-CG 4.22Å
467	F	96.7	Very high	92.8	Very high	29 Å²	29	52.8 Å²	52.8	13%	0.127	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	-39.8	-179.8	-71.1	-54.9	0	0	0	113	W207 V208 A481 A483	W207-F467 HydrophobicContact CB-CD2 4.22Å; W207-F467 HydrophobicContact CB-CE2 3.67Å; W207-F467 HydrophobicContact CD2-CE2 4.06Å; W207-F467 HydrophobicContact CD2-CZ 4.2Å; W207-F467 HydrophobicContact CE3-CE2 4.21Å; W207-F467 HydrophobicContact CE3-CZ 4Å; W207-F467 AromaticContact CG-CE2 3.85Å; W207-F467 HydrophobicContact CG-CE2 3.85Å; W207-F467 HydrophobicContact CG-CZ 4.47Å; V208-F467 WeakPolarHBondContact O-CB 3.36Å; V208-F467 VanDerWaalsContact O-CD2 3.31Å; V208-F467 WeakPolarHBondContact O-CD2 3.38Å; F467-A481 PolarHBondContact N-O 3.45Å; F467-A483 HydrophobicContact CD2-CB 4.18Å; F467-A483 HydrophobicContact CE2-CB 3.42Å; F467-A483 VanDerWaalsContact CE2-CB 3.42Å; F467-A483 HydrophobicContact CZ-CB 3.91Å
468	A	96.4	Very high	93.2	Very high	14 Å²	14	46.6 Å²	46.6	12%	0.116	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	148	176.4	0	0	0	0	0	110.2	T480 A481	A468-T480 WeakPolarHBondContact O-CA 3.43Å; A468-A481 HydrophobicContact CB-CB 4.2Å; A468-A481 PolarHBondContact N-O 3.35Å; A468-A481 PolarHBondContact O-N 3.08Å
469	C	96.3	Very high	93.6	Very high	7 Å²	7	42.3 Å²	42.3	5%	0.047	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	146.1	168.3	65.4	0	0	0	0	109.1	T419 L478 I479 T480	T419-C469 HydrophobicContact CG2-CB 3.99Å; T419-C469 WeakPolarHBondContact CG2-SG 3.35Å; T419-C469 PolarHBondContact OG1-N 3.25Å; T419-C469 PolarHBondContact OG1-SG 3.41Å; C469-L478 HydrophobicContact CB-CD1 4.21Å; C469-I479 CarbonylContact C-O 3.48Å; C469-I479 VanDerWaalsContact CA-O 3.23Å; C469-I479 WeakPolarHBondContact CA-O 3.47Å; C469-T480 HydrophobicContact CB-CG2 3.96Å
470	L	96.4	Very high	94	Very high	62 Å²	62	41.5 Å²	41.5	33%	0.325	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	143.6	179.1	-163.2	85.3	0	0	0	109.1	I211 V213 I479	I211-L470 HydrophobicContact CG2-CB 4.47Å; V213-L470 HydrophobicContact CB-CD2 3.93Å; V213-L470 HydrophobicContact CG2-CD2 3.72Å; L470-I479 PolarHBondContact N-O 3.42Å; L470-I479 PolarHBondContact O-N 2.91Å
471	F	96.8	Very high	94.2	Very high	12 Å²	12	36.3 Å²	36.3	5%	0.053	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	150.7	164.2	-70.4	-74.3	0	0	0	110.4	W195 A421 V422 N423 V427 V429 E475 R477 L478	W195-F471 AromaticContact CH2-CD1 4Å; W195-F471 HydrophobicContact CH2-CD1 4Å; W195-F471 AromaticContact CH2-CE1 3.48Å; W195-F471 HydrophobicContact CH2-CE1 3.48Å; W195-F471 VanDerWaalsContact CH2-CE1 3.48Å; W195-F471 AromaticContact CZ2-CE1 3.63Å; W195-F471 HydrophobicContact CZ2-CE1 3.63Å; W195-F471 HydrophobicContact CZ2-CZ 4.4Å; W195-F471 HydrophobicContact CZ3-CE1 4.14Å; A421-F471 HydrophobicContact CB-CD2 3.9Å; A421-F471 HydrophobicContact CB-CE2 3.99Å; V422-F471 VanDerWaalsContact C-CD2 3.49Å; V422-F471 WeakPolarHBondContact O-CD2 3.31Å; N423-F471 HydrophobicContact CB-CD2 4.04Å; N423-F471 HydrophobicContact CB-CE1 4.25Å; N423-F471 HydrophobicContact CB-CE2 3.75Å; N423-F471 HydrophobicContact CB-CG 4.4Å; N423-F471 HydrophobicContact CB-CZ 3.85Å; V427-F471 HydrophobicContact CG1-CZ 4.39Å; V429-F471 HydrophobicContact CG2-CE1 4.28Å; V429-F471 HydrophobicContact CG2-CE2 3.68Å; V429-F471 HydrophobicContact CG2-CZ 3.34Å; F471-E475 HydrophobicContact CB-CG 4.45Å; F471-R477 WeakPolarHBondContact CA-O 3.41Å; F471-L478 HydrophobicContact CD1-CB 4.08Å; F471-L478 HydrophobicContact CD1-CD1 4.15Å; F471-L478 HydrophobicContact CE1-CB 3.89Å; F471-L478 HydrophobicContact CE1-CD1 3.97Å; F471-L478 HydrophobicContact CE1-CG 4.43Å; F471-L478 HydrophobicContact CE2-CD1 4.43Å; F471-L478 HydrophobicContact CG-CD1 4.46Å; F471-L478 HydrophobicContact CZ-CD1 4.14Å
472	D	95.1	Very high	94.6	Very high	3 Å²	3	29.9 Å²	29.9	2%	0.016	17%	0.165	C	C	.	.			trans	-73.1	167.5	166.6	82.6	-59.8	0	0	0	110.6	V213 N217 L234 S474 E475 S476 R477	V213-D472 HydrophobicContact CG1-CB 4.44Å; N217-D472 PolarHBondContact ND2-OD2 3.44Å; N217-D472 WeakPolarHBondContact OD1-CB 3.28Å; N217-D472 PolarHBondContact OD1-OD2 3.13Å; L234-D472 HydrophobicContact CD2-CB 4.18Å; D472-S474 PolarHBondContact O-N 3.22Å; D472-S474 PolarHBondContact OD1-OG 3.1Å; D472-S474 WeakPolarHBondContact OD2-CB 3.39Å; D472-S474 PolarHBondContact OD2-N 3.11Å; D472-S474 PolarHBondContact OD2-OG 3.11Å; D472-E475 WeakPolarHBondContact O-CA 3.31Å; D472-E475 PolarHBondContact O-N 3.09Å; D472-E475 WeakPolarHBondContact OD1-CA 3.45Å; D472-E475 PolarHBondContact OD1-N 3.36Å; D472-S476 PolarHBondContact OD1-N 2.84Å; D472-R477 HydrophobicContact CB-CB 4.31Å; D472-R477 PolarHBondContact N-O 3.24Å; D472-R477 PolarHBondContact OD1-N 2.86Å; D472-R477 VanDerWaalsContact OD1-O 3.12Å
473	H	92.3	Very high	94.9	Very high	114 Å²	114	25.6 Å²	25.6	53%	0.528	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-20.4	-177.5	-85.2	37.5	0	0	0	113.6	P215 N217 E475	P215-H473 PolarHBondContact O-CD2 2.96Å; N217-H473 PolarHBondContact OD1-N 3.24Å; H473-E475 VanDerWaalsContact C-N 3.27Å
474	S	92.1	Very high	95.2	Very high	68 Å²	68	22.3 Å²	22.3	48%	0.476	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-8.8	169.9	80	0	0	0	0	113.3	D472 S476	D472-S474 PolarHBondContact O-N 3.22Å; D472-S474 PolarHBondContact OD1-OG 3.1Å; D472-S474 WeakPolarHBondContact OD2-CB 3.39Å; D472-S474 PolarHBondContact OD2-N 3.11Å; D472-S474 PolarHBondContact OD2-OG 3.11Å; S474-S476 PolarHBondContact O-N 2.91Å; S474-S476 PolarHBondContact OG-OG 2.85Å
475	E	92.5	Very high	95.4	Very high	42 Å²	42	25.6 Å²	25.6	20%	0.196	13%	0.134	C	C	.	.	S	Bend	trans	57.9	11.2	-177.7	-56	175.7	140.7	0	0	115.2	N423 S424 F471 D472 H473	N423-E475 PolarHBondContact ND2-O 2.91Å; N423-E475 WeakPolarHBondContact OD1-CB 3.48Å; N423-E475 PolarHBondContact OD1-OE2 3.29Å; S424-E475 WeakPolarHBondContact CB-OE1 3.47Å; S424-E475 WeakPolarHBondContact CB-OE2 3.33Å; S424-E475 VanDerWaalsContact N-CD 3.31Å; S424-E475 PolarHBondContact N-OE1 2.88Å; S424-E475 PolarHBondContact N-OE2 2.89Å; S424-E475 PolarHBondContact OG-OE2 2.94Å; F471-E475 HydrophobicContact CB-CG 4.45Å; D472-E475 WeakPolarHBondContact O-CA 3.31Å; D472-E475 PolarHBondContact O-N 3.09Å; D472-E475 WeakPolarHBondContact OD1-CA 3.45Å; D472-E475 PolarHBondContact OD1-N 3.36Å; H473-E475 VanDerWaalsContact C-N 3.27Å
476	S	91.6	Very high	95.5	Very high	47 Å²	47	25.6 Å²	25.6	33%	0.329	13%	0.134	S	C	.	.	S	Bend	trans	-83.9	-15.2	177.8	67.6	0	0	0	0	113.6	D472 S474	D472-S476 PolarHBondContact OD1-N 2.84Å; S474-S476 PolarHBondContact O-N 2.91Å; S474-S476 PolarHBondContact OG-OG 2.85Å
477	R	95	Very high	95.5	Very high	58 Å²	58	25.7 Å²	25.7	22%	0.219	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	132.8	-178	-61.1	-177.6	-175.2	-145.5	-1.9	110.4	L234 F471 D472 V489 Y490	L234-R477 PolarHBondContact O-NH1 3.1Å; F471-R477 WeakPolarHBondContact CA-O 3.41Å; D472-R477 HydrophobicContact CB-CB 4.31Å; D472-R477 PolarHBondContact N-O 3.24Å; D472-R477 PolarHBondContact OD1-N 2.86Å; D472-R477 VanDerWaalsContact OD1-O 3.12Å; R477-V489 HydrophobicContact CB-CG1 4.19Å; R477-V489 HydrophobicContact CG-CG1 4.48Å; R477-Y490 WeakPolarHBondContact CA-O 3.41Å
478	L	96.8	Very high	95.5	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	122.1	171.5	171.4	71.3	0	0	0	108.2	W195 V429 M437 M439 C469 F471 T480 V489 Y490	W195-L478 HydrophobicContact CE3-CB 3.78Å; W195-L478 HydrophobicContact CH2-CB 4.31Å; W195-L478 HydrophobicContact CZ3-CB 3.57Å; V429-L478 HydrophobicContact CB-CD1 4.41Å; V429-L478 HydrophobicContact CG1-CD1 4.34Å; V429-L478 HydrophobicContact CG1-CD2 4.02Å; V429-L478 HydrophobicContact CG2-CD1 3.78Å; V429-L478 HydrophobicContact CG2-CD2 3.8Å; V429-L478 HydrophobicContact CG2-CG 4.42Å; M437-L478 HydrophobicContact CE-CD2 3.88Å; M437-L478 HydrophobicContact SD-CD2 3.85Å; M439-L478 HydrophobicContact CE-CD2 4.18Å; M439-L478 HydrophobicContact SD-CD2 4.37Å; C469-L478 HydrophobicContact CB-CD1 4.21Å; F471-L478 HydrophobicContact CD1-CB 4.08Å; F471-L478 HydrophobicContact CD1-CD1 4.15Å; F471-L478 HydrophobicContact CE1-CB 3.89Å; F471-L478 HydrophobicContact CE1-CD1 3.97Å; F471-L478 HydrophobicContact CE1-CG 4.43Å; F471-L478 HydrophobicContact CE2-CD1 4.43Å; F471-L478 HydrophobicContact CG-CD1 4.46Å; F471-L478 HydrophobicContact CZ-CD1 4.14Å; L478-T480 HydrophobicContact CD2-CG2 4.45Å; L478-T480 HydrophobicContact CG-CG2 4.3Å; L478-V489 CarbonylContact O-C 3.58Å; L478-V489 WeakPolarHBondContact O-CA 3.48Å; L478-Y490 HydrophobicContact CD2-CD2 4.48Å; L478-Y490 PolarHBondContact N-O 3.49Å; L478-Y490 PolarHBondContact O-N 2.86Å
479	I	97.3	Very high	95.5	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	123.9	179.2	-47.9	175	0	0	0	107.7	I211 V213 F220 L234 C469 L470 I487 V489	I211-I479 HydrophobicContact CD1-CB 4.36Å; I211-I479 HydrophobicContact CD1-CG2 3.84Å; I211-I479 HydrophobicContact CG2-CG2 4.25Å; V213-I479 HydrophobicContact CG2-CD1 3.69Å; F220-I479 HydrophobicContact CB-CD1 4.25Å; F220-I479 HydrophobicContact CD1-CD1 4.19Å; F220-I479 HydrophobicContact CD2-CD1 4.35Å; F220-I479 HydrophobicContact CD2-CG2 4.46Å; F220-I479 HydrophobicContact CE2-CG2 4.25Å; F220-I479 HydrophobicContact CG-CD1 4.01Å; L234-I479 HydrophobicContact CD1-CD1 3.48Å; L234-I479 VanDerWaalsContact CD1-CD1 3.48Å; L234-I479 HydrophobicContact CD1-CG1 4.46Å; C469-I479 CarbonylContact C-O 3.48Å; C469-I479 VanDerWaalsContact CA-O 3.23Å; C469-I479 WeakPolarHBondContact CA-O 3.47Å; L470-I479 PolarHBondContact N-O 3.42Å; L470-I479 PolarHBondContact O-N 2.91Å; I479-I487 HydrophobicContact CG2-CG2 3.41Å; I479-I487 VanDerWaalsContact CG2-CG2 3.41Å; I479-V489 HydrophobicContact CG2-CG2 4.5Å
480	T	97.3	Very high	95.5	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	139.8	175.5	64	0	0	0	0	110.5	I211 M437 A468 C469 L478 E482 I487 K488 Y490	I211-T480 VanDerWaalsContact CD1-C 3.49Å; M437-T480 HydrophobicContact CE-CG2 4.45Å; M437-T480 HydrophobicContact SD-CG2 3.79Å; A468-T480 WeakPolarHBondContact O-CA 3.43Å; C469-T480 HydrophobicContact CB-CG2 3.96Å; L478-T480 HydrophobicContact CD2-CG2 4.45Å; L478-T480 HydrophobicContact CG-CG2 4.3Å; T480-E482 PolarHBondContact OG1-OE1 3.42Å; T480-I487 CarbonylContact O-C 3.58Å; T480-I487 VanDerWaalsContact O-CA 3.26Å; T480-I487 WeakPolarHBondContact O-CA 3.32Å; T480-K488 PolarHBondContact N-O 3.34Å; T480-K488 PolarHBondContact O-N 2.98Å; T480-K488 WeakPolarHBondContact OG1-CB 3.33Å; T480-K488 PolarHBondContact OG1-O 2.93Å; T480-Y490 HydrophobicContact CG2-CD2 4.13Å; T480-Y490 HydrophobicContact CG2-CE2 3.95Å
481	A	96.9	Very high	95.5	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	121.3	174.7	0	0	0	0	0	108.3	V208 I211 F467 A468	V208-A481 HydrophobicContact CB-CB 3.71Å; V208-A481 HydrophobicContact CG1-CB 3.44Å; V208-A481 VanDerWaalsContact CG1-CB 3.44Å; I211-A481 HydrophobicContact CD1-CB 3.3Å; I211-A481 HydrophobicContact CG1-CB 3.53Å; F467-A481 PolarHBondContact N-O 3.45Å; A468-A481 HydrophobicContact CB-CB 4.2Å; A468-A481 PolarHBondContact N-O 3.35Å; A468-A481 PolarHBondContact O-N 3.08Å
482	E	96.4	Very high	95.3	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.005	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	159.5	-166.6	-63.1	-169	-165.1	0	0	112.9	V208 G465 I466 T480 D484 K485 T486 K488	V208-E482 PolarHBondContact N-O 3.36Å; G465-E482 CarbonylContact O-C 3.34Å; G465-E482 WeakPolarHBondContact O-CA 3.43Å; I466-E482 HydrophobicContact CG1-CG 4.22Å; T480-E482 PolarHBondContact OG1-OE1 3.42Å; E482-D484 VanDerWaalsContact CB-OD1 3.28Å; E482-D484 WeakPolarHBondContact CB-OD1 3.33Å; E482-K485 PolarHBondContact O-N 2.97Å; E482-T486 PolarHBondContact N-O 3.49Å; E482-T486 VanDerWaalsContact N-O 3.14Å; E482-K488 WeakPolarHBondContact OE1-CD 3.12Å; E482-K488 WeakPolarHBondContact OE2-CE 3.36Å; E482-K488 IonicContact OE2-NZ 2.71Å; E482-K488 PolarHBondContact OE2-NZ 3.21Å
483	A	95.7	Very high	95.2	Very high	7 Å²	7	26.9 Å²	26.9	6%	0.058	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-22.7	177.6	0	0	0	0	0	112	W207 E463 G465 F467 K485	W207-A483 PolarHBondContact NE1-O 3.41Å; E463-A483 CarbonylContact O-C 3.5Å; E463-A483 WeakPolarHBondContact O-CB 3.35Å; G465-A483 PolarHBondContact O-N 3.37Å; F467-A483 HydrophobicContact CD2-CB 4.18Å; F467-A483 HydrophobicContact CE2-CB 3.42Å; F467-A483 VanDerWaalsContact CE2-CB 3.42Å; F467-A483 HydrophobicContact CZ-CB 3.91Å; A483-K485 PolarHBondContact O-N 2.99Å
484	D	95	Very high	95.1	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73	14.9	169.7	75.5	-4.1	0	0	0	112.7	Q456 E463 E482 T486 K488	Q456-D484 HydrophobicContact CG-CB 4.09Å; Q456-D484 PolarHBondContact N-OD2 3.42Å; Q456-D484 VanDerWaalsContact N-OD2 3.09Å; Q456-D484 PolarHBondContact NE2-O 2.89Å; Q456-D484 PolarHBondContact OE1-O 3.47Å; E463-D484 PolarHBondContact O-N 3.01Å; E482-D484 VanDerWaalsContact CB-OD1 3.28Å; E482-D484 WeakPolarHBondContact CB-OD1 3.33Å; D484-T486 VanDerWaalsContact CG-OG1 3.29Å; D484-T486 PolarHBondContact O-N 2.97Å; D484-T486 VanDerWaalsContact OD1-CB 3.31Å; D484-T486 WeakPolarHBondContact OD1-CB 3.34Å; D484-T486 WeakPolarHBondContact OD1-CG2 3.45Å; D484-T486 PolarHBondContact OD1-N 3.12Å; D484-T486 PolarHBondContact OD1-OG1 3.39Å; D484-T486 PolarHBondContact OD2-OG1 2.71Å; D484-K488 IonicContact OD2-NZ 3.75Å; D484-K488 PolarHBondContact OD2-NZ 2.99Å
485	K	95.7	Very high	95	Very high	73 Å²	73	29.5 Å²	29.5	32%	0.317	15%	0.153	S	C	.	.	S	Bend	trans	65.5	10.3	177.1	-38.9	170.2	-178	-176.9	0	113.6	H204 L205 E482 A483	H204-K485 HydrophobicContact CB-CB 4.48Å; L205-K485 WeakPolarHBondContact O-CD 3.42Å; L205-K485 WeakPolarHBondContact O-CE 3.35Å; L205-K485 PolarHBondContact O-NZ 3.18Å; E482-K485 PolarHBondContact O-N 2.97Å; A483-K485 PolarHBondContact O-N 2.99Å
486	T	96.4	Very high	94.9	Very high	1 Å²	1	28 Å²	28	1%	0.006	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	163.7	174.5	73.3	0	0	0	0	111.9	V200 I201 Q456 E482 D484 K488	V200-T486 HydrophobicContact CG1-CG2 3.95Å; I201-T486 WeakPolarHBondContact O-CA 3.46Å; Q456-T486 HydrophobicContact CB-CG2 3.86Å; Q456-T486 HydrophobicContact CG-CG2 4.31Å; E482-T486 PolarHBondContact N-O 3.49Å; E482-T486 VanDerWaalsContact N-O 3.14Å; D484-T486 VanDerWaalsContact CG-OG1 3.29Å; D484-T486 PolarHBondContact O-N 2.97Å; D484-T486 VanDerWaalsContact OD1-CB 3.31Å; D484-T486 WeakPolarHBondContact OD1-CB 3.34Å; D484-T486 WeakPolarHBondContact OD1-CG2 3.45Å; D484-T486 PolarHBondContact OD1-N 3.12Å; D484-T486 PolarHBondContact OD1-OG1 3.39Å; D484-T486 PolarHBondContact OD2-OG1 2.71Å; T486-K488 VanDerWaalsContact OG1-CE 3.3Å; T486-K488 WeakPolarHBondContact OG1-CE 3.35Å
487	I	97.3	Very high	94.7	Very high	1 Å²	1	29.2 Å²	29.2	1%	0.005	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	118.1	167.1	-58	149.1	0	0	0	106	I201 V208 F220 T222 W232 I479 T480	I201-I487 HydrophobicContact CB-CB 4.22Å; I201-I487 PolarHBondContact N-O 2.93Å; I201-I487 PolarHBondContact O-N 3.45Å; V208-I487 HydrophobicContact CG1-CG1 4.35Å; V208-I487 HydrophobicContact CG2-CG1 4.38Å; F220-I487 HydrophobicContact CE2-CD1 4.19Å; F220-I487 HydrophobicContact CE2-CG2 3.97Å; F220-I487 HydrophobicContact CZ-CG2 4.23Å; T222-I487 HydrophobicContact CG2-CD1 3.52Å; T222-I487 HydrophobicContact CG2-CG1 3.98Å; W232-I487 HydrophobicContact CD2-CD1 4.38Å; W232-I487 HydrophobicContact CZ2-CD1 4.01Å; I479-I487 HydrophobicContact CG2-CG2 3.41Å; I479-I487 VanDerWaalsContact CG2-CG2 3.41Å; T480-I487 CarbonylContact O-C 3.58Å; T480-I487 VanDerWaalsContact O-CA 3.26Å; T480-I487 WeakPolarHBondContact O-CA 3.32Å
488	K	96.6	Very high	94.3	Very high	5 Å²	5	32.2 Å²	32.2	2%	0.022	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	132.1	179.1	-61.2	-171.6	-174.9	137.6	0	109.3	L197 R199 V200 A453 A454 T480 E482 D484 T486 Y490	L197-K488 HydrophobicContact CD1-CB 3.69Å; L197-K488 HydrophobicContact CD1-CD 4.22Å; L197-K488 HydrophobicContact CD1-CG 4.19Å; R199-K488 WeakPolarHBondContact O-CA 3.35Å; V200-K488 HydrophobicContact CG1-CG 4.3Å; V200-K488 HydrophobicContact CG2-CD 4.41Å; V200-K488 HydrophobicContact CG2-CG 4.21Å; A453-K488 HydrophobicContact CB-CD 4.47Å; A454-K488 PolarHBondContact O-NZ 2.81Å; T480-K488 PolarHBondContact N-O 3.34Å; T480-K488 PolarHBondContact O-N 2.98Å; T480-K488 WeakPolarHBondContact OG1-CB 3.33Å; T480-K488 PolarHBondContact OG1-O 2.93Å; E482-K488 WeakPolarHBondContact OE1-CD 3.12Å; E482-K488 WeakPolarHBondContact OE2-CE 3.36Å; E482-K488 IonicContact OE2-NZ 2.71Å; E482-K488 PolarHBondContact OE2-NZ 3.21Å; D484-K488 IonicContact OD2-NZ 3.75Å; D484-K488 PolarHBondContact OD2-NZ 2.99Å; T486-K488 VanDerWaalsContact OG1-CE 3.3Å; T486-K488 WeakPolarHBondContact OG1-CE 3.35Å; K488-Y490 HydrophobicContact CB-CD2 4.49Å; K488-Y490 HydrophobicContact CB-CE2 3.77Å
489	V	96.8	Very high	93.5	Very high	4 Å²	4	40.8 Å²	40.8	2%	0.024	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	122.6	178.4	-175.6	0	0	0	0	107.6	F198 R199 I201 R477 L478 I479	F198-V489 WeakPolarHBondContact CA-O 3.42Å; F198-V489 WeakPolarHBondContact CB-O 3.4Å; F198-V489 HydrophobicContact CD1-CG1 4.5Å; F198-V489 PolarHBondContact N-O 2.85Å; R199-V489 HydrophobicContact CB-CB 4.26Å; R199-V489 PolarHBondContact N-O 2.87Å; R199-V489 VanDerWaalsContact N-O 3.08Å; R199-V489 PolarHBondContact O-N 3.48Å; I201-V489 HydrophobicContact CD1-CG2 4.2Å; R477-V489 HydrophobicContact CB-CG1 4.19Å; R477-V489 HydrophobicContact CG-CG1 4.48Å; L478-V489 CarbonylContact O-C 3.58Å; L478-V489 WeakPolarHBondContact O-CA 3.48Å; I479-V489 HydrophobicContact CG2-CG2 4.5Å
490	Y	96.4	Very high	92.7	Very high	6 Å²	6	43.8 Å²	43.8	2%	0.024	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	147.2	175.8	-64	-100.3	0	0	0	109.7	K196 L197 M437 I451 R477 L478 T480 K488	K196-Y490 CarbonylContact O-C 3.59Å; K196-Y490 VanDerWaalsContact O-CA 3.24Å; K196-Y490 WeakPolarHBondContact O-CA 3.37Å; L197-Y490 HydrophobicContact CB-CD1 4.24Å; L197-Y490 HydrophobicContact CB-CE1 3.97Å; L197-Y490 HydrophobicContact CD1-CE1 4.17Å; L197-Y490 HydrophobicContact CD1-CE2 4.19Å; M437-Y490 HydrophobicContact CE-CD1 4.21Å; M437-Y490 HydrophobicContact CE-CD2 4.07Å; M437-Y490 HydrophobicContact CE-CE1 4.01Å; M437-Y490 HydrophobicContact CE-CE2 3.86Å; M437-Y490 HydrophobicContact CE-CG 4.26Å; I451-Y490 HydrophobicContact CD1-CD1 4.3Å; I451-Y490 HydrophobicContact CD1-CE1 4.23Å; I451-Y490 HydrophobicContact CG2-CE1 4.03Å; R477-Y490 WeakPolarHBondContact CA-O 3.41Å; L478-Y490 HydrophobicContact CD2-CD2 4.48Å; L478-Y490 PolarHBondContact N-O 3.49Å; L478-Y490 PolarHBondContact O-N 2.86Å; T480-Y490 HydrophobicContact CG2-CD2 4.13Å; T480-Y490 HydrophobicContact CG2-CE2 3.95Å; K488-Y490 HydrophobicContact CB-CD2 4.49Å; K488-Y490 HydrophobicContact CB-CE2 3.77Å
491	K	95.3	Very high	92	Very high	68 Å²	68	48.3 Å²	48.3	30%	0.296	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	148.9	173.6	-168.2	-165.1	166	-159.9	0	108.3	K196 F198 D494	K196-K491 PolarHBondContact N-O 3.31Å; K196-K491 PolarHBondContact O-N 3.4Å; F198-K491 HydrophobicContact CB-CB 4.05Å; F198-K491 HydrophobicContact CG-CB 4.47Å; K491-D494 IonicContact NZ-OD1 3.74Å; K491-D494 IonicContact NZ-OD2 2.75Å; K491-D494 PolarHBondContact NZ-OD2 3.28Å
492	E	94.2	Very high	91.3	Very high	43 Å²	43	52 Å²	52	20%	0.201	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.8	145.2	167.6	-62.8	-174.6	162.7	0	0	111.6	P193 W195 D494	P193-E492 HydrophobicContact CB-CB 4.32Å; P193-E492 HydrophobicContact CG-CB 3.98Å; P193-E492 VanDerWaalsContact CG-CD 3.49Å; P193-E492 HydrophobicContact CG-CG 3.95Å; P193-E492 WeakPolarHBondContact CG-OE2 3.35Å; W195-E492 HydrophobicContact CD2-CG 3.97Å; W195-E492 HydrophobicContact CE3-CG 4.31Å; W195-E492 HydrophobicContact CH2-CG 3.8Å; W195-E492 HydrophobicContact CZ2-CG 3.43Å; W195-E492 VanDerWaalsContact CZ2-CG 3.43Å; W195-E492 VanDerWaalsContact CZ2-OE1 3.22Å; W195-E492 WeakPolarHBondContact CZ2-OE1 3.45Å; W195-E492 HydrophobicContact CZ3-CG 4.22Å; E492-D494 PolarHBondContact O-N 3.18Å
493	D	92.6	Very high	90.6	Very high	27 Å²	27	53.9 Å²	53.9	14%	0.144	29%	0.285	C	S	.	.			trans	-88.1	99.8	176.1	-169.8	22.7	0	0	0	111.4	P194 K196 T495 A496	P194-D493 HydrophobicContact CG-CB 4.16Å; P194-D493 WeakPolarHBondContact O-CB 3.24Å; P194-D493 PolarHBondContact O-N 2.93Å; K196-D493 HydrophobicContact CD-CB 4.11Å; K196-D493 WeakPolarHBondContact CE-OD1 3.31Å; K196-D493 HydrophobicContact CG-CB 4.46Å; K196-D493 IonicContact NZ-OD1 3.8Å; K196-D493 PolarHBondContact NZ-OD1 2.97Å; D493-T495 PolarHBondContact O-N 2.98Å; D493-T495 PolarHBondContact OD1-N 3.2Å; D493-T495 PolarHBondContact OD1-OG1 3.34Å; D493-T495 PolarHBondContact OD2-OG1 3.38Å; D493-A496 HydrophobicContact CB-CB 4.36Å; D493-A496 WeakPolarHBondContact O-CB 2.94Å; D493-A496 PolarHBondContact O-N 3.09Å; D493-A496 VanDerWaalsContact O-N 3.09Å
494	D	89.9	Confident	89.7	Confident	123 Å²	123	59.9 Å²	59.9	66%	0.658	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-14.9	179.7	-52.5	-36.5	0	0	0	113.4	K491 E492	K491-D494 IonicContact NZ-OD1 3.74Å; K491-D494 IonicContact NZ-OD2 2.75Å; K491-D494 PolarHBondContact NZ-OD2 3.28Å; E492-D494 PolarHBondContact O-N 3.18Å
495	T	90.1	Very high	88.6	Confident	114 Å²	114	62.6 Å²	62.6	70%	0.699	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.5	-9	178.2	57.1	0	0	0	0	114.6	D493	D493-T495 PolarHBondContact O-N 2.98Å; D493-T495 PolarHBondContact OD1-N 3.2Å; D493-T495 PolarHBondContact OD1-OG1 3.34Å; D493-T495 PolarHBondContact OD2-OG1 3.38Å
496	A	89.4	Confident	87.3	Confident	11 Å²	11	68 Å²	68	9%	0.091	35%	0.349	C	S	.	.			trans	-77.7	142.7	-179.4	0	0	0	0	0	111.7	W191 P194 D493	W191-A496 HydrophobicContact CH2-CB 4.42Å; W191-A496 VanDerWaalsContact CH2-O 3.31Å; W191-A496 WeakPolarHBondContact CH2-O 3.33Å; W191-A496 HydrophobicContact CZ2-CB 4.13Å; P194-A496 HydrophobicContact CG-CB 3.68Å; D493-A496 HydrophobicContact CB-CB 4.36Å; D493-A496 WeakPolarHBondContact O-CB 2.94Å; D493-A496 PolarHBondContact O-N 3.09Å; D493-A496 VanDerWaalsContact O-N 3.09Å
497	T	88.4	Confident	85.6	Confident	72 Å²	72	71.8 Å²	71.8	44%	0.442	37%	0.374	S	S	.	.			trans	-129.8	168	172.7	62.8	0	0	0	0	110.3	E499 S500 H501	T497-E499 PolarHBondContact O-N 3.33Å; T497-E499 VanDerWaalsContact O-N 3.13Å; T497-S500 PolarHBondContact N-OG 3Å; T497-S500 PolarHBondContact O-N 2.9Å; T497-S500 PolarHBondContact O-OG 3.47Å; T497-S500 PolarHBondContact OG1-N 2.86Å; T497-H501 PolarHBondContact O-N 3.07Å
498	E	85.4	Confident	83.6	Confident	120 Å²	120	79.4 Å²	79.4	56%	0.561	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-25.5	174.6	-57.3	-162.7	164.7	0	0	112.8	W191 H501 P502	W191-E498 HydrophobicContact CB-CG 3.97Å; W191-E498 HydrophobicContact CD2-CG 3.71Å; W191-E498 HydrophobicContact CE3-CG 4.16Å; W191-E498 HydrophobicContact CG-CB 4.39Å; W191-E498 HydrophobicContact CG-CG 3.62Å; E498-H501 CarbonylContact O-C 3.54Å; E498-P502 VanDerWaalsContact O-CA 3.25Å; E498-P502 WeakPolarHBondContact O-CA 3.49Å
499	E	80.5	Confident	81.5	Confident	181 Å²	181	85.8 Å²	85.8	85%	0.846	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-38.2	179	-61.6	-179.6	174.2	0	0	112.4	T497	T497-E499 PolarHBondContact O-N 3.33Å; T497-E499 VanDerWaalsContact O-N 3.13Å
500	S	79.7	Confident	79.3	Confident	62 Å²	62	92.4 Å²	92.4	43%	0.434	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-37.1	178.7	74	0	0	0	0	112	T497 P502	T497-S500 PolarHBondContact N-OG 3Å; T497-S500 PolarHBondContact O-N 2.9Å; T497-S500 PolarHBondContact O-OG 3.47Å; T497-S500 PolarHBondContact OG1-N 2.86Å; S500-P502 WeakPolarHBondContact O-CD 3.18Å
501	H	82.8	Confident	76.6	Confident	95 Å²	95	101 Å²	101	44%	0.44	52%	0.515	S	S	.	.	S	Bend	trans	-123.7	77.7	176.6	-68.4	-61.7	0	0	0	110.3	W191 T497 E498	W191-H501 PolarHBondContact NE1-O 2.96Å; W191-H501 VanDerWaalsContact NE1-O 3.14Å; T497-H501 PolarHBondContact O-N 3.07Å; E498-H501 CarbonylContact O-C 3.54Å
502	P	83.1	Confident	74	Confident	77 Å²	77	108.9 Å²	108.9	50%	0.5	54%	0.543	S	S	.	.			trans	-68.7	139.4	-178.9	28.4	-34.3	0	0	0	110.6	E498 S500 N504	E498-P502 VanDerWaalsContact O-CA 3.25Å; E498-P502 WeakPolarHBondContact O-CA 3.49Å; S500-P502 WeakPolarHBondContact O-CD 3.18Å; P502-N504 PolarHBondContact O-N 2.9Å
503	I	82.4	Confident	71.4	Confident	42 Å²	42	115.5 Å²	115.5	22%	0.215	57%	0.571	C	S	.	*			trans	-67.6	108.2	171	-54.9	-178.7	0	0	0	107.9	P189 W191 Y446 W505	P189-I503 HydrophobicContact CB-CG2 4.48Å; P189-I503 HydrophobicContact CG-CD1 4.03Å; P189-I503 HydrophobicContact CG-CG2 3.34Å; W191-I503 HydrophobicContact CB-CD1 3.9Å; W191-I503 HydrophobicContact CB-CG1 4.39Å; Y446-I503 HydrophobicContact CD1-CG2 4.07Å; Y446-I503 HydrophobicContact CE1-CG2 3.55Å; I503-W505 HydrophobicContact CG2-CB 3.71Å; I503-W505 PolarHBondContact O-N 2.92Å
504	N	76.6	Confident	68.8	Low	133 Å²	133	125.9 Å²	125.9	71%	0.711	61%	0.608	S	S	*	*			trans	-74.5	71.3	170.3	-76.2	-39.6	0	0	0	109.9	Y446 P502	Y446-N504 WeakPolarHBondContact CE2-O 3.48Å; Y446-N504 WeakPolarHBondContact OH-CA 3.43Å; Y446-N504 PolarHBondContact OH-N 3.02Å; Y446-N504 PolarHBondContact OH-O 3.36Å; P502-N504 PolarHBondContact O-N 2.9Å
505	W	71.9	Confident	66.1	Low	57 Å²	57	132.5 Å²	132.5	22%	0.216	63%	0.631	C	S	.	*			trans	-100.9	105.9	178	-176.5	-106.7	0	0	0	110.7	M186 P187 P189 Y446 I503	M186-W505 HydrophobicContact CB-CH2 3.69Å; M186-W505 HydrophobicContact CB-CZ2 3.31Å; M186-W505 HydrophobicContact CE-CH2 3.62Å; M186-W505 HydrophobicContact CE-CZ2 4.47Å; M186-W505 HydrophobicContact CE-CZ3 4.38Å; M186-W505 HydrophobicContact CG-CH2 4.48Å; M186-W505 HydrophobicContact CG-CZ2 4.46Å; M186-W505 HydrophobicContact SD-CH2 4.06Å; M186-W505 HydrophobicContact SD-CZ2 4.44Å; P187-W505 VanDerWaalsContact O-CZ2 3.26Å; P187-W505 WeakPolarHBondContact O-CZ2 3.46Å; P189-W505 VanDerWaalsContact CD-CD2 3.43Å; P189-W505 HydrophobicContact CG-CB 4.27Å; P189-W505 HydrophobicContact CG-CD2 4.01Å; P189-W505 HydrophobicContact CG-CE3 3.86Å; P189-W505 HydrophobicContact CG-CG 4.22Å; P189-W505 HydrophobicContact CG-CZ3 4.42Å; Y446-W505 AromaticContact CD2-CE3 3.56Å; Y446-W505 HydrophobicContact CD2-CE3 3.56Å; Y446-W505 AromaticContact CD2-CZ3 3.8Å; Y446-W505 HydrophobicContact CD2-CZ3 3.8Å; Y446-W505 HydrophobicContact CE2-CE3 4.14Å; Y446-W505 HydrophobicContact CG-CE3 4.09Å; Y446-W505 HydrophobicContact CG-CZ3 4.18Å; I503-W505 HydrophobicContact CG2-CB 3.71Å; I503-W505 PolarHBondContact O-N 2.92Å
506	K	67.3	Low	64.9	Low	185 Å²	185	133.4 Å²	133.4	80%	0.804	63%	0.628	S	S	*	*			trans	-105.1	114.1	166.3	-66.9	-178.5	-179.1	177.5	0	106.7	E508	K506-E508 VanDerWaalsContact C-N 3.34Å; K506-E508 PolarHBondContact O-N 3.3Å
507	P	61.3	Low	63.7	Low	81 Å²	81	139.8 Å²	139.8	53%	0.526	66%	0.656	S	S	.	*			trans	-65.4	99	175	26.4	-32	0	0	0	107.8	I509	P507-I509 PolarHBondContact O-N 3.41Å
508	E	55.6	Low	62.3	Low	161 Å²	161	143.6 Å²	143.6	75%	0.752	67%	0.668	S	S	*	*			trans	-65.7	106.7	165.5	-80.4	-164.4	160.3	0	0	106.7	K506 L510	K506-E508 VanDerWaalsContact C-N 3.34Å; K506-E508 PolarHBondContact O-N 3.3Å; E508-L510 PolarHBondContact O-N 3.02Å
509	I	51.9	Low	60.9	Low	139 Å²	139	145 Å²	145	71%	0.713	67%	0.674	S	S	*	*			trans	-62.8	98.1	164.5	-58.7	166.3	0	0	0	104.4	P507 K511	P507-I509 PolarHBondContact O-N 3.41Å; I509-K511 PolarHBondContact O-N 2.77Å
510	L	50.4	Low	59.7	Low	144 Å²	144	142.8 Å²	142.8	75%	0.754	66%	0.664	S	S	*	*			trans	-54.9	88.6	168.4	-92.5	149.1	0	0	0	107.2	E508 R512	E508-L510 PolarHBondContact O-N 3.02Å; L510-R512 PolarHBondContact O-N 3.01Å
511	K	40.9	Very low	58.4	Low	185 Å²	185	148.1 Å²	148.1	80%	0.804	68%	0.679	S	S	*	*			trans	-59.2	109.8	167.7	-78.2	-175.9	178.4	178.2	0	104.3	I509 K513	I509-K511 PolarHBondContact O-N 2.77Å; K511-K513 PolarHBondContact O-N 2.84Å
512	R	40.5	Very low	56.6	Low	235 Å²	235	151.9 Å²	151.9	89%	0.887	70%	0.696	S	S	*	*			trans	-44.9	109.1	164.8	-96.7	179.7	165.3	175.7	-6.3	106.2	L510 R514	L510-R512 PolarHBondContact O-N 3.01Å; R512-R514 VanDerWaalsContact C-N 3.29Å; R512-R514 PolarHBondContact O-N 2.79Å
513	K	39.3	Very low	54.6	Low	182 Å²	182	157.7 Å²	157.7	79%	0.791	71%	0.711	S	S	*	*			trans	-59.7	104	162.6	-81.3	-174.9	175.2	-178.5	0	104.6	K511 F515	K511-K513 PolarHBondContact O-N 2.84Å; K513-F515 PolarHBondContact O-N 3.28Å; K513-F515 VanDerWaalsContact O-N 3.13Å
514	R	36.9	Very low	52.3	Low	244 Å²	244	167.3 Å²	167.3	92%	0.921	75%	0.752	S	S	*	*			trans	-62.5	109.9	164.5	-81.1	-176.8	171.4	-177.9	-3.2	104.6	R512	R512-R514 VanDerWaalsContact C-N 3.29Å; R512-R514 PolarHBondContact O-N 2.79Å
515	F	34.7	Very low	50.1	Low	262 Å²	262	170.5 Å²	170.5	100%	1.149	76%	0.756	S	S	*	*			trans	-70.7	0	162.6	-76.7	-81.7	0	0	0	108.8	K513	K513-F515 PolarHBondContact O-N 3.28Å; K513-F515 VanDerWaalsContact O-N 3.13Å

Retrieved 515 of 515 residues in 541.3 ms (Link to these results)

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