A0A087YDK7_POEFO Loading...

Cytoplasmic polyadenylation element binding protein 1a

Sequence-specific RNA-binding protein that regulates mRNA cytoplasmic polyadenylation and translation initiation during oocyte maturation and early development. Binds to the cytoplasmic polyadenylation element (CPE), an uridine-rich sequence element (consensus sequence 5'-UUUUUAU-3') within the mRNA 3'-UTR.

AlphaFold DB , UniProt , Accession A0A087YDK7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 578 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.9	Very low	33.4	Very low	250 Å²	250	177.2 Å²	177.2	100%	1.232	87%	0.869	S	S	*	*				0	141.4	0	-66.7	165.6	-177.8	0	0	107.3
2	A	34.7	Very low	33.5	Very low	90 Å²	90	170.8 Å²	170.8	74%	0.744	85%	0.851	S	S	*	*			trans	-99.4	143.6	-179.1	0	0	0	0	0	110.8
3	F	32.6	Very low	33.1	Very low	219 Å²	219	170.9 Å²	170.9	96%	0.961	85%	0.848	S	S	*	*			trans	-140.2	140	145.5	-96.2	-72.4	0	0	0	109
4	S	30.5	Very low	33.2	Very low	103 Å²	103	165.8 Å²	165.8	72%	0.72	84%	0.837	S	S	*	*			trans	-113.9	139.7	-179.7	179.8	0	0	0	0	108.6
5	L	32.9	Very low	33.5	Very low	180 Å²	180	162.3 Å²	162.3	94%	0.942	83%	0.83	S	S	*	*			trans	-112.2	117	166.7	-76.4	172.6	0	0	0	108.5
6	R	33.3	Very low	33.4	Very low	236 Å²	236	162.6 Å²	162.6	89%	0.891	83%	0.834	S	S	*	*			trans	-120.4	145.4	171.7	-162.3	-179.9	-170	-161.7	2.2	106.9
7	N	34.1	Very low	34	Very low	147 Å²	147	159.7 Å²	159.7	79%	0.786	83%	0.826	S	S	*	*			trans	-46.4	147.5	-179.5	-54.9	-4.2	0	0	0	112.5
8	D	27.8	Very low	34.6	Very low	152 Å²	152	158.2 Å²	158.2	81%	0.813	82%	0.819	S	S	*	*				-153.9	166.6	97.2	-128.6	-45.1	0	0	0	115.2
9	S	36.6	Very low	35.1	Very low	98 Å²	98	154.6 Å²	154.6	69%	0.685	81%	0.809	S	S	*	*			trans	-77.6	147.9	-164.5	-43.5	0	0	0	0	113
10	R	30.2	Very low	35.8	Very low	246 Å²	246	152.2 Å²	152.2	93%	0.928	80%	0.803	S	S	*	*			trans	-152.1	131.6	149.2	-139.9	171	-70.7	-167.1	-0	111.7
11	R	38	Very low	36.7	Very low	228 Å²	228	145.5 Å²	145.5	86%	0.86	77%	0.77	S	S	*	*			trans	-117.6	127.1	-178.1	179.4	-169.1	-172.2	-172.7	4.7	109.2
12	P	34.1	Very low	37.6	Very low	100 Å²	100	134 Å²	134	65%	0.649	71%	0.713	S	S	*	*			trans	-126.3	160.6	139.5	36.3	-26	0	0	0	110.1
13	E	28.5	Very low	38.7	Very low	173 Å²	173	134.1 Å²	134.1	81%	0.808	71%	0.708	S	S	*	*			cis	-148.6	-162.7	-17.8	-119.5	162	140.6	0	0	108.2
14	S	35.1	Very low	40.1	Very low	99 Å²	99	128.1 Å²	128.1	69%	0.692	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-67.9	154.3	174.2	41.4	0	0	0	0	112.7	D16	S14-D16 PolarHBondContact O-N 2.69Å
15	P	37.3	Very low	42.1	Very low	113 Å²	113	124.2 Å²	124.2	73%	0.734	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-70	125.6	175.6	29.4	-33.9	0	0	0	111	T17	P15-T17 PolarHBondContact O-N 2.62Å; P15-T17 PolarHBondContact O-OG1 3.34Å
16	D	32.2	Very low	44	Very low	168 Å²	168	121.1 Å²	121.1	90%	0.898	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-59.1	128.3	170.9	-84.8	-46.2	0	0	0	110.4	S14	S14-D16 PolarHBondContact O-N 2.69Å
17	T	43.6	Very low	46.1	Very low	113 Å²	113	113.7 Å²	113.7	69%	0.693	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-100.8	149.9	-178.1	-56.6	0	0	0	0	108.8	P15	P15-T17 PolarHBondContact O-N 2.62Å; P15-T17 PolarHBondContact O-OG1 3.34Å
18	D	44.9	Very low	48.2	Very low	132 Å²	132	107.2 Å²	107.2	71%	0.706	60%	0.601	S	S	*	*			trans	62.8	68.4	175.6	-58.7	-31.3	0	0	0	117.9	P20	D18-P20 VanDerWaalsContact O-CD 3.3Å; D18-P20 WeakPolarHBondContact O-CD 3.23Å
19	S	44.3	Very low	50.4	Low	91 Å²	91	104.3 Å²	104.3	64%	0.636	59%	0.585	S	S	*	*			trans	-74.6	108.4	142.3	-55.1	0	0	0	0	108.8	A21	S19-A21 VanDerWaalsContact C-N 3.29Å; S19-A21 PolarHBondContact O-N 3.11Å
20	P	48.3	Very low	52.5	Low	106 Å²	106	104.2 Å²	104.2	69%	0.688	58%	0.576	S	S	*	*	G	3₁₀ helix	trans	-68.6	-22.7	-163.2	24.6	-34.7	0	0	0	114.6	D18 L22 S23	D18-P20 VanDerWaalsContact O-CD 3.3Å; D18-P20 WeakPolarHBondContact O-CD 3.23Å; P20-L22 VanDerWaalsContact C-N 3.35Å; P20-L22 PolarHBondContact O-N 3.23Å; P20-S23 WeakPolarHBondContact O-CB 3.3Å; P20-S23 PolarHBondContact O-N 3.25Å; P20-S23 PolarHBondContact O-OG 3.34Å
21	A	55.3	Low	54.9	Low	12 Å²	12	95.7 Å²	95.7	10%	0.099	55%	0.546	C	S	.	.	G	3₁₀ helix	trans	-60.8	-37.1	-176.3	0	0	0	0	0	113.9	S19 S23 T24 F44 V47 T49	S19-A21 VanDerWaalsContact C-N 3.29Å; S19-A21 PolarHBondContact O-N 3.11Å; A21-S23 VanDerWaalsContact C-N 3.35Å; A21-S23 PolarHBondContact O-N 3.38Å; A21-T24 PolarHBondContact O-OG1 2.84Å; A21-F44 WeakPolarHBondContact CB-O 3.29Å; A21-V47 CarbonylContact C-O 3.6Å; A21-T49 HydrophobicContact CB-CG2 4.46Å
22	L	55.4	Low	56.9	Low	8 Å²	8	90 Å²	90	4%	0.042	52%	0.524	C	S	.	.	G	3₁₀ helix	trans	-82.9	-7.1	-178.7	-68.2	-177	0	0	0	114.2	P20 T24 C25 A28 F31 R32 F44 V47	P20-L22 VanDerWaalsContact C-N 3.35Å; P20-L22 PolarHBondContact O-N 3.23Å; L22-T24 PolarHBondContact O-N 3.17Å; L22-C25 PolarHBondContact O-N 3.49Å; L22-C25 VanDerWaalsContact O-N 3.15Å; L22-A28 HydrophobicContact CB-CB 4.11Å; L22-A28 WeakPolarHBondContact O-CB 3.3Å; L22-F31 HydrophobicContact CD2-CB 4.5Å; L22-R32 HydrophobicContact CD1-CG 4.01Å; L22-F44 HydrophobicContact CD1-CB 4.36Å; L22-F44 HydrophobicContact CD1-CD2 3.69Å; L22-F44 HydrophobicContact CD1-CE2 4.23Å; L22-F44 HydrophobicContact CD1-CG 4.25Å; L22-F44 HydrophobicContact CD2-CB 4.28Å; L22-F44 HydrophobicContact CD2-CG 4.46Å; L22-F44 HydrophobicContact CG-CB 4.21Å; L22-F44 HydrophobicContact CG-CD2 4.43Å; L22-V47 HydrophobicContact CD2-CG1 4.26Å
23	S	58.3	Low	59	Low	92 Å²	92	93.9 Å²	93.9	64%	0.643	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-63.3	-23.3	-176	64.5	0	0	0	0	114.3	P20 A21	P20-S23 WeakPolarHBondContact O-CB 3.3Å; P20-S23 PolarHBondContact O-N 3.25Å; P20-S23 PolarHBondContact O-OG 3.34Å; A21-S23 VanDerWaalsContact C-N 3.35Å; A21-S23 PolarHBondContact O-N 3.38Å
24	T	62.1	Low	61.5	Low	94 Å²	94	89.2 Å²	89.2	58%	0.577	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-93.4	-4.9	179.6	53.4	0	0	0	0	113.9	A21 L22 C48	A21-T24 PolarHBondContact O-OG1 2.84Å; L22-T24 PolarHBondContact O-N 3.17Å; T24-C48 PolarHBondContact OG1-O 2.96Å
25	C	71.1	Confident	63.8	Low	21 Å²	21	85.2 Å²	85.2	14%	0.142	48%	0.476	C	S	.	.			trans	-95.1	121.4	-172.5	-172.8	0	0	0	0	112.1	L22 N27 A28 C48	L22-C25 PolarHBondContact O-N 3.49Å; L22-C25 VanDerWaalsContact O-N 3.15Å; C25-N27 PolarHBondContact O-N 3.48Å; C25-N27 PolarHBondContact SG-N 3.35Å; C25-N27 VanDerWaalsContact SG-N 3.44Å; C25-A28 HydrophobicContact CB-CB 4.19Å; C25-A28 WeakPolarHBondContact O-CB 3.41Å; C25-A28 PolarHBondContact O-N 3.18Å; C25-A28 VanDerWaalsContact O-N 3.14Å; C25-C48 HydrophobicContact CB-CB 3.94Å
26	S	74.8	Confident	66	Low	115 Å²	115	84.5 Å²	84.5	80%	0.804	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-22.6	173.7	64.5	0	0	0	0	113.8
27	N	77	Confident	68.1	Low	80 Å²	80	83.9 Å²	83.9	43%	0.428	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110	14.9	-174.7	-60	-0.1	0	0	0	111.9	C25 D29 I30 F31	C25-N27 PolarHBondContact O-N 3.48Å; C25-N27 PolarHBondContact SG-N 3.35Å; C25-N27 VanDerWaalsContact SG-N 3.44Å; N27-D29 VanDerWaalsContact C-N 3.25Å; N27-D29 PolarHBondContact O-N 2.69Å; N27-D29 VanDerWaalsContact O-N 3.14Å; N27-I30 HydrophobicContact CB-CD1 4.22Å; N27-I30 WeakPolarHBondContact O-CB 3.35Å; N27-I30 PolarHBondContact O-N 3.24Å; N27-F31 HydrophobicContact CB-CD2 4.37Å; N27-F31 HydrophobicContact CB-CE2 4.08Å; N27-F31 WeakPolarHBondContact O-CD2 3.39Å; N27-F31 PolarHBondContact O-N 3.19Å
28	A	77.6	Confident	69.8	Low	10 Å²	10	83.5 Å²	83.5	8%	0.083	46%	0.456	C	S	.	.	H	α-helix	trans	-48	-43.6	-175	0	0	0	0	0	113.6	L22 C25 I30 F31 R32	L22-A28 HydrophobicContact CB-CB 4.11Å; L22-A28 WeakPolarHBondContact O-CB 3.3Å; C25-A28 HydrophobicContact CB-CB 4.19Å; C25-A28 WeakPolarHBondContact O-CB 3.41Å; C25-A28 PolarHBondContact O-N 3.18Å; C25-A28 VanDerWaalsContact O-N 3.14Å; A28-I30 VanDerWaalsContact C-N 3.28Å; A28-I30 PolarHBondContact O-N 3.31Å; A28-F31 PolarHBondContact O-N 3.49Å; A28-R32 WeakPolarHBondContact O-CG 3.35Å; A28-R32 PolarHBondContact O-N 2.96Å
29	D	74.6	Confident	71.5	Confident	91 Å²	91	80.4 Å²	80.4	49%	0.487	46%	0.456	S	S	.	.	H	α-helix	trans	-71.4	-20.9	-177.9	-65.3	-33.2	0	0	0	113.8	N27 R32 R33	N27-D29 VanDerWaalsContact C-N 3.25Å; N27-D29 PolarHBondContact O-N 2.69Å; N27-D29 VanDerWaalsContact O-N 3.14Å; D29-R32 IonicContact OD1-CZ 2.69Å; D29-R32 IonicContact OD1-NH1 2.62Å; D29-R32 PolarHBondContact OD1-NH1 3.32Å; D29-R33 WeakPolarHBondContact O-CB 3.48Å; D29-R33 WeakPolarHBondContact O-CD 3.21Å; D29-R33 WeakPolarHBondContact O-CG 3.38Å; D29-R33 PolarHBondContact O-N 3.38Å; D29-R33 VanDerWaalsContact O-N 3.12Å
30	I	80.4	Confident	73.4	Confident	96 Å²	96	81.4 Å²	81.4	49%	0.492	45%	0.454	S	S	.	.	H	α-helix	trans	-73.5	-46.5	172.1	-50.6	-179.2	0	0	0	108.9	N27 A28 R32 R33 M34	N27-I30 HydrophobicContact CB-CD1 4.22Å; N27-I30 WeakPolarHBondContact O-CB 3.35Å; N27-I30 PolarHBondContact O-N 3.24Å; A28-I30 VanDerWaalsContact C-N 3.28Å; A28-I30 PolarHBondContact O-N 3.31Å; I30-R32 PolarHBondContact O-N 3.34Å; I30-R33 PolarHBondContact O-N 2.83Å; I30-M34 HydrophobicContact CG2-CE 4.2Å; I30-M34 WeakPolarHBondContact O-CG 3.38Å; I30-M34 PolarHBondContact O-N 3.08Å
31	F	79.5	Confident	74.8	Confident	68 Å²	68	80.3 Å²	80.3	30%	0.298	45%	0.454	S	S	.	.	H	α-helix	trans	-61.7	-43.2	175.5	-69.5	-71.3	0	0	0	112.4	L22 N27 A28 M34 N35 F44	L22-F31 HydrophobicContact CD2-CB 4.5Å; N27-F31 HydrophobicContact CB-CD2 4.37Å; N27-F31 HydrophobicContact CB-CE2 4.08Å; N27-F31 WeakPolarHBondContact O-CD2 3.39Å; N27-F31 PolarHBondContact O-N 3.19Å; A28-F31 PolarHBondContact O-N 3.49Å; F31-M34 HydrophobicContact CD1-CE 3.54Å; F31-M34 HydrophobicContact CE1-CE 3.9Å; F31-M34 HydrophobicContact CG-CE 4.21Å; F31-M34 PolarHBondContact O-N 3.44Å; F31-N35 PolarHBondContact O-N 3.14Å; F31-F44 HydrophobicContact CB-CE1 4.43Å; F31-F44 HydrophobicContact CB-CE2 4.28Å; F31-F44 HydrophobicContact CB-CZ 3.99Å; F31-F44 WeakPolarHBondContact O-CZ 3.32Å
32	R	79.6	Confident	75.9	Confident	107 Å²	107	83.5 Å²	83.5	40%	0.404	47%	0.469	S	S	.	.	H	α-helix	trans	-55.4	-52.9	172.3	-72.1	170.2	177.1	149.7	-3.6	111.5	L22 A28 D29 I30 M34 N35 T36	L22-R32 HydrophobicContact CD1-CG 4.01Å; A28-R32 WeakPolarHBondContact O-CG 3.35Å; A28-R32 PolarHBondContact O-N 2.96Å; D29-R32 IonicContact OD1-CZ 2.69Å; D29-R32 IonicContact OD1-NH1 2.62Å; D29-R32 PolarHBondContact OD1-NH1 3.32Å; I30-R32 PolarHBondContact O-N 3.34Å; R32-M34 PolarHBondContact O-N 3.15Å; R32-N35 PolarHBondContact O-N 2.73Å; R32-N35 VanDerWaalsContact O-N 3.14Å; R32-T36 PolarHBondContact O-N 3.38Å; R32-T36 PolarHBondContact O-OG1 3.03Å; R32-T36 VanDerWaalsContact O-OG1 3.07Å
33	R	79.7	Confident	77	Confident	182 Å²	182	89 Å²	89	69%	0.687	50%	0.498	S	S	*	.	H	α-helix	trans	-59.9	-42	179.4	-73.4	171.9	-162.2	-146.7	5.9	112.7	D29 I30 N35 T36 M37	D29-R33 WeakPolarHBondContact O-CB 3.48Å; D29-R33 WeakPolarHBondContact O-CD 3.21Å; D29-R33 WeakPolarHBondContact O-CG 3.38Å; D29-R33 PolarHBondContact O-N 3.38Å; D29-R33 VanDerWaalsContact O-N 3.12Å; I30-R33 PolarHBondContact O-N 2.83Å; R33-N35 VanDerWaalsContact C-N 3.34Å; R33-T36 PolarHBondContact O-N 2.8Å; R33-M37 WeakPolarHBondContact O-CG 3.46Å; R33-M37 PolarHBondContact O-N 3.34Å
34	M	80.1	Confident	77.7	Confident	75 Å²	75	86.2 Å²	86.2	37%	0.369	47%	0.474	S	S	.	.	H	α-helix	trans	-61.9	-42	175.6	-70.7	-172.8	-60.8	0	0	111.5	I30 F31 R32 M37 L38	I30-M34 HydrophobicContact CG2-CE 4.2Å; I30-M34 WeakPolarHBondContact O-CG 3.38Å; I30-M34 PolarHBondContact O-N 3.08Å; F31-M34 HydrophobicContact CD1-CE 3.54Å; F31-M34 HydrophobicContact CE1-CE 3.9Å; F31-M34 HydrophobicContact CG-CE 4.21Å; F31-M34 PolarHBondContact O-N 3.44Å; R32-M34 PolarHBondContact O-N 3.15Å; M34-M37 HydrophobicContact CG-CE 4.39Å; M34-M37 PolarHBondContact O-N 2.93Å; M34-L38 WeakPolarHBondContact O-CG 3.38Å; M34-L38 PolarHBondContact O-N 3.06Å; M34-L38 VanDerWaalsContact O-N 3.12Å
35	N	84.6	Confident	77.8	Confident	16 Å²	16	86.9 Å²	86.9	9%	0.086	48%	0.478	C	S	.	.	H	α-helix	trans	-65	-41.7	176.5	-155.1	10	0	0	0	112.2	F31 R32 R33 M37 L38 G39 N40 A41 L42 F44	F31-N35 PolarHBondContact O-N 3.14Å; R32-N35 PolarHBondContact O-N 2.73Å; R32-N35 VanDerWaalsContact O-N 3.14Å; R33-N35 VanDerWaalsContact C-N 3.34Å; N35-M37 VanDerWaalsContact C-N 3.33Å; N35-M37 PolarHBondContact O-N 3.14Å; N35-L38 CarbonylContact O-C 3.26Å; N35-L38 VanDerWaalsContact O-C 3.26Å; N35-L38 WeakPolarHBondContact O-CA 3.39Å; N35-L38 PolarHBondContact O-N 3.41Å; N35-G39 PolarHBondContact O-N 2.92Å; N35-G39 VanDerWaalsContact O-N 3.14Å; N35-N40 WeakPolarHBondContact O-CA 3.48Å; N35-N40 PolarHBondContact O-N 3.36Å; N35-N40 WeakPolarHBondContact OD1-CA 3.49Å; N35-A41 PolarHBondContact OD1-N 3.33Å; N35-L42 PolarHBondContact ND2-O 2.84Å; N35-L42 VanDerWaalsContact OD1-CB 3.32Å; N35-L42 WeakPolarHBondContact OD1-CB 3.4Å; N35-L42 PolarHBondContact OD1-N 3.38Å; N35-F44 HydrophobicContact CB-CE2 3.61Å; N35-F44 HydrophobicContact CB-CZ 3.76Å; N35-F44 WeakPolarHBondContact ND2-CE2 3.39Å
36	T	82.6	Confident	77.3	Confident	98 Å²	98	88.2 Å²	88.2	60%	0.601	50%	0.496	S	S	*	.	H	α-helix	trans	-61.7	-38.3	175.8	-51.5	0	0	0	0	112.3	R32 R33 L38 G39 N40	R32-T36 PolarHBondContact O-N 3.38Å; R32-T36 PolarHBondContact O-OG1 3.03Å; R32-T36 VanDerWaalsContact O-OG1 3.07Å; R33-T36 PolarHBondContact O-N 2.8Å; T36-L38 PolarHBondContact O-N 3.5Å; T36-G39 PolarHBondContact O-N 3.25Å; T36-N40 WeakPolarHBondContact CA-OD1 3.18Å
37	M	76.3	Confident	76.5	Confident	155 Å²	155	85.1 Å²	85.1	76%	0.764	47%	0.472	S	S	*	.	H	α-helix	trans	-67.2	-23.8	172.3	-68.4	-169	-58.2	0	0	113.3	R33 M34 N35	R33-M37 WeakPolarHBondContact O-CG 3.46Å; R33-M37 PolarHBondContact O-N 3.34Å; M34-M37 HydrophobicContact CG-CE 4.39Å; M34-M37 PolarHBondContact O-N 2.93Å; N35-M37 VanDerWaalsContact C-N 3.33Å; N35-M37 PolarHBondContact O-N 3.14Å
38	L	79.3	Confident	75.7	Confident	105 Å²	105	84 Å²	84	55%	0.55	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	17.7	176.5	-64.4	170.4	0	0	0	112.8	M34 N35 T36 N40 A41 L42	M34-L38 WeakPolarHBondContact O-CG 3.38Å; M34-L38 PolarHBondContact O-N 3.06Å; M34-L38 VanDerWaalsContact O-N 3.12Å; N35-L38 CarbonylContact O-C 3.26Å; N35-L38 VanDerWaalsContact O-C 3.26Å; N35-L38 WeakPolarHBondContact O-CA 3.39Å; N35-L38 PolarHBondContact O-N 3.41Å; T36-L38 PolarHBondContact O-N 3.5Å; L38-N40 VanDerWaalsContact C-N 3.31Å; L38-N40 PolarHBondContact O-N 3.12Å; L38-A41 VanDerWaalsContact O-CB 3.29Å; L38-A41 WeakPolarHBondContact O-CB 3.45Å; L38-A41 PolarHBondContact O-N 3.21Å; L38-L42 HydrophobicContact CD1-CD1 3.84Å; L38-L42 HydrophobicContact CD1-CG 4.21Å
39	G	81.1	Confident	74.5	Confident	67 Å²	67	87.7 Å²	87.7	69%	0.691	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.4	25.5	176.5	0	0	0	0	0	114.8	N35 T36 A41	N35-G39 PolarHBondContact O-N 2.92Å; N35-G39 VanDerWaalsContact O-N 3.14Å; T36-G39 PolarHBondContact O-N 3.25Å; G39-A41 VanDerWaalsContact C-N 3.29Å; G39-A41 PolarHBondContact O-N 2.86Å
40	N	83.1	Confident	73.3	Confident	111 Å²	111	89.2 Å²	89.2	59%	0.594	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.6	27.5	-174.2	-57.1	-26.4	0	0	0	114.5	N35 T36 L38 L42	N35-N40 WeakPolarHBondContact O-CA 3.48Å; N35-N40 PolarHBondContact O-N 3.36Å; N35-N40 WeakPolarHBondContact OD1-CA 3.49Å; T36-N40 WeakPolarHBondContact CA-OD1 3.18Å; L38-N40 VanDerWaalsContact C-N 3.31Å; L38-N40 PolarHBondContact O-N 3.12Å; N40-L42 VanDerWaalsContact C-N 3.3Å; N40-L42 PolarHBondContact O-N 3.46Å
41	A	79.4	Confident	71.4	Confident	83 Å²	83	90.8 Å²	90.8	69%	0.686	52%	0.521	S	S	*	.			trans	-76.1	-5.7	-177.6	0	0	0	0	0	115.7	N35 L38 G39	N35-A41 PolarHBondContact OD1-N 3.33Å; L38-A41 VanDerWaalsContact O-CB 3.29Å; L38-A41 WeakPolarHBondContact O-CB 3.45Å; L38-A41 PolarHBondContact O-N 3.21Å; G39-A41 VanDerWaalsContact C-N 3.29Å; G39-A41 PolarHBondContact O-N 2.86Å
42	L	76.6	Confident	69.3	Low	79 Å²	79	94.5 Å²	94.5	41%	0.414	54%	0.544	S	S	.	.			trans	-100.1	130.4	178.3	-52.4	178.4	0	0	0	111.2	N35 L38 N40 F44	N35-L42 PolarHBondContact ND2-O 2.84Å; N35-L42 VanDerWaalsContact OD1-CB 3.32Å; N35-L42 WeakPolarHBondContact OD1-CB 3.4Å; N35-L42 PolarHBondContact OD1-N 3.38Å; L38-L42 HydrophobicContact CD1-CD1 3.84Å; L38-L42 HydrophobicContact CD1-CG 4.21Å; N40-L42 VanDerWaalsContact C-N 3.3Å; N40-L42 PolarHBondContact O-N 3.46Å; L42-F44 HydrophobicContact CB-CE1 3.93Å; L42-F44 HydrophobicContact CB-CZ 4.07Å; L42-F44 HydrophobicContact CD1-CE1 4.03Å; L42-F44 HydrophobicContact CD1-CZ 4.06Å
43	D	78.2	Confident	66.9	Low	123 Å²	123	95 Å²	95	66%	0.658	56%	0.564	S	S	*	*			trans	-83.3	141.5	161.9	-169.9	-5.6	0	0	0	109.6	T45	D43-T45 VanDerWaalsContact CG-OG1 3.26Å; D43-T45 WeakPolarHBondContact OD1-CB 3.22Å; D43-T45 WeakPolarHBondContact OD1-CG2 3.39Å; D43-T45 PolarHBondContact OD1-N 3.28Å; D43-T45 PolarHBondContact OD1-OG1 3.33Å; D43-T45 PolarHBondContact OD2-OG1 3.14Å
44	F	73.9	Confident	64.7	Low	34 Å²	34	91.8 Å²	91.8	15%	0.149	57%	0.565	C	S	.	*			trans	-119.5	9	177.9	-63.3	-46.3	0	0	0	113.2	A21 L22 F31 N35 L42 G46 V47	A21-F44 WeakPolarHBondContact CB-O 3.29Å; L22-F44 HydrophobicContact CD1-CB 4.36Å; L22-F44 HydrophobicContact CD1-CD2 3.69Å; L22-F44 HydrophobicContact CD1-CE2 4.23Å; L22-F44 HydrophobicContact CD1-CG 4.25Å; L22-F44 HydrophobicContact CD2-CB 4.28Å; L22-F44 HydrophobicContact CD2-CG 4.46Å; L22-F44 HydrophobicContact CG-CB 4.21Å; L22-F44 HydrophobicContact CG-CD2 4.43Å; F31-F44 HydrophobicContact CB-CE1 4.43Å; F31-F44 HydrophobicContact CB-CE2 4.28Å; F31-F44 HydrophobicContact CB-CZ 3.99Å; F31-F44 WeakPolarHBondContact O-CZ 3.32Å; N35-F44 HydrophobicContact CB-CE2 3.61Å; N35-F44 HydrophobicContact CB-CZ 3.76Å; N35-F44 WeakPolarHBondContact ND2-CE2 3.39Å; L42-F44 HydrophobicContact CB-CE1 3.93Å; L42-F44 HydrophobicContact CB-CZ 4.07Å; L42-F44 HydrophobicContact CD1-CE1 4.03Å; L42-F44 HydrophobicContact CD1-CZ 4.06Å; F44-G46 PolarHBondContact O-N 3.02Å; F44-V47 HydrophobicContact CB-CB 4.48Å; F44-V47 HydrophobicContact CB-CG2 4.3Å; F44-V47 HydrophobicContact CD1-CG2 4.27Å; F44-V47 WeakPolarHBondContact O-CB 3.46Å; F44-V47 PolarHBondContact O-N 2.95Å; F44-V47 VanDerWaalsContact O-N 3.08Å
45	T	64.6	Low	62.5	Low	108 Å²	108	97.4 Å²	97.4	66%	0.663	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.6	130.1	172.1	54.7	0	0	0	0	110.8	D43 V47	D43-T45 VanDerWaalsContact CG-OG1 3.26Å; D43-T45 WeakPolarHBondContact OD1-CB 3.22Å; D43-T45 WeakPolarHBondContact OD1-CG2 3.39Å; D43-T45 PolarHBondContact OD1-N 3.28Å; D43-T45 PolarHBondContact OD1-OG1 3.33Å; D43-T45 PolarHBondContact OD2-OG1 3.14Å; T45-V47 VanDerWaalsContact C-N 3.28Å; T45-V47 PolarHBondContact O-N 3.4Å
46	G	59.6	Low	59.8	Low	50 Å²	50	105.9 Å²	105.9	52%	0.515	63%	0.626	S	S	.	*	T	Hydrogen-bonded Turn	trans	79	-8.4	-175.6	0	0	0	0	0	116.3	F44 C48 T49	F44-G46 PolarHBondContact O-N 3.02Å; G46-C48 PolarHBondContact O-N 3.35Å; G46-T49 PolarHBondContact O-OG1 2.98Å; G46-T49 VanDerWaalsContact O-OG1 3.11Å
47	V	59.3	Low	57.3	Low	50 Å²	50	108.1 Å²	108.1	30%	0.303	63%	0.627	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.8	134.1	171.6	179.9	0	0	0	0	109.2	A21 L22 F44 T45 T49	A21-V47 CarbonylContact C-O 3.6Å; L22-V47 HydrophobicContact CD2-CG1 4.26Å; F44-V47 HydrophobicContact CB-CB 4.48Å; F44-V47 HydrophobicContact CB-CG2 4.3Å; F44-V47 HydrophobicContact CD1-CG2 4.27Å; F44-V47 WeakPolarHBondContact O-CB 3.46Å; F44-V47 PolarHBondContact O-N 2.95Å; F44-V47 VanDerWaalsContact O-N 3.08Å; T45-V47 VanDerWaalsContact C-N 3.28Å; T45-V47 PolarHBondContact O-N 3.4Å; V47-T49 PolarHBondContact O-N 3.14Å; V47-T49 VanDerWaalsContact O-N 3.17Å
48	C	59	Low	55.3	Low	55 Å²	55	106.5 Å²	106.5	37%	0.372	63%	0.628	S	S	.	*	T	Hydrogen-bonded Turn	trans	59.6	16.8	179	-66.9	0	0	0	0	117.2	T24 C25 G46 T50	T24-C48 PolarHBondContact OG1-O 2.96Å; C25-C48 HydrophobicContact CB-CB 3.94Å; G46-C48 PolarHBondContact O-N 3.35Å; C48-T50 PolarHBondContact O-N 3.12Å
49	T	53.6	Low	52.8	Low	89 Å²	89	106.7 Å²	106.7	55%	0.546	63%	0.629	S	S	.	*			trans	-85	102.3	172.4	57.7	0	0	0	0	111.9	A21 G46 V47	A21-T49 HydrophobicContact CB-CG2 4.46Å; G46-T49 PolarHBondContact O-OG1 2.98Å; G46-T49 VanDerWaalsContact O-OG1 3.11Å; V47-T49 PolarHBondContact O-N 3.14Å; V47-T49 VanDerWaalsContact O-N 3.17Å
50	T	49.2	Very low	50.4	Low	122 Å²	122	111.1 Å²	111.1	75%	0.748	64%	0.637	S	S	*	*			trans	-97.6	137.9	164.8	46.4	0	0	0	0	110.6	C48 N52	C48-T50 PolarHBondContact O-N 3.12Å; T50-N52 PolarHBondContact O-N 3.41Å
51	P	40.7	Very low	47.8	Very low	129 Å²	129	113.2 Å²	113.2	84%	0.838	65%	0.647	S	S	*	*			trans	-71.8	121.1	179.7	28.3	-33.4	0	0	0	110.8	S53	P51-S53 PolarHBondContact O-N 2.96Å
52	N	34.2	Very low	45.3	Very low	146 Å²	146	114.8 Å²	114.8	78%	0.781	65%	0.651	S	S	*	*			trans	-84.6	97.7	-171.6	-162.8	6.9	0	0	0	111.5	T50 T54	T50-N52 PolarHBondContact O-N 3.41Å; N52-T54 PolarHBondContact O-N 3.37Å
53	S	30.2	Very low	42.9	Very low	118 Å²	118	120.2 Å²	120.2	83%	0.825	68%	0.675	S	S	*	*			trans	-80.7	98	-178.5	-171.9	0	0	0	0	112	P51 K55	P51-S53 PolarHBondContact O-N 2.96Å; S53-K55 PolarHBondContact O-N 3.31Å
54	T	32.8	Very low	40.5	Very low	115 Å²	115	118.7 Å²	118.7	71%	0.706	67%	0.674	S	S	*	*			trans	-83.3	104.9	178.7	49.8	0	0	0	0	112.5	N52	N52-T54 PolarHBondContact O-N 3.37Å
55	K	34.4	Very low	38.5	Very low	192 Å²	192	125.2 Å²	125.2	84%	0.835	71%	0.705	S	S	*	*			trans	31	118.4	150.1	-62.6	179	-180	176.8	0	118.1	S53	S53-K55 PolarHBondContact O-N 3.31Å
56	H	28.6	Very low	36.8	Very low	195 Å²	195	127.9 Å²	127.9	90%	0.903	71%	0.714	S	S	*	*				-140.1	142.6	128.1	-114.6	-87.3	0	0	0	110.7
57	K	30.3	Very low	35.4	Very low	145 Å²	145	130.4 Å²	130.4	63%	0.63	73%	0.73	S	S	*	*			trans	-97	149.2	175.8	-151.9	-167	-179.2	-155.7	0	108.6	D59	K57-D59 VanDerWaalsContact CE-OD1 3.23Å; K57-D59 WeakPolarHBondContact CE-OD1 3.37Å; K57-D59 VanDerWaalsContact CE-OD2 3.3Å; K57-D59 WeakPolarHBondContact CE-OD2 3.44Å; K57-D59 IonicContact NZ-OD1 3.73Å; K57-D59 PolarHBondContact NZ-OD1 3.07Å; K57-D59 IonicContact NZ-OD2 2.78Å; K57-D59 PolarHBondContact NZ-OD2 2.74Å
58	P	33.3	Very low	33.9	Very low	121 Å²	121	133 Å²	133	79%	0.786	76%	0.756	S	S	*	*				-135.4	170.9	108.6	38.3	-29.2	0	0	0	113.5
59	D	27.8	Very low	32.5	Very low	108 Å²	108	137.8 Å²	137.8	58%	0.578	78%	0.784	S	S	*	*			trans	-86.6	152.4	174.7	-62.7	-89	0	0	0	111.7	K57	K57-D59 VanDerWaalsContact CE-OD1 3.23Å; K57-D59 WeakPolarHBondContact CE-OD1 3.37Å; K57-D59 VanDerWaalsContact CE-OD2 3.3Å; K57-D59 WeakPolarHBondContact CE-OD2 3.44Å; K57-D59 IonicContact NZ-OD1 3.73Å; K57-D59 PolarHBondContact NZ-OD1 3.07Å; K57-D59 IonicContact NZ-OD2 2.78Å; K57-D59 PolarHBondContact NZ-OD2 2.74Å
60	L	30.1	Very low	31.1	Very low	161 Å²	161	137.3 Å²	137.3	84%	0.843	80%	0.797	S	S	*	*				176.1	145	123.8	-92.2	165.4	0	0	0	113.9
61	L	28.6	Very low	30.1	Very low	154 Å²	154	135.3 Å²	135.3	81%	0.806	80%	0.8	S	S	*	*			trans	1.4	130.3	160.4	-58.3	171.1	0	0	0	122.5
62	C	25.9	Very low	29.6	Very low	116 Å²	116	140.9 Å²	140.9	78%	0.784	81%	0.805	S	S	*	*				39.4	116.3	121.1	-163	0	0	0	0	120.9
63	E	25.8	Very low	29.4	Very low	194 Å²	194	145.8 Å²	145.8	91%	0.907	81%	0.812	S	S	*	*				-163.5	-163.5	109	-118	-156.4	124	0	0	113.5
64	S	29.4	Very low	29.2	Very low	91 Å²	91	149 Å²	149	64%	0.636	82%	0.816	S	S	*	*			trans	-110.4	163.5	-156.2	-163.3	0	0	0	0	116.4
65	E	30.6	Very low	29	Very low	171 Å²	171	151.1 Å²	151.1	80%	0.799	82%	0.823	S	S	*	*			trans	74.5	160.8	144.7	-97.8	173.1	158.8	0	0	124.4
66	L	30	Very low	28.6	Very low	163 Å²	163	151.7 Å²	151.7	85%	0.853	83%	0.825	S	S	*	*			trans	72.6	92.5	160.3	-75	159.1	0	0	0	121.5
67	A	28.9	Very low	29.1	Very low	103 Å²	103	148.3 Å²	148.3	85%	0.851	82%	0.821	S	S	*	*			trans	-24.9	149.5	155.3	0	0	0	0	0	120.4
68	A	29	Very low	28.9	Very low	104 Å²	104	149.3 Å²	149.3	86%	0.86	83%	0.833	S	S	*	*			trans	-148.5	147.6	148.1	0	0	0	0	0	112.8
69	V	28.5	Very low	28.7	Very low	157 Å²	157	149.1 Å²	149.1	95%	0.952	83%	0.834	S	S	*	*			trans	-80.2	145.3	177.4	174.2	0	0	0	0	111.2
70	G	25.9	Very low	28.7	Very low	79 Å²	79	146.6 Å²	146.6	81%	0.814	83%	0.833	S	S	*	*			trans	159.2	101.3	157.5	0	0	0	0	0	117.1
71	G	28.1	Very low	28.6	Very low	80 Å²	80	144.7 Å²	144.7	83%	0.825	83%	0.833	S	S	*	*			trans	-99	139	169	0	0	0	0	0	113.4
72	R	28.4	Very low	28.7	Very low	245 Å²	245	144.9 Å²	144.9	93%	0.925	83%	0.833	S	S	*	*			trans	-145	119.8	163.8	-77.8	175.3	-175.7	-151	-1.8	106.3
73	R	30.5	Very low	29.4	Very low	250 Å²	250	145.2 Å²	145.2	94%	0.943	83%	0.834	S	S	*	*				47.4	103.8	67.9	-100.2	-171.3	-179.2	-173.3	1.7	113.2
74	M	26.4	Very low	29.5	Very low	185 Å²	185	143.2 Å²	143.2	91%	0.911	83%	0.83	S	S	*	*			trans	-85.8	141.4	173.3	-61.8	-122.7	-82.2	0	0	111.1
75	L	28.4	Very low	29.5	Very low	160 Å²	160	143.4 Å²	143.4	84%	0.838	83%	0.831	S	S	*	*			trans	-152.7	177.2	164.7	-84	-174.7	0	0	0	108.5
76	F	25.5	Very low	29.5	Very low	203 Å²	203	143.6 Å²	143.6	89%	0.89	83%	0.832	S	S	*	*			trans	99.1	149.9	-177.1	-57.6	-51	0	0	0	114.4
77	P	38.8	Very low	29.4	Very low	125 Å²	125	142.7 Å²	142.7	81%	0.812	83%	0.828	S	S	*	*			cis	-119.1	163.4	13.2	40.8	-29.2	0	0	0	116.8
78	N	26.4	Very low	29.4	Very low	166 Å²	166	145.4 Å²	145.4	89%	0.888	83%	0.826	S	S	*	*			trans	-140.7	162.4	143	-163.2	10.1	0	0	0	108.8
79	C	29.3	Very low	30	Very low	117 Å²	117	145.1 Å²	145.1	79%	0.791	82%	0.815	S	S	*	*			trans	-103.9	151.1	-159.4	-163.2	0	0	0	0	114.8
80	G	28.2	Very low	29.9	Very low	54 Å²	54	145 Å²	145	56%	0.557	81%	0.809	S	S	*	*				78.7	97.5	128.6	0	0	0	0	0	120.4
81	S	27.8	Very low	29.9	Very low	122 Å²	122	146.1 Å²	146.1	85%	0.853	80%	0.804	S	S	*	*			trans	52.6	126.8	135.9	57.3	0	0	0	0	122
82	I	31	Very low	30	Very low	157 Å²	157	154 Å²	154	81%	0.805	81%	0.809	S	S	*	*			trans	-107.2	163	155.2	-29.2	179.3	0	0	0	107.8
83	P	40.5	Very low	29.8	Very low	124 Å²	124	145.7 Å²	145.7	81%	0.805	80%	0.799	S	S	*	*				-148.6	126.5	102.9	35.2	-17.3	0	0	0	117.4
84	N	27.2	Very low	30.8	Very low	152 Å²	152	140.1 Å²	140.1	81%	0.813	80%	0.795	S	S	*	*			trans	69.1	160.4	133.7	-126.5	14.4	0	0	0	124.6
85	S	30.8	Very low	30.9	Very low	94 Å²	94	137 Å²	137	66%	0.657	79%	0.791	S	S	*	*			trans	74.9	100.7	162.9	50.7	0	0	0	0	122.5
86	Q	29.7	Very low	30.9	Very low	176 Å²	176	136.1 Å²	136.1	82%	0.822	79%	0.788	S	S	*	*				68.6	147.3	125	-73.5	179.1	-74.7	0	0	124.5
87	D	27.3	Very low	31.1	Very low	144 Å²	144	133 Å²	133	77%	0.77	79%	0.785	S	S	*	*			trans	80.2	168.4	157.9	-59.5	-14.6	0	0	0	122
88	I	29.4	Very low	30.7	Very low	159 Å²	159	132.3 Å²	132.3	82%	0.815	78%	0.779	S	S	*	*			trans	-143.8	157.9	-147.3	-73.6	169.9	0	0	0	106.7
89	P	42.7	Very low	30.8	Very low	98 Å²	98	131.2 Å²	131.2	64%	0.636	77%	0.773	S	S	*	*			cis	-135.1	-171	2.8	32.5	-9.3	0	0	0	116.4
90	L	25.4	Very low	30.9	Very low	156 Å²	156	134 Å²	134	82%	0.817	78%	0.779	S	S	*	*			trans	58.7	117.3	138.3	-84.8	162.3	0	0	0	122
91	S	26.9	Very low	30.8	Very low	101 Å²	101	134.2 Å²	134.2	71%	0.706	78%	0.781	S	S	*	*				156.2	152	109.8	-73.5	0	0	0	0	115.9
92	R	29.5	Very low	31	Very low	247 Å²	247	136.9 Å²	136.9	93%	0.932	79%	0.785	S	S	*	*			trans	59.9	119	156.7	-71	174	179.1	167.2	-0.7	120.4
93	G	24.9	Very low	30.8	Very low	70 Å²	70	132.9 Å²	132.9	72%	0.722	78%	0.782	S	S	*	*			trans	-99.5	-152.7	130.3	0	0	0	0	0	109.4
94	P	51.3	Low	30.4	Very low	132 Å²	132	134.7 Å²	134.7	86%	0.857	78%	0.784	S	S	*	*			cis	-125.6	178.3	-13.7	41.6	-28.1	0	0	0	112.6
95	S	28.1	Very low	30.5	Very low	119 Å²	119	136 Å²	136	83%	0.832	79%	0.785	S	S	*	*			trans	-159.8	126.5	158.1	57.5	0	0	0	0	112.5
96	D	28.1	Very low	30.4	Very low	142 Å²	142	136.1 Å²	136.1	76%	0.759	79%	0.786	S	S	*	*			trans	-111.2	135.1	172.6	171.6	32.7	0	0	0	108.8
97	V	29.3	Very low	30.3	Very low	138 Å²	138	135.9 Å²	135.9	84%	0.836	79%	0.79	S	S	*	*			trans	-149.4	138.2	171.4	-176.2	0	0	0	0	109.6
98	T	31	Very low	30.2	Very low	111 Å²	111	139.8 Å²	139.8	68%	0.681	79%	0.793	S	S	*	*			trans	-107.9	159.4	-167.3	55.8	0	0	0	0	115
99	D	29	Very low	30.2	Very low	142 Å²	142	140.9 Å²	140.9	76%	0.759	80%	0.8	S	S	*	*			trans	76.1	139	143.7	-156.4	14.5	0	0	0	120.3
100	L	32	Very low	29.6	Very low	177 Å²	177	141.4 Å²	141.4	93%	0.927	81%	0.806	S	S	*	*			trans	-175.3	103.6	143.4	-107.2	173.9	0	0	0	109.2
101	G	26	Very low	29.6	Very low	58 Å²	58	137.3 Å²	137.3	60%	0.598	80%	0.801	S	S	*	*			trans	-122.7	145.1	179.4	0	0	0	0	0	115.1
102	L	31.9	Very low	29.8	Very low	178 Å²	178	144.6 Å²	144.6	93%	0.932	81%	0.814	S	S	*	*			trans	-141.6	130.8	162.8	-64.1	174.7	0	0	0	105.6
103	G	26.8	Very low	29.6	Very low	72 Å²	72	140.1 Å²	140.1	74%	0.742	81%	0.808	S	S	*	*				94.9	121.3	64	0	0	0	0	0	107.8
104	L	30.8	Very low	30	Very low	162 Å²	162	148.2 Å²	148.2	85%	0.848	82%	0.817	S	S	*	*			cis	-138.9	153.6	29.9	-61.9	160.9	0	0	0	109
105	Q	28.8	Very low	29.5	Very low	180 Å²	180	147.2 Å²	147.2	84%	0.841	81%	0.81	S	S	*	*				47.2	135.2	70	-57.3	-170.1	16.2	0	0	114.2
106	S	29	Very low	29.5	Very low	96 Å²	96	153.5 Å²	153.5	67%	0.671	82%	0.816	S	S	*	*			cis	-145.2	162.9	5.9	-150.9	0	0	0	0	108.7
107	L	28.6	Very low	29.4	Very low	172 Å²	172	151.8 Å²	151.8	90%	0.901	82%	0.815	S	S	*	*				-146.1	145.6	71	-76.7	169	0	0	0	112.2
108	R	25.6	Very low	29.4	Very low	225 Å²	225	150.9 Å²	150.9	85%	0.849	82%	0.815	S	S	*	*			trans	-106.3	146	168	-73.1	-179.5	173.6	175.4	-1.6	110.9
109	L	29.5	Very low	29.2	Very low	183 Å²	183	154.8 Å²	154.8	96%	0.958	83%	0.825	S	S	*	*			trans	-129.2	123.9	136.9	-79.2	176.3	0	0	0	109
110	S	29.2	Very low	29	Very low	109 Å²	109	157.1 Å²	157.1	76%	0.762	83%	0.832	S	S	*	*			trans	-87.8	160.6	168.2	48.4	0	0	0	0	110
111	G	25.8	Very low	28.9	Very low	69 Å²	69	153.6 Å²	153.6	71%	0.711	83%	0.828	S	S	*	*			cis	-163.6	-151.1	1.1	0	0	0	0	0	107.5
112	W	30.3	Very low	28.9	Very low	255 Å²	255	158.3 Å²	158.3	97%	0.966	84%	0.84	S	S	*	*			cis	-135.4	151.6	5	-89.4	46.8	0	0	0	108.5
113	D	24.8	Very low	28.8	Very low	153 Å²	153	156.2 Å²	156.2	82%	0.818	83%	0.829	S	S	*	*			trans	-154.4	129.9	170.9	-166.2	-2.5	0	0	0	109.9
114	R	35.1	Very low	28.9	Very low	240 Å²	240	161.4 Å²	161.4	91%	0.906	83%	0.833	S	S	*	*			trans	-160.8	148	157.2	-91.2	-134.1	168.7	177.8	-3.3	111.8
115	P	40.9	Very low	28.9	Very low	110 Å²	110	158.9 Å²	158.9	71%	0.714	83%	0.829	S	S	*	*			trans	-109.6	174.9	-162.3	41.6	-33.9	0	0	0	114.1
116	W	27.4	Very low	29.4	Very low	252 Å²	252	156 Å²	156	96%	0.955	83%	0.826	S	S	*	*			trans	-84.7	134.5	164.2	-135.7	-66.1	0	0	0	110.3
117	S	26.4	Very low	29.3	Very low	105 Å²	105	156.7 Å²	156.7	73%	0.734	83%	0.831	S	S	*	*			trans	-138.3	124.9	167.3	57.7	0	0	0	0	109.6
118	S	28.1	Very low	29.4	Very low	120 Å²	120	153.1 Å²	153.1	84%	0.839	82%	0.82	S	S	*	*			trans	-65.5	152	175.8	-49.3	0	0	0	0	111.7
119	Q	26.4	Very low	29.5	Very low	192 Å²	192	151.1 Å²	151.1	90%	0.897	82%	0.82	S	S	*	*			trans	-142.7	128.4	163.1	-165.7	164	26.2	0	0	109.6
120	E	26.1	Very low	29.4	Very low	191 Å²	191	148.5 Å²	148.5	89%	0.893	81%	0.812	S	S	*	*			trans	-90.9	147.8	173.9	-64.1	169.4	127.8	0	0	109.5
121	A	28.7	Very low	29.3	Very low	104 Å²	104	152 Å²	152	86%	0.86	82%	0.816	S	S	*	*			trans	-155.1	138.4	166.4	0	0	0	0	0	109.6
122	D	27.7	Very low	29.3	Very low	156 Å²	156	153.9 Å²	153.9	83%	0.834	82%	0.818	S	S	*	*			trans	-96.7	175.1	-170.9	-94.6	-55.7	0	0	0	114.2
123	L	28.7	Very low	29.1	Very low	135 Å²	135	146.6 Å²	146.6	71%	0.707	81%	0.806	S	S	*	*			trans	67.3	96.4	150.2	-74.8	150.8	0	0	0	118.9
124	H	29.3	Very low	29.3	Very low	181 Å²	181	143.9 Å²	143.9	84%	0.838	80%	0.8	S	S	*	*				171.1	160	97	-89	-65.7	0	0	0	112.9
125	S	29.7	Very low	29	Very low	108 Å²	108	137.5 Å²	137.5	76%	0.755	79%	0.792	S	S	*	*			trans	-117.9	164.7	175.2	62.7	0	0	0	0	111.1
126	P	40.2	Very low	28.6	Very low	121 Å²	121	137.1 Å²	137.1	79%	0.786	79%	0.791	S	S	*	*				-146.2	-174.3	91.4	37.8	-19.4	0	0	0	116.1
127	S	27.9	Very low	28.7	Very low	109 Å²	109	132.7 Å²	132.7	76%	0.762	78%	0.783	S	S	*	*			trans	-57.6	168.3	179.5	57.2	0	0	0	0	115.8
128	S	29.3	Very low	29	Very low	97 Å²	97	135.2 Å²	135.2	68%	0.678	79%	0.788	S	S	*	*			cis	-175.2	146	42.3	54.6	0	0	0	0	117.9
129	Q	28.5	Very low	28.9	Very low	183 Å²	183	132.7 Å²	132.7	86%	0.855	78%	0.78	S	S	*	*			trans	63.8	171.1	140.2	-74.1	-171.1	-20.6	0	0	124
130	V	27.6	Very low	29.1	Very low	128 Å²	128	131 Å²	131	78%	0.776	78%	0.775	S	S	*	*			trans	77.8	106.1	177.5	-171.9	0	0	0	0	113.6
131	Q	27.1	Very low	29.4	Very low	183 Å²	183	128.4 Å²	128.4	86%	0.855	77%	0.766	S	S	*	*				63.2	140.7	69	-61.4	-175.6	-7.8	0	0	113
132	S	25	Very low	29.3	Very low	108 Å²	108	130 Å²	130	76%	0.755	76%	0.76	S	S	*	*			cis	-154.1	175.2	24.3	61.6	0	0	0	0	115.8
133	S	26.1	Very low	29.7	Very low	102 Å²	102	129.9 Å²	129.9	71%	0.713	76%	0.759	S	S	*	*			trans	-38	165	157.6	40.5	0	0	0	0	118.1
134	S	29.3	Very low	30.5	Very low	97 Å²	97	128.2 Å²	128.2	68%	0.678	76%	0.756	S	S	*	*			cis	-176	173.2	-7.6	50.9	0	0	0	0	112.7
135	S	29.1	Very low	30.5	Very low	106 Å²	106	128.1 Å²	128.1	74%	0.741	75%	0.754	S	S	*	*			trans	64.1	149.5	146.7	49.2	0	0	0	0	120.7
136	S	31.3	Very low	30.5	Very low	101 Å²	101	127.4 Å²	127.4	71%	0.706	75%	0.749	S	S	*	*			cis	-171.9	158.9	-14.7	49.8	0	0	0	0	110.8
137	M	30.6	Very low	30	Very low	160 Å²	160	126.7 Å²	126.7	79%	0.788	75%	0.747	S	S	*	*			trans	156	130.4	133.5	-85.7	-60.9	-142.5	0	0	114.6
138	L	31.9	Very low	30.2	Very low	158 Å²	158	129.3 Å²	129.3	83%	0.827	75%	0.751	S	S	*	*			trans	45.7	132.9	147.7	-60.7	165.7	0	0	0	121.8
139	G	27.4	Very low	30.2	Very low	66 Å²	66	132.7 Å²	132.7	68%	0.68	76%	0.76	S	S	*	*			cis	165.7	178.8	-8.8	0	0	0	0	0	116.9
140	M	30	Very low	30.2	Very low	158 Å²	158	127.4 Å²	127.4	78%	0.778	76%	0.755	S	S	*	*			trans	75.6	108.4	157.8	-53.2	-138.4	90.8	0	0	121.8
141	L	31.2	Very low	30.2	Very low	135 Å²	135	131 Å²	131	71%	0.707	76%	0.76	S	S	*	*			trans	66.3	143.5	134	-53.5	-177.7	0	0	0	119.2
142	N	27.1	Very low	31.3	Very low	139 Å²	139	127.8 Å²	127.8	74%	0.743	76%	0.755	S	S	*	*			cis	-145.7	156.2	11.2	-110.5	-28.2	0	0	0	112.4
143	N	36.9	Very low	32.4	Very low	153 Å²	153	128.6 Å²	128.6	82%	0.818	76%	0.758	S	S	*	*			trans	-151.3	140.8	166.8	-119.4	-15.2	0	0	0	106.9
144	P	44.7	Very low	32.4	Very low	99 Å²	99	127 Å²	127	64%	0.643	76%	0.757	S	S	*	*				-154.3	178.5	109.1	42.9	-26.1	0	0	0	113.3
145	F	29.9	Very low	32.3	Very low	179 Å²	179	133.5 Å²	133.5	79%	0.785	77%	0.768	S	S	*	*			cis	-129.6	144.2	1.4	-80.1	-84.5	0	0	0	108.1
146	S	29.2	Very low	32.3	Very low	94 Å²	94	135.8 Å²	135.8	66%	0.657	77%	0.772	S	S	*	*				63.4	131	71.6	119.6	0	0	0	0	114
147	S	29.4	Very low	33	Very low	105 Å²	105	136.5 Å²	136.5	73%	0.734	77%	0.774	S	S	*	*			cis	-161.1	-159.8	-4.1	-80.2	0	0	0	0	107.4
148	I	32.1	Very low	32.8	Very low	164 Å²	164	137.2 Å²	137.2	84%	0.841	78%	0.775	S	S	*	*			cis	-150.3	174.8	11.2	-42.7	161.5	0	0	0	109
149	L	30.6	Very low	32.6	Very low	169 Å²	169	137.7 Å²	137.7	89%	0.885	77%	0.773	S	S	*	*			trans	-63.3	169.9	165.3	-95	54.3	0	0	0	113.7
150	G	27.6	Very low	32.6	Very low	72 Å²	72	139.2 Å²	139.2	74%	0.742	77%	0.773	S	S	*	*			cis	-175.7	-167.1	7.4	0	0	0	0	0	113.8
151	K	28.8	Very low	32.6	Very low	204 Å²	204	139.9 Å²	139.9	89%	0.887	78%	0.776	S	S	*	*			trans	-117.9	-159.1	-176.3	-61.4	-175.9	178.1	-179.9	0	112.5
152	P	48.6	Very low	32.3	Very low	115 Å²	115	140.4 Å²	140.4	75%	0.747	78%	0.78	S	S	*	*				-118.5	-136.7	-99.5	43.1	-23.5	0	0	0	110
153	P	49.4	Very low	32.3	Very low	124 Å²	124	140.5 Å²	140.5	81%	0.805	79%	0.785	S	S	*	*			cis	-129.4	-175.4	-29.7	39.4	-22.6	0	0	0	114.3
154	G	25.3	Very low	32	Very low	68 Å²	68	139 Å²	139	70%	0.701	78%	0.782	S	S	*	*			trans	169.9	98.4	159.8	0	0	0	0	0	121.1
155	Y	27.7	Very low	31.2	Very low	234 Å²	234	138.2 Å²	138.2	92%	0.918	78%	0.784	S	S	*	*			trans	57.7	171.5	145.4	-80.1	-86.9	0	0	0	124.3
156	L	29.7	Very low	31.1	Very low	155 Å²	155	137.1 Å²	137.1	81%	0.812	79%	0.786	S	S	*	*			trans	-112.6	-164.2	-163.7	-55	159.7	0	0	0	111.1
157	P	45.6	Very low	31.1	Very low	115 Å²	115	142.4 Å²	142.4	75%	0.747	80%	0.797	S	S	*	*			cis	-132.8	178.7	-19.2	38.4	-21.4	0	0	0	114.6
158	H	26.7	Very low	31.2	Very low	175 Å²	175	145.4 Å²	145.4	81%	0.81	80%	0.804	S	S	*	*				-176.6	170.4	126	-148	-98.5	0	0	0	113.4
159	E	26.8	Very low	31.1	Very low	169 Å²	169	143.9 Å²	143.9	79%	0.79	79%	0.793	S	S	*	*			trans	-100.3	179	177.1	-49.6	-170.9	105	0	0	112.4
160	S	27.8	Very low	30.9	Very low	97 Å²	97	145.7 Å²	145.7	68%	0.678	79%	0.794	S	S	*	*			cis	-169.7	179.9	26.8	66.1	0	0	0	0	115.2
161	M	28.7	Very low	31.1	Very low	172 Å²	172	149.8 Å²	149.8	85%	0.847	79%	0.792	S	S	*	*			trans	81.9	157.9	151.5	-72.6	-69	171.4	0	0	122.8
162	N	26.2	Very low	31.5	Very low	146 Å²	146	146 Å²	146	78%	0.781	79%	0.788	S	S	*	*			trans	-85.9	166.3	-176.4	-60.4	-44.5	0	0	0	113.7
163	V	27.1	Very low	30.4	Very low	142 Å²	142	144 Å²	144	86%	0.861	79%	0.788	S	S	*	*				-179.8	168.2	119.1	147.6	0	0	0	0	111.9
164	T	30.3	Very low	29.3	Very low	121 Å²	121	146.9 Å²	146.9	74%	0.742	79%	0.793	S	S	*	*			trans	-81.3	156.5	-159	53.3	0	0	0	0	118.9
165	A	27.5	Very low	29.4	Very low	83 Å²	83	147.8 Å²	147.8	69%	0.686	79%	0.794	S	S	*	*			trans	78.4	148.8	135.7	0	0	0	0	0	122.5
166	D	28.6	Very low	29.5	Very low	155 Å²	155	147.9 Å²	147.9	83%	0.829	79%	0.793	S	S	*	*			trans	47.5	110.6	153.8	-56.3	-19.6	0	0	0	121.3
167	F	29.2	Very low	29.4	Very low	205 Å²	205	148.9 Å²	148.9	90%	0.899	80%	0.795	S	S	*	*			trans	-149.9	102.4	145.2	-143.1	-92.1	0	0	0	112.7
168	L	31.1	Very low	28.5	Very low	168 Å²	168	147.4 Å²	147.4	88%	0.88	79%	0.793	S	S	*	*			trans	-146.2	82.5	172.1	-162.7	172.9	0	0	0	110
169	E	29.4	Very low	28.3	Very low	132 Å²	132	146.2 Å²	146.2	62%	0.617	79%	0.792	S	S	*	*			trans	-165.1	119.7	156.1	-125.6	-172.4	-163.1	0	0	113.8	F171	E169-F171 HydrophobicContact CG-CE2 3.64Å; E169-F171 HydrophobicContact CG-CZ 3.92Å; E169-F171 WeakPolarHBondContact OE1-CE2 3.4Å; E169-F171 WeakPolarHBondContact OE1-CZ 3.25Å
170	K	27.3	Very low	28.3	Very low	207 Å²	207	148.8 Å²	148.8	90%	0.9	80%	0.795	S	S	*	*				-173	139	127.6	-103.1	160.6	-176.6	169.8	0	112.3
171	F	31.7	Very low	28.3	Very low	159 Å²	159	151 Å²	151	70%	0.697	80%	0.798	S	S	*	*			trans	-100.7	-164	-171	-44	-99.4	0	0	0	111.3	E169	E169-F171 HydrophobicContact CG-CE2 3.64Å; E169-F171 HydrophobicContact CG-CZ 3.92Å; E169-F171 WeakPolarHBondContact OE1-CE2 3.4Å; E169-F171 WeakPolarHBondContact OE1-CZ 3.25Å
172	P	36.1	Very low	28.1	Very low	125 Å²	125	149.3 Å²	149.3	81%	0.812	79%	0.793	S	S	*	*			cis	-136	161.8	-19.8	23.9	-1.1	0	0	0	116.9
173	G	25.5	Very low	28	Very low	72 Å²	72	147.6 Å²	147.6	74%	0.742	79%	0.792	S	S	*	*			trans	79.6	-179.4	139.9	0	0	0	0	0	120.1
174	M	26.6	Very low	27.9	Very low	185 Å²	185	145.2 Å²	145.2	91%	0.911	78%	0.782	S	S	*	*			cis	-157	159.9	-21.5	-73.2	-149.1	82.1	0	0	110.5
175	A	28.1	Very low	27.7	Very low	87 Å²	87	145 Å²	145	72%	0.719	79%	0.786	S	S	*	*			trans	61.1	122.7	170.3	0	0	0	0	0	117.6
176	R	30	Very low	27.6	Very low	235 Å²	235	150.4 Å²	150.4	89%	0.887	79%	0.794	S	S	*	*				62.4	125	68.9	-64.6	178.6	180	163.5	0.1	112.4
177	M	26.7	Very low	27.7	Very low	176 Å²	176	150.4 Å²	150.4	87%	0.867	79%	0.793	S	S	*	*			cis	-160.1	157.1	21.5	-126.4	176.7	-169.9	0	0	114.1
178	A	26.3	Very low	27.6	Very low	84 Å²	84	145 Å²	145	69%	0.694	77%	0.774	S	S	*	*			trans	70.6	118.9	147	0	0	0	0	0	124.8
179	N	24.3	Very low	27.4	Very low	150 Å²	150	142.9 Å²	142.9	80%	0.802	77%	0.773	S	S	*	*			trans	80.7	114.8	134.5	-78.1	-30	0	0	0	125.2
180	R	26.3	Very low	27.3	Very low	224 Å²	224	146.3 Å²	146.3	85%	0.845	78%	0.78	S	S	*	*			trans	97.3	121.2	131.5	-80.1	-172.8	174.9	-175.1	-1.8	122.8
181	L	26.8	Very low	27.4	Very low	143 Å²	143	141.8 Å²	141.8	75%	0.749	77%	0.774	S	S	*	*			trans	92.7	118.5	146.5	-66.8	163.5	0	0	0	120.9
182	D	25.1	Very low	27.2	Very low	136 Å²	136	139.6 Å²	139.6	73%	0.727	78%	0.779	S	S	*	*			trans	49.6	118.7	146.7	-48.4	-19.2	0	0	0	120.2
183	S	24	Very low	27.1	Very low	110 Å²	110	137.5 Å²	137.5	77%	0.769	77%	0.767	S	S	*	*				-168.8	144.1	71.1	-66.6	0	0	0	0	116.1
184	S	25.7	Very low	27.5	Very low	93 Å²	93	137 Å²	137	65%	0.65	75%	0.751	S	S	*	*			trans	9.1	124.6	154.1	60.1	0	0	0	0	123.5
185	S	26	Very low	27.9	Very low	117 Å²	117	132 Å²	132	82%	0.818	73%	0.726	S	S	*	*				175	99	117.1	37.9	0	0	0	0	110.6
186	F	25.8	Very low	28.1	Very low	195 Å²	195	134.5 Å²	134.5	86%	0.855	73%	0.727	S	S	*	*				80.6	100.5	82	-77.7	-59	0	0	0	115.9
187	L	29.2	Very low	28.4	Very low	155 Å²	155	124.9 Å²	124.9	81%	0.812	70%	0.696	S	S	*	*			trans	-68.4	-178.8	157.6	-63.5	168	0	0	0	109
188	D	27.5	Very low	28.9	Very low	93 Å²	93	122.3 Å²	122.3	50%	0.497	68%	0.682	S	S	.	*			cis	-171.3	156	41.5	-149.1	-21.2	0	0	0	112.3	R190	D188-R190 IonicContact OD1-NE 3.99Å; D188-R190 IonicContact OD2-CZ 3.18Å; D188-R190 IonicContact OD2-NE 2.73Å; D188-R190 PolarHBondContact OD2-NE 2.95Å; D188-R190 IonicContact OD2-NH2 2.75Å; D188-R190 PolarHBondContact OD2-NH2 3.35Å
189	S	26.1	Very low	29.5	Very low	123 Å²	123	120.4 Å²	120.4	86%	0.86	66%	0.661	S	S	*	*			trans	-127.4	89.8	178.4	-79.4	0	0	0	0	110.2
190	R	28.2	Very low	30	Very low	203 Å²	203	116.5 Å²	116.5	77%	0.766	65%	0.646	S	S	*	*			trans	-104.3	111.8	-172.9	-62.8	-172.1	-177.1	-162.8	0.3	113	D188	D188-R190 IonicContact OD1-NE 3.99Å; D188-R190 IonicContact OD2-CZ 3.18Å; D188-R190 IonicContact OD2-NE 2.73Å; D188-R190 PolarHBondContact OD2-NE 2.95Å; D188-R190 IonicContact OD2-NH2 2.75Å; D188-R190 PolarHBondContact OD2-NH2 3.35Å
191	S	29.2	Very low	30.3	Very low	112 Å²	112	107.2 Å²	107.2	78%	0.783	62%	0.62	S	S	*	*			trans	-90.3	95.8	166.3	56.2	0	0	0	0	110.6	S193	S191-S193 PolarHBondContact O-N 2.85Å
192	S	27.7	Very low	30.4	Very low	113 Å²	113	105 Å²	105	79%	0.79	60%	0.604	S	S	*	*			trans	-74.4	104.2	-179.7	-59.3	0	0	0	0	111.9
193	S	34.3	Very low	30.8	Very low	81 Å²	81	102.9 Å²	102.9	57%	0.566	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-100.4	137.6	169	-58	0	0	0	0	110.2	S191	S191-S193 PolarHBondContact O-N 2.85Å
194	P	33	Very low	31.1	Very low	63 Å²	63	103.8 Å²	103.8	41%	0.409	61%	0.606	S	S	.	*	P	Polyproline II helix	trans	-77.4	124.3	177.7	30.9	-32.7	0	0	0	111
195	E	36.7	Very low	31.2	Very low	79 Å²	79	103 Å²	103	37%	0.369	61%	0.613	S	S	.	*	P	Polyproline II helix	trans	-81.4	150.3	158.2	-60.5	171.7	123.4	0	0	108.9	K573	E195-K573 IonicContact OE2-NZ 2.77Å; E195-K573 PolarHBondContact OE2-NZ 3.17Å
196	D	31.6	Very low	31.5	Very low	139 Å²	139	102.2 Å²	102.2	74%	0.743	61%	0.607	S	S	*	*			trans	67.9	114.5	-176.9	-50	-34	0	0	0	115.6
197	S	36.3	Very low	31.6	Very low	34 Å²	34	100.1 Å²	100.1	24%	0.238	61%	0.605	C	S	.	*			trans	-158	120.2	171.1	-75.5	0	0	0	0	111.3	T199 N571	S197-T199 PolarHBondContact O-N 3.38Å; S197-N571 PolarHBondContact OG-ND2 2.96Å
198	E	38	Very low	32.1	Very low	122 Å²	122	101.3 Å²	101.3	57%	0.57	61%	0.606	S	S	*	*			trans	-80.3	38.9	-165.1	-56.4	-174.1	106.5	0	0	115.2	K359	E198-K359 VanDerWaalsContact OE1-CB 3.22Å; E198-K359 WeakPolarHBondContact OE1-CB 2.8Å
199	T	37.5	Very low	32.4	Very low	44 Å²	44	105 Å²	105	27%	0.27	63%	0.625	S	S	.	*			trans	-93.6	-4.8	-168	72.8	0	0	0	0	115.9	S197 G201 I483	S197-T199 PolarHBondContact O-N 3.38Å; T199-G201 PolarHBondContact O-N 2.99Å; T199-I483 PolarHBondContact OG1-O 3.5Å
200	S	34.6	Very low	32.9	Very low	67 Å²	67	104 Å²	104	47%	0.469	62%	0.617	S	S	.	*			trans	-78.8	48.6	-172.8	51	0	0	0	0	114.9
201	G	32.4	Very low	33.3	Very low	29 Å²	29	101 Å²	101	30%	0.299	62%	0.616	S	S	.	*			trans	-95.6	117.6	173.7	0	0	0	0	0	113.4	T199 K514	T199-G201 PolarHBondContact O-N 2.99Å; G201-K514 PolarHBondContact O-NZ 2.92Å
202	F	30	Very low	33.7	Very low	98 Å²	98	104.5 Å²	104.5	43%	0.43	62%	0.623	S	S	.	*			trans	-126.6	128.2	169.3	-62.6	-81.6	0	0	0	112.3	H450 K514	F202-H450 AromaticContact CD1-CD2 3.89Å; F202-H450 HydrophobicContact CE1-CB 4.48Å; F202-H450 AromaticContact CE1-CD2 3.42Å; F202-H450 VanDerWaalsContact CE1-CD2 3.42Å; F202-H450 WeakPolarHBondContact CE1-CD2 3.14Å; F202-K514 HydrophobicContact CD1-CD 4Å; F202-K514 HydrophobicContact CE1-CD 3.69Å; F202-K514 VanDerWaalsContact CE1-CE 3.48Å; F202-K514 HydrophobicContact CE1-CG 4.24Å
203	S	33.1	Very low	34.3	Very low	91 Å²	91	106.3 Å²	106.3	64%	0.636	62%	0.623	S	S	*	*			trans	-149	123.8	151.5	-50.5	0	0	0	0	102.9
204	S	29.5	Very low	34.3	Very low	128 Å²	128	106.8 Å²	106.8	90%	0.895	63%	0.626	S	S	*	*				57.4	101.7	56.1	-159.1	0	0	0	0	109.3
205	G	28.6	Very low	34.3	Very low	78 Å²	78	111 Å²	111	80%	0.804	65%	0.645	S	S	*	*			trans	-117.9	124.5	-166	0	0	0	0	0	113.3
206	S	32.9	Very low	34.3	Very low	99 Å²	99	113.9 Å²	113.9	69%	0.692	66%	0.662	S	S	*	*			trans	-155.4	164.3	143.9	59.5	0	0	0	0	107
207	D	28.2	Very low	34.3	Very low	152 Å²	152	118.3 Å²	118.3	81%	0.813	67%	0.668	S	S	*	*			trans	78.4	95.4	178.3	-48.5	-15.6	0	0	0	115.7
208	H	38.1	Very low	34.2	Very low	180 Å²	180	124.4 Å²	124.4	83%	0.833	70%	0.696	S	S	*	*			trans	-118.7	170.5	164	-65.2	-36.7	0	0	0	109.4
209	L	33.8	Very low	33.9	Very low	170 Å²	170	123.4 Å²	123.4	89%	0.89	70%	0.703	S	S	*	*	S	Bend	trans	83.5	45.1	173.4	-46.2	178.5	0	0	0	118.5
210	C	37.3	Very low	33.6	Very low	103 Å²	103	127.2 Å²	127.2	70%	0.696	73%	0.728	S	S	*	*	S	Bend	trans	-121.4	-56.7	160.1	-75.9	0	0	0	0	114.6	M212	C210-M212 PolarHBondContact O-N 3.39Å
211	D	36.4	Very low	33.8	Very low	138 Å²	138	129.5 Å²	129.5	74%	0.738	74%	0.742	S	S	*	*	G	3₁₀ helix	trans	-74.1	-15.9	-162.1	-71.5	-39.2	0	0	0	116.9	L213	D211-L213 VanDerWaalsContact C-N 3.3Å; D211-L213 PolarHBondContact O-N 3.26Å
212	M	37.4	Very low	33.6	Very low	187 Å²	187	136 Å²	136	92%	0.921	77%	0.769	S	S	*	*	G	3₁₀ helix	trans	-73.5	-14.4	-179.4	-95.7	-172.9	165.9	0	0	114.8	C210	C210-M212 PolarHBondContact O-N 3.39Å
213	L	40.1	Very low	33.9	Very low	151 Å²	151	136.8 Å²	136.8	79%	0.791	78%	0.784	S	S	*	*	G	3₁₀ helix	trans	-88.1	-8.2	179	-72	171.9	0	0	0	114	D211 N215	D211-L213 VanDerWaalsContact C-N 3.3Å; D211-L213 PolarHBondContact O-N 3.26Å; L213-N215 PolarHBondContact O-N 3.45Å
214	S	35.7	Very low	33.8	Very low	91 Å²	91	142.9 Å²	142.9	64%	0.636	79%	0.794	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	-12.8	-173.2	-62.1	0	0	0	0	115.1
215	N	32.1	Very low	33.7	Very low	150 Å²	150	143.3 Å²	143.3	80%	0.802	79%	0.791	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.2	6.3	-171.6	-76.2	-53.1	0	0	0	115.6	L213	L213-N215 PolarHBondContact O-N 3.45Å
216	L	36	Very low	33.6	Very low	141 Å²	141	145 Å²	145	74%	0.738	79%	0.786	S	S	*	*			trans	-107.1	79.4	173.9	-82.5	169.1	0	0	0	112
217	R	31.5	Very low	33.3	Very low	231 Å²	231	145.6 Å²	145.6	87%	0.872	79%	0.79	S	S	*	*			trans	-126.7	95.2	160.1	-76.8	-172.8	176.8	154.7	1.8	110.3
218	I	35	Very low	33.2	Very low	162 Å²	162	145.1 Å²	145.1	83%	0.831	79%	0.788	S	S	*	*			trans	-84.6	120.5	166.8	-58.6	172.4	0	0	0	107
219	S	31	Very low	32.7	Very low	101 Å²	101	143 Å²	143	71%	0.706	78%	0.78	S	S	*	*			trans	-127.9	132.7	177.7	-65.5	0	0	0	0	110.5
220	P	32.5	Very low	32.5	Very low	124 Å²	124	141.7 Å²	141.7	81%	0.805	77%	0.769	S	S	*	*			trans	-82.5	163	179.3	34.2	-35.7	0	0	0	113.1
221	P	38.2	Very low	32.2	Very low	115 Å²	115	144.4 Å²	144.4	75%	0.747	77%	0.769	S	S	*	*			trans	-91.1	173.6	-179.9	37.5	-36.9	0	0	0	114.1
222	L	27.8	Very low	31.8	Very low	166 Å²	166	144.3 Å²	144.3	87%	0.869	77%	0.769	S	S	*	*			trans	117.6	157	169.2	-69.9	164.3	0	0	0	113.9
223	P	36.9	Very low	31.3	Very low	114 Å²	114	142.5 Å²	142.5	74%	0.74	76%	0.762	S	S	*	*			cis	-131.1	-174.6	-25.1	35.6	-17.2	0	0	0	114.1
224	Y	31	Very low	30.9	Very low	219 Å²	219	142.7 Å²	142.7	86%	0.859	76%	0.763	S	S	*	*			trans	-91.6	133.9	179.6	-139.2	-96.4	0	0	0	112.2
225	V	27.7	Very low	30.6	Very low	138 Å²	138	150.6 Å²	150.6	84%	0.836	78%	0.779	S	S	*	*			trans	-147.8	152.3	162.4	-170.7	0	0	0	0	110.4
226	T	26.2	Very low	30.5	Very low	112 Å²	112	151.3 Å²	151.3	69%	0.687	78%	0.782	S	S	*	*			trans	-106.6	154.2	-175.3	54.4	0	0	0	0	113.6
227	S	26.1	Very low	30.1	Very low	112 Å²	112	148 Å²	148	78%	0.783	78%	0.781	S	S	*	*				158.1	115.1	121.6	55.9	0	0	0	0	117.2
228	N	25.5	Very low	29.9	Very low	142 Å²	142	142.8 Å²	142.8	76%	0.759	78%	0.776	S	S	*	*				59.7	155.5	119.6	-134.9	-2.3	0	0	0	124.7
229	M	29.3	Very low	29.7	Very low	137 Å²	137	145.1 Å²	145.1	68%	0.675	77%	0.774	S	S	*	*			trans	73.1	149.8	168.5	-59.1	-69.8	98.6	0	0	118.9
230	Q	29.7	Very low	29.8	Very low	142 Å²	142	147.2 Å²	147.2	66%	0.664	78%	0.777	S	S	*	*			cis	-168.4	160.2	-33.5	-154.3	-165.7	9.3	0	0	109.1
231	K	29.5	Very low	29.8	Very low	160 Å²	160	148 Å²	148	70%	0.696	77%	0.774	S	S	*	*			trans	71.6	150	166.6	-60.3	-177.7	-176	-179.9	0	115.7
232	D	29	Very low	30.5	Very low	136 Å²	136	146.9 Å²	146.9	73%	0.727	77%	0.767	S	S	*	*			cis	-159.1	177.3	-13.2	-98.4	-22.4	0	0	0	106.2
233	L	27.5	Very low	30.7	Very low	148 Å²	148	146.9 Å²	146.9	78%	0.775	76%	0.762	S	S	*	*			cis	-148.5	-138.5	15.9	-140.9	163.7	0	0	0	109.9
234	L	31.1	Very low	30.5	Very low	156 Å²	156	147.3 Å²	147.3	82%	0.817	76%	0.758	S	S	*	*			trans	-122.4	149.9	-171	-64.5	164.4	0	0	0	114.7
235	R	29.3	Very low	30.4	Very low	256 Å²	256	143.1 Å²	143.1	97%	0.966	76%	0.756	S	S	*	*				-156.7	154.6	126.8	-118.7	-179.2	-176.8	-165.4	-0.3	112.8
236	L	28.8	Very low	30.6	Very low	165 Å²	165	142.3 Å²	142.3	86%	0.864	76%	0.756	S	S	*	*			trans	-135.2	149.5	-168.5	-175.3	71.2	0	0	0	110.7
237	G	27.6	Very low	31	Very low	71 Å²	71	142 Å²	142	73%	0.732	76%	0.759	S	S	*	*			trans	-166	143.2	171.5	0	0	0	0	0	111.5
238	T	29.3	Very low	32	Very low	122 Å²	122	142.3 Å²	142.3	75%	0.748	76%	0.758	S	S	*	*			trans	-150.8	162.7	-162.7	-37.9	0	0	0	0	112.2
239	R	30.7	Very low	32.3	Very low	212 Å²	212	142.3 Å²	142.3	80%	0.8	76%	0.757	S	S	*	*			trans	105.8	146.8	173	-65.1	-170.8	172.7	-78.3	2.7	114.4
240	L	32.3	Very low	32.6	Very low	145 Å²	145	141.6 Å²	141.6	76%	0.759	76%	0.761	S	S	*	*			cis	-150.4	-165.2	-2.2	-122.3	172.6	0	0	0	111.7
241	D	32.8	Very low	33.5	Very low	140 Å²	140	140.6 Å²	140.6	75%	0.749	77%	0.767	S	S	*	*			trans	-120.4	-155.1	-156	-147.5	21.2	0	0	0	112.8
242	P	51.8	Low	34.6	Very low	92 Å²	92	138.4 Å²	138.4	60%	0.597	77%	0.769	S	S	*	*				-120.2	-159.6	-78	34.3	-15.1	0	0	0	115.5
243	Q	32.7	Very low	35.5	Very low	166 Å²	166	138.2 Å²	138.2	78%	0.776	78%	0.775	S	S	*	*			trans	81.7	147.9	157.3	-85.3	-172.3	-56.8	0	0	119.8
244	D	31.7	Very low	35.7	Very low	122 Å²	122	136.8 Å²	136.8	65%	0.652	78%	0.777	S	S	*	*			cis	-163	-173.1	-8.2	-143.1	-31.7	0	0	0	113.5
245	T	31	Very low	35.7	Very low	131 Å²	131	134.1 Å²	134.1	80%	0.804	78%	0.778	S	S	*	*			trans	99.8	158	159.3	72.8	0	0	0	0	120.8
246	S	30.6	Very low	35.7	Very low	122 Å²	122	127.5 Å²	127.5	85%	0.853	77%	0.771	S	S	*	*			trans	-155.6	-178	-147.9	60.5	0	0	0	0	116.7
247	S	34.8	Very low	36.3	Very low	106 Å²	106	125.4 Å²	125.4	74%	0.741	77%	0.767	S	S	*	*			trans	-74.7	171	-168.9	-34.6	0	0	0	0	118
248	P	47	Very low	36.4	Very low	118 Å²	118	126.7 Å²	126.7	77%	0.766	77%	0.77	S	S	*	*				-136.7	176.9	127.5	16	6.3	0	0	0	113
249	L	32.7	Very low	36.4	Very low	142 Å²	142	125.8 Å²	125.8	74%	0.743	77%	0.769	S	S	*	*			cis	166.6	110.6	-38	-97.1	168.6	0	0	0	109.3
250	T	34.6	Very low	36.3	Very low	121 Å²	121	120.7 Å²	120.7	74%	0.742	77%	0.766	S	S	*	*			trans	70.4	177.6	134.3	62.1	0	0	0	0	121.8
251	P	48.4	Very low	36.1	Very low	122 Å²	122	119.1 Å²	119.1	79%	0.792	77%	0.767	S	S	*	*				-134.1	-135.3	-73	49.8	-31.7	0	0	0	114.4
252	P	54.1	Low	36	Very low	113 Å²	113	120.7 Å²	120.7	73%	0.734	77%	0.774	S	S	*	*			trans	-117.2	-169.6	-150.9	43.1	-21.4	0	0	0	115.6
253	P	47.9	Very low	34.8	Very low	132 Å²	132	120.6 Å²	120.6	86%	0.857	78%	0.776	S	S	*	*				-151.6	-158.2	89.6	41.7	-21.1	0	0	0	115.5
254	S	30.2	Very low	34.8	Very low	118 Å²	118	123.8 Å²	123.8	83%	0.825	78%	0.781	S	S	*	*			trans	-124.7	149.9	-161	57.1	0	0	0	0	116.9
255	A	30.7	Very low	34.7	Very low	100 Å²	100	128.8 Å²	128.8	83%	0.826	79%	0.79	S	S	*	*			trans	-158.6	166.3	161.6	0	0	0	0	0	113.4
256	S	29.5	Very low	34.6	Very low	118 Å²	118	134.1 Å²	134.1	83%	0.825	80%	0.796	S	S	*	*			trans	-151.1	172.9	177.5	-71.9	0	0	0	0	108.4
257	P	43	Very low	34.6	Very low	121 Å²	121	139.1 Å²	139.1	79%	0.786	80%	0.796	S	S	*	*			cis	-138.2	-165.7	10.3	44.3	-25.7	0	0	0	115.8
258	A	27.8	Very low	34.2	Very low	97 Å²	97	140.1 Å²	140.1	80%	0.802	80%	0.803	S	S	*	*			trans	71.4	147.3	164.3	0	0	0	0	0	117.9
259	S	29.8	Very low	33.3	Very low	103 Å²	103	138.1 Å²	138.1	72%	0.72	80%	0.804	S	S	*	*			cis	-155.7	161.9	-8	43.5	0	0	0	0	111.5
260	S	28.6	Very low	33.2	Very low	106 Å²	106	136.5 Å²	136.5	74%	0.741	80%	0.804	S	S	*	*			trans	40.4	123.4	156.5	55.3	0	0	0	0	119.8
261	S	29	Very low	33.5	Very low	112 Å²	112	136.2 Å²	136.2	78%	0.783	80%	0.804	S	S	*	*			cis	-172.9	148.3	39.2	45.2	0	0	0	0	114.6
262	I	30.2	Very low	32.6	Very low	172 Å²	172	142 Å²	142	88%	0.882	81%	0.811	S	S	*	*			trans	14.8	107.5	153.9	-51.4	168.3	0	0	0	118.9
263	S	27	Very low	31.7	Very low	91 Å²	91	142.3 Å²	142.3	64%	0.636	81%	0.813	S	S	*	*			trans	-161.8	126.2	133.5	-155.8	0	0	0	0	114.5
264	R	32	Very low	30.9	Very low	233 Å²	233	138.6 Å²	138.6	88%	0.879	80%	0.798	S	S	*	*			trans	61.9	147.7	158.3	-76.6	-178.7	-79.6	-163.2	-2.9	121.3
265	R	30	Very low	31.1	Very low	227 Å²	227	138 Å²	138	86%	0.857	79%	0.794	S	S	*	*			trans	76.6	100.2	157.5	-157	-174.7	-145.3	-169.7	8.3	118
266	W	28.3	Very low	31.3	Very low	243 Å²	243	139.6 Å²	139.6	92%	0.92	79%	0.789	S	S	*	*			trans	-112.4	129.1	152.9	-78.4	97.8	0	0	0	110.5
267	R	30.3	Very low	31.5	Very low	227 Å²	227	140.8 Å²	140.8	86%	0.857	78%	0.783	S	S	*	*			trans	-109.7	146.1	141.1	-70.4	-165.4	-169.2	-157.5	8.1	106.1
268	S	27.8	Very low	31.2	Very low	126 Å²	126	141.4 Å²	141.4	88%	0.881	78%	0.779	S	S	*	*			trans	-153.5	150.7	152	-164.7	0	0	0	0	108.1
269	G	26.8	Very low	31.6	Very low	77 Å²	77	143.5 Å²	143.5	79%	0.794	78%	0.777	S	S	*	*			trans	126.2	87.9	-170.7	0	0	0	0	0	112.2
270	S	31.3	Very low	31.8	Very low	107 Å²	107	146.4 Å²	146.4	75%	0.748	78%	0.779	S	S	*	*			trans	-113.6	-174.1	165.7	55.2	0	0	0	0	108.6
271	P	40.9	Very low	32.3	Very low	115 Å²	115	146 Å²	146	75%	0.747	78%	0.776	S	S	*	*				-123.2	130.4	-67.7	33.6	-20.5	0	0	0	111.3
272	W	29.6	Very low	33.1	Very low	243 Å²	243	145.1 Å²	145.1	92%	0.92	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-103.3	138.7	162.9	-68.2	90.7	0	0	0	108.9
273	P	35.9	Very low	34	Very low	121 Å²	121	141.2 Å²	141.2	79%	0.786	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-62.6	138.7	175.4	26.9	-33.4	0	0	0	110
274	G	31.3	Very low	34.9	Very low	53 Å²	53	139.7 Å²	139.7	55%	0.546	74%	0.736	S	S	.	*	P	Polyproline II helix	trans	-63.9	140.2	-166.5	0	0	0	0	0	114.1	D276	G274-D276 PolarHBondContact O-N 2.88Å; G274-D276 VanDerWaalsContact O-N 3.08Å
275	S	33.5	Very low	36.1	Very low	106 Å²	106	136.2 Å²	136.2	74%	0.741	73%	0.728	S	S	*	*	G	3₁₀ helix	trans	-75.8	16.5	173.8	-168.8	0	0	0	0	113.2	M277	S275-M277 VanDerWaalsContact C-N 3.34Å
276	D	34.4	Very low	38.6	Very low	134 Å²	134	125.9 Å²	125.9	72%	0.717	69%	0.691	S	S	*	*	G	3₁₀ helix	trans	-90.8	5.5	-173.1	-52.6	-52.7	0	0	0	113.1	G274	G274-D276 PolarHBondContact O-N 2.88Å; G274-D276 VanDerWaalsContact O-N 3.08Å
277	M	33.3	Very low	41.3	Very low	142 Å²	142	114.6 Å²	114.6	70%	0.7	65%	0.648	S	S	*	*	G	3₁₀ helix	trans	-114.2	21.5	-177.8	-70.4	-89.1	74	0	0	114.1	S275	S275-M277 VanDerWaalsContact C-N 3.34Å
278	L	36.9	Very low	44	Very low	134 Å²	134	106.1 Å²	106.1	70%	0.702	62%	0.618	S	S	*	*	S	Bend	trans	-123.7	-8.2	171.8	-74.2	172.8	0	0	0	114.3	Q280 S281	L278-Q280 VanDerWaalsContact C-N 3.32Å; L278-Q280 PolarHBondContact O-N 2.82Å; L278-S281 PolarHBondContact O-OG 3.18Å; L278-S281 VanDerWaalsContact O-OG 3.05Å
279	D	36.5	Very low	46.8	Very low	142 Å²	142	104.5 Å²	104.5	76%	0.759	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	-3.1	-176.6	-150.9	42	0	0	0	113.6
280	Q	34.2	Very low	49.6	Very low	163 Å²	163	103.2 Å²	103.2	76%	0.762	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	-5.2	178.6	-67.5	-173.3	9.3	0	0	114.2	L278	L278-Q280 VanDerWaalsContact C-N 3.32Å; L278-Q280 PolarHBondContact O-N 2.82Å
281	S	40.1	Very low	52.2	Low	97 Å²	97	98.2 Å²	98.2	68%	0.678	53%	0.531	S	S	*	.	S	Bend	trans	-92.4	-11.2	-179.2	38.2	0	0	0	0	115.4	L278	L278-S281 PolarHBondContact O-OG 3.18Å; L278-S281 VanDerWaalsContact O-OG 3.05Å
282	D	44	Very low	54.2	Low	95 Å²	95	98.6 Å²	98.6	51%	0.508	52%	0.518	S	S	.	.	S	Bend	trans	-100.5	-3.5	-170.5	-153.7	46.6	0	0	0	114.3	A284 F285 R550	D282-A284 PolarHBondContact O-N 2.7Å; D282-A284 VanDerWaalsContact O-N 3.1Å; D282-F285 PolarHBondContact O-N 2.69Å; D282-R550 IonicContact OD2-NH2 3.73Å
283	D	49.3	Very low	56.9	Low	90 Å²	90	92.4 Å²	92.4	48%	0.481	50%	0.502	S	S	.	.	G	3₁₀ helix	trans	-61.5	-25.3	-173.4	-171.4	11.7	0	0	0	113	F285 S286 R289	D283-F285 VanDerWaalsContact C-N 3.25Å; D283-F285 PolarHBondContact O-N 3.08Å; D283-F285 VanDerWaalsContact O-N 3.13Å; D283-S286 PolarHBondContact O-N 2.78Å; D283-R289 PolarHBondContact O-NE 2.7Å; D283-R289 PolarHBondContact O-NH2 3.03Å; D283-R289 VanDerWaalsContact O-NH2 3.07Å; D283-R289 IonicContact OD1-CZ 2.75Å; D283-R289 IonicContact OD1-NE 2.78Å; D283-R289 IonicContact OD1-NH2 2.62Å; D283-R289 PolarHBondContact OD1-NH2 2.54Å; D283-R289 IonicContact OD2-NH2 3.43Å; D283-R289 PolarHBondContact OD2-NH2 3.26Å; D283-R289 VanDerWaalsContact OD2-NH2 3.07Å
284	A	47.3	Very low	59.3	Low	58 Å²	58	88 Å²	88	48%	0.479	47%	0.471	S	S	.	.	G	3₁₀ helix	trans	-51.3	-39.5	-179.5	0	0	0	0	0	114.1	D282 R289	D282-A284 PolarHBondContact O-N 2.7Å; D282-A284 VanDerWaalsContact O-N 3.1Å; A284-R289 PolarHBondContact O-NH1 2.76Å
285	F	56.8	Low	61.8	Low	160 Å²	160	90.3 Å²	90.3	70%	0.702	46%	0.463	S	S	*	.	G	3₁₀ helix	trans	-125.9	32.1	-173.5	-66.5	-80.4	0	0	0	113.6	D282 D283 I287	D282-F285 PolarHBondContact O-N 2.69Å; D283-F285 VanDerWaalsContact C-N 3.25Å; D283-F285 PolarHBondContact O-N 3.08Å; D283-F285 VanDerWaalsContact O-N 3.13Å; F285-I287 PolarHBondContact O-N 2.87Å
286	S	82.1	Confident	64.1	Low	11 Å²	11	90.7 Å²	90.7	8%	0.077	45%	0.454	C	S	.	.			trans	-54.1	125.4	171.5	151.6	0	0	0	0	111.8	D283 E288 R289 E290	D283-S286 PolarHBondContact O-N 2.78Å; S286-E288 PolarHBondContact O-N 3.34Å; S286-E288 WeakPolarHBondContact OG-CB 3.09Å; S286-E288 PolarHBondContact OG-N 3.07Å; S286-E288 PolarHBondContact OG-OE2 2.83Å; S286-R289 WeakPolarHBondContact O-CA 3.33Å; S286-R289 WeakPolarHBondContact O-CB 3.39Å; S286-R289 PolarHBondContact O-N 2.91Å; S286-R289 PolarHBondContact OG-N 2.99Å; S286-E290 PolarHBondContact O-N 2.8Å
287	I	85.2	Confident	66.5	Low	5 Å²	5	84.7 Å²	84.7	3%	0.026	42%	0.422	C	S	.	.	H	α-helix	trans	-53.7	-38.6	173.6	-58.3	175.3	0	0	0	110.4	F285 R289 E290 A291 F537 R550 W553 H554 P567	F285-I287 PolarHBondContact O-N 2.87Å; I287-R289 VanDerWaalsContact C-N 3.3Å; I287-R289 PolarHBondContact O-N 3.47Å; I287-E290 PolarHBondContact O-N 2.96Å; I287-A291 WeakPolarHBondContact O-CB 3.49Å; I287-A291 PolarHBondContact O-N 3.12Å; I287-F537 HydrophobicContact CB-CE1 4.18Å; I287-F537 HydrophobicContact CB-CZ 4.22Å; I287-F537 HydrophobicContact CD1-CD2 4.38Å; I287-F537 HydrophobicContact CD1-CE2 4.2Å; I287-F537 HydrophobicContact CG2-CB 4.49Å; I287-F537 HydrophobicContact CG2-CD1 3.46Å; I287-F537 VanDerWaalsContact CG2-CD1 3.46Å; I287-F537 HydrophobicContact CG2-CD2 4.09Å; I287-F537 HydrophobicContact CG2-CE1 3.57Å; I287-F537 HydrophobicContact CG2-CE2 4.18Å; I287-F537 HydrophobicContact CG2-CG 3.74Å; I287-F537 HydrophobicContact CG2-CZ 3.95Å; I287-R550 HydrophobicContact CD1-CG 4.07Å; I287-W553 HydrophobicContact CD1-CB 3.82Å; I287-W553 HydrophobicContact CD1-CG 3.67Å; I287-W553 HydrophobicContact CG1-CG 4.45Å; I287-H554 WeakPolarHBondContact CD1-NE2 3.17Å; I287-P567 HydrophobicContact CG2-CB 3.5Å; I287-P567 VanDerWaalsContact CG2-CB 3.5Å; I287-P567 HydrophobicContact CG2-CG 3.6Å; I287-P567 WeakPolarHBondContact O-CG 3.29Å
288	E	86.8	Confident	68.8	Low	49 Å²	49	78.6 Å²	78.6	23%	0.229	40%	0.395	C	S	.	.	H	α-helix	trans	-66	-31.3	177.5	-51.9	76.1	-169.8	0	0	111.9	S286 R292 F537 R550 M569	S286-E288 PolarHBondContact O-N 3.34Å; S286-E288 WeakPolarHBondContact OG-CB 3.09Å; S286-E288 PolarHBondContact OG-N 3.07Å; S286-E288 PolarHBondContact OG-OE2 2.83Å; E288-R292 WeakPolarHBondContact O-CB 3.39Å; E288-R292 VanDerWaalsContact O-CG 3.26Å; E288-R292 WeakPolarHBondContact O-CG 3.49Å; E288-R292 PolarHBondContact O-N 2.69Å; E288-R292 VanDerWaalsContact O-N 3.08Å; E288-R292 PolarHBondContact O-NE 3.3Å; E288-F537 HydrophobicContact CG-CE1 4.14Å; E288-F537 HydrophobicContact CG-CZ 4.2Å; E288-F537 WeakPolarHBondContact OE1-CZ 3.47Å; E288-R550 IonicContact OE1-CZ 2.94Å; E288-R550 IonicContact OE1-NH1 3.5Å; E288-R550 PolarHBondContact OE1-NH1 2.94Å; E288-R550 IonicContact OE2-NH1 3.96Å; E288-R550 PolarHBondContact OE2-NH1 3.17Å; E288-M569 HydrophobicContact CB-CE 4.28Å; E288-M569 HydrophobicContact CG-CE 4.43Å
289	R	85.7	Confident	70.9	Confident	93 Å²	93	76.4 Å²	76.4	35%	0.351	40%	0.396	S	S	.	.	H	α-helix	trans	-65.8	-47.5	173.2	-175.7	-174.5	-73.1	-151.2	-9.2	110.3	D283 A284 S286 I287 R292 L293	D283-R289 PolarHBondContact O-NE 2.7Å; D283-R289 PolarHBondContact O-NH2 3.03Å; D283-R289 VanDerWaalsContact O-NH2 3.07Å; D283-R289 IonicContact OD1-CZ 2.75Å; D283-R289 IonicContact OD1-NE 2.78Å; D283-R289 IonicContact OD1-NH2 2.62Å; D283-R289 PolarHBondContact OD1-NH2 2.54Å; D283-R289 IonicContact OD2-NH2 3.43Å; D283-R289 PolarHBondContact OD2-NH2 3.26Å; D283-R289 VanDerWaalsContact OD2-NH2 3.07Å; A284-R289 PolarHBondContact O-NH1 2.76Å; S286-R289 WeakPolarHBondContact O-CA 3.33Å; S286-R289 WeakPolarHBondContact O-CB 3.39Å; S286-R289 PolarHBondContact O-N 2.91Å; S286-R289 PolarHBondContact OG-N 2.99Å; I287-R289 VanDerWaalsContact C-N 3.3Å; I287-R289 PolarHBondContact O-N 3.47Å; R289-R292 VanDerWaalsContact N-NH2 3.2Å; R289-R292 WeakPolarHBondContact O-CB 3.08Å; R289-R292 PolarHBondContact O-N 2.83Å; R289-L293 WeakPolarHBondContact O-CG 2.99Å; R289-L293 PolarHBondContact O-N 3.26Å
290	E	86.7	Confident	73.2	Confident	49 Å²	49	75.4 Å²	75.4	23%	0.229	40%	0.395	C	S	.	.	H	α-helix	trans	-63.1	-44.8	176.3	-60	-158.5	169.9	0	0	112.3	S286 I287 R292 L293 H294 R566 P567	S286-E290 PolarHBondContact O-N 2.8Å; I287-E290 PolarHBondContact O-N 2.96Å; E290-R292 PolarHBondContact O-N 3.07Å; E290-L293 PolarHBondContact O-N 3.4Å; E290-H294 PolarHBondContact O-N 3.24Å; E290-R566 IonicContact OE1-NH1 3.23Å; E290-R566 PolarHBondContact OE1-NH1 3.46Å; E290-R566 WeakPolarHBondContact OE2-CD 3.35Å; E290-R566 IonicContact OE2-CZ 2.66Å; E290-R566 IonicContact OE2-NE 3.17Å; E290-R566 IonicContact OE2-NH1 2.76Å; E290-R566 PolarHBondContact OE2-NH1 3.16Å; E290-P567 HydrophobicContact CB-CG 3.75Å; E290-P567 WeakPolarHBondContact OE2-CD 3.36Å
291	A	85.4	Confident	75.7	Confident	2 Å²	2	70.9 Å²	70.9	2%	0.017	38%	0.376	C	S	.	.	H	α-helix	trans	-65.9	-19.3	177.1	0	0	0	0	0	113.8	I287 R295 P567 M569	I287-A291 WeakPolarHBondContact O-CB 3.49Å; I287-A291 PolarHBondContact O-N 3.12Å; A291-R295 PolarHBondContact O-NE 2.83Å; A291-P567 VanDerWaalsContact CA-O 3.29Å; A291-P567 WeakPolarHBondContact CA-O 3.11Å; A291-P567 HydrophobicContact CB-CB 4.39Å; A291-P567 HydrophobicContact CB-CG 4.22Å; A291-P567 VanDerWaalsContact CB-O 3.29Å; A291-P567 WeakPolarHBondContact CB-O 3.48Å; A291-M569 HydrophobicContact CB-CB 3.76Å; A291-M569 HydrophobicContact CB-CE 4.44Å
292	R	84.3	Confident	78.1	Confident	124 Å²	124	73.2 Å²	73.2	47%	0.468	38%	0.376	S	S	.	.	H	α-helix	trans	-79.7	-43.4	168.4	-79.2	171.4	-72.6	-170.2	0.8	111.4	E288 R289 E290 H294 R295	E288-R292 WeakPolarHBondContact O-CB 3.39Å; E288-R292 VanDerWaalsContact O-CG 3.26Å; E288-R292 WeakPolarHBondContact O-CG 3.49Å; E288-R292 PolarHBondContact O-N 2.69Å; E288-R292 VanDerWaalsContact O-N 3.08Å; E288-R292 PolarHBondContact O-NE 3.3Å; R289-R292 VanDerWaalsContact N-NH2 3.2Å; R289-R292 WeakPolarHBondContact O-CB 3.08Å; R289-R292 PolarHBondContact O-N 2.83Å; E290-R292 PolarHBondContact O-N 3.07Å; R292-H294 VanDerWaalsContact C-N 3.35Å; R292-H294 PolarHBondContact O-N 3Å; R292-R295 WeakPolarHBondContact O-CB 3.21Å; R292-R295 PolarHBondContact O-N 2.93Å
293	L	84.5	Confident	80.3	Confident	113 Å²	113	69.9 Å²	69.9	59%	0.592	36%	0.362	S	S	*	.	H	α-helix	trans	-63	-37.5	177.6	-69.4	170.9	0	0	0	112.5	R289 E290 R295 Q296	R289-L293 WeakPolarHBondContact O-CG 2.99Å; R289-L293 PolarHBondContact O-N 3.26Å; E290-L293 PolarHBondContact O-N 3.4Å; L293-R295 PolarHBondContact O-N 3.15Å; L293-Q296 PolarHBondContact O-N 3.22Å
294	H	86.5	Confident	82.3	Confident	29 Å²	29	70.1 Å²	70.1	13%	0.134	37%	0.366	C	S	.	.	G	3₁₀ helix	trans	-57.2	-24.3	176.6	-171.8	82.5	0	0	0	113.6	E290 R292 Q296 A297 Q517 D519 L568	E290-H294 PolarHBondContact O-N 3.24Å; R292-H294 VanDerWaalsContact C-N 3.35Å; R292-H294 PolarHBondContact O-N 3Å; H294-Q296 PolarHBondContact O-N 3.35Å; H294-A297 WeakPolarHBondContact O-CB 3.43Å; H294-A297 PolarHBondContact O-N 3.35Å; H294-A297 VanDerWaalsContact O-N 3.17Å; H294-Q517 PolarHBondContact CD2-NE2 3.02Å; H294-Q517 VanDerWaalsContact CD2-NE2 3.26Å; H294-Q517 PolarHBondContact NE2-NE2 3.2Å; H294-Q517 VanDerWaalsContact NE2-NE2 3.17Å; H294-Q517 PolarHBondContact O-NE2 3.37Å; H294-Q517 PolarHBondContact O-OE1 2.88Å; H294-D519 IonicContact CD2-OD2 3.32Å; H294-D519 PolarHBondContact CD2-OD2 3.41Å; H294-D519 IonicContact CE1-OD1 3.68Å; H294-D519 VanDerWaalsContact NE2-CG 3.32Å; H294-D519 IonicContact NE2-OD1 2.65Å; H294-D519 PolarHBondContact NE2-OD1 2.91Å; H294-D519 IonicContact NE2-OD2 3.17Å; H294-D519 PolarHBondContact NE2-OD2 3.45Å; H294-L568 WeakPolarHBondContact CD2-CD2 3.35Å; H294-L568 WeakPolarHBondContact NE2-CD2 3.44Å
295	R	83.8	Confident	84.5	Confident	100 Å²	100	70.6 Å²	70.6	38%	0.377	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-69.8	-15.4	177.4	-55.7	173.2	-172.6	179	-6.6	113.5	A291 R292 L293 N571	A291-R295 PolarHBondContact O-NE 2.83Å; R292-R295 WeakPolarHBondContact O-CB 3.21Å; R292-R295 PolarHBondContact O-N 2.93Å; L293-R295 PolarHBondContact O-N 3.15Å; R295-N571 PolarHBondContact NE-OD1 3.45Å; R295-N571 PolarHBondContact NH1-OD1 3.01Å; R295-N571 PolarHBondContact NH2-OD1 3.22Å
296	Q	82	Confident	86.5	Confident	115 Å²	115	66.4 Å²	66.4	54%	0.537	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-106.4	3.4	176.4	-58.4	-175.9	12.8	0	0	112	L293 H294 A298 A299	L293-Q296 PolarHBondContact O-N 3.22Å; H294-Q296 PolarHBondContact O-N 3.35Å; Q296-A298 PolarHBondContact O-N 3.35Å; Q296-A299 WeakPolarHBondContact O-CB 3.47Å; Q296-A299 PolarHBondContact O-N 2.8Å
297	A	84.2	Confident	87.2	Confident	7 Å²	7	67.1 Å²	67.1	6%	0.058	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-58.4	-33.6	-173.1	0	0	0	0	0	113.2	H294 A299 V300 N301 F504	H294-A297 WeakPolarHBondContact O-CB 3.43Å; H294-A297 PolarHBondContact O-N 3.35Å; H294-A297 VanDerWaalsContact O-N 3.17Å; A297-A299 PolarHBondContact O-N 2.6Å; A297-V300 PolarHBondContact O-N 2.87Å; A297-N301 WeakPolarHBondContact CB-ND2 3.35Å; A297-N301 WeakPolarHBondContact O-CB 3.29Å; A297-N301 PolarHBondContact O-N 2.85Å; A297-N301 PolarHBondContact O-ND2 2.95Å; A297-F504 HydrophobicContact CB-CE1 3.93Å; A297-F504 HydrophobicContact CB-CZ 3.65Å
298	A	81.8	Confident	87.8	Confident	15 Å²	15	71.2 Å²	71.2	12%	0.124	38%	0.375	C	S	.	.	G	3₁₀ helix	trans	-52.3	-23.6	173.5	0	0	0	0	0	115.3	Q296 A448 Q517	Q296-A298 PolarHBondContact O-N 3.35Å; A298-A448 HydrophobicContact CB-CB 4.12Å; A298-Q517 HydrophobicContact CB-CB 3.96Å; A298-Q517 VanDerWaalsContact N-OE1 3.08Å
299	A	82.1	Confident	88.1	Confident	87 Å²	87	70.3 Å²	70.3	72%	0.719	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-89	-12.9	-178.7	0	0	0	0	0	114.1	Q296 A297	Q296-A299 WeakPolarHBondContact O-CB 3.47Å; Q296-A299 PolarHBondContact O-N 2.8Å; A297-A299 PolarHBondContact O-N 2.6Å
300	V	83.7	Confident	88.4	Confident	122 Å²	122	73.8 Å²	73.8	74%	0.739	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.5	-12.7	-171.3	-60.9	0	0	0	0	114.7	A297	A297-V300 PolarHBondContact O-N 2.87Å
301	N	87.8	Confident	88.6	Confident	68 Å²	68	73.2 Å²	73.2	36%	0.364	40%	0.398	S	S	.	.	S	Bend	trans	-94.6	157.6	175.4	-72.4	-98.7	0	0	0	111.1	A297 F504 K515	A297-N301 WeakPolarHBondContact CB-ND2 3.35Å; A297-N301 WeakPolarHBondContact O-CB 3.29Å; A297-N301 PolarHBondContact O-N 2.85Å; A297-N301 PolarHBondContact O-ND2 2.95Å; N301-F504 HydrophobicContact CB-CD1 4.45Å; N301-F504 HydrophobicContact CB-CD2 3.64Å; N301-F504 HydrophobicContact CB-CE1 4.23Å; N301-F504 HydrophobicContact CB-CE2 3.37Å; N301-F504 HydrophobicContact CB-CG 4.19Å; N301-F504 HydrophobicContact CB-CZ 3.71Å; N301-K515 WeakPolarHBondContact O-CD 3.29Å; N301-K515 WeakPolarHBondContact O-CE 3.29Å; N301-K515 PolarHBondContact O-NZ 2.59Å
302	E	89.5	Confident	88.7	Confident	146 Å²	146	74.7 Å²	74.7	68%	0.682	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-88.3	153.4	173.5	-75.3	-48.3	130.7	0	0	114.5	F504 K515	E302-F504 WeakPolarHBondContact O-CB 3.38Å; E302-K515 IonicContact OE1-NZ 3.25Å; E302-K515 PolarHBondContact OE1-NZ 2.83Å; E302-K515 IonicContact OE2-NZ 3.63Å; E302-K515 PolarHBondContact OE2-NZ 2.82Å
303	A	90.9	Very high	88.6	Confident	25 Å²	25	74.4 Å²	74.4	21%	0.207	42%	0.421	C	S	.	.	P	Polyproline II helix	trans	-83.5	121.7	-178.7	0	0	0	0	0	111	F305 F504 E506 K515	A303-F305 VanDerWaalsContact C-N 3.29Å; A303-F504 WeakPolarHBondContact CA-O 3.48Å; A303-E506 HydrophobicContact CB-CB 3.75Å; A303-K515 HydrophobicContact CB-CD 4.33Å; A303-K515 HydrophobicContact CB-CG 4.29Å
304	T	90.9	Very high	88.6	Confident	94 Å²	94	72.5 Å²	72.5	58%	0.577	41%	0.406	S	S	*	.	S	Bend	trans	-74	-24	176.2	-50	0	0	0	0	111.9	A502 F504	T304-A502 WeakPolarHBondContact CB-O 3.31Å; T304-A502 PolarHBondContact OG1-O 3.21Å; T304-F504 PolarHBondContact N-O 3.21Å; T304-F504 VanDerWaalsContact N-O 3.07Å
305	F	94.6	Very high	88.1	Confident	69 Å²	69	77.6 Å²	77.6	30%	0.303	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	146.9	176.1	-70	-96.4	0	0	0	111	A303 L465 A502 V505 E506	A303-F305 VanDerWaalsContact C-N 3.29Å; F305-L465 HydrophobicContact CB-CD2 4.29Å; F305-L465 HydrophobicContact CD1-CD2 4.49Å; F305-A502 HydrophobicContact CD2-CB 3.45Å; F305-A502 VanDerWaalsContact CD2-CB 3.45Å; F305-A502 HydrophobicContact CE2-CB 3.63Å; F305-V505 HydrophobicContact CB-CG2 4.34Å; F305-V505 WeakPolarHBondContact O-CA 3.47Å; F305-E506 PolarHBondContact O-N 2.74Å
306	T	97.4	Very high	87.8	Confident	71 Å²	71	74.5 Å²	74.5	44%	0.436	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	133.9	169.7	-58.7	0	0	0	0	109.1	E506 K508	T306-E506 CarbonylContact C-O 3.6Å; T306-E506 WeakPolarHBondContact CA-O 3.49Å; T306-E506 HydrophobicContact CG2-CB 4.42Å; T306-K508 HydrophobicContact CG2-CD 3.85Å; T306-K508 HydrophobicContact CG2-CG 4.47Å
307	W	98	Very high	87.7	Confident	26 Å²	26	77.3 Å²	77.3	10%	0.098	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	138.1	163.1	-179.7	102.4	0	0	0	108.6	G309 L311 I461 D464 L465 E506 I507 K508 T509	W307-G309 VanDerWaalsContact CZ3-N 3.34Å; W307-L311 HydrophobicContact CH2-CD2 4.07Å; W307-L311 HydrophobicContact CZ3-CD2 4.14Å; W307-I461 HydrophobicContact CB-CG2 4.03Å; W307-I461 HydrophobicContact CD2-CB 4.37Å; W307-I461 HydrophobicContact CD2-CG1 3.75Å; W307-I461 HydrophobicContact CD2-CG2 4.16Å; W307-I461 HydrophobicContact CE3-CD1 4.29Å; W307-I461 HydrophobicContact CE3-CG1 3.95Å; W307-I461 HydrophobicContact CG-CB 4.42Å; W307-I461 HydrophobicContact CG-CG1 4.31Å; W307-I461 HydrophobicContact CG-CG2 3.87Å; W307-I461 HydrophobicContact CH2-CD1 4.49Å; W307-I461 HydrophobicContact CH2-CG1 4.02Å; W307-I461 HydrophobicContact CZ2-CG1 3.82Å; W307-I461 HydrophobicContact CZ3-CD1 4.26Å; W307-I461 HydrophobicContact CZ3-CG1 4.08Å; W307-D464 PolarHBondContact NE1-OD2 3.01Å; W307-L465 HydrophobicContact CB-CD1 4.06Å; W307-L465 HydrophobicContact CB-CD2 4.17Å; W307-L465 HydrophobicContact CB-CG 4.18Å; W307-E506 PolarHBondContact N-O 2.73Å; W307-I507 HydrophobicContact CE3-CG2 4.08Å; W307-I507 HydrophobicContact CZ3-CG2 4.37Å; W307-K508 PolarHBondContact O-N 3.08Å; W307-T509 HydrophobicContact CZ3-CG2 4.19Å
308	S	97.4	Very high	87.6	Confident	92 Å²	92	84.3 Å²	84.3	64%	0.643	47%	0.472	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.8	121.4	-179.3	57.9	0	0	0	0	111.1	K508	S308-K508 WeakPolarHBondContact CA-O 3.46Å
309	G	93.7	Very high	88	Confident	29 Å²	29	84.8 Å²	84.8	30%	0.299	47%	0.474	S	S	.	.	S	Bend	trans	179.1	-178.6	-178.2	0	0	0	0	0	114.2	W307 K508 T509	W307-G309 VanDerWaalsContact CZ3-N 3.34Å; G309-K508 PolarHBondContact N-O 3.12Å; G309-T509 WeakPolarHBondContact O-CA 3.46Å
310	Q	91.7	Very high	88.6	Confident	166 Å²	166	85.4 Å²	85.4	78%	0.776	46%	0.464	S	S	*	.	P	Polyproline II helix	trans	-87.3	141	168.9	-174.3	170.9	-7.4	0	0	109.2
311	L	90.1	Very high	89.2	Confident	38 Å²	38	80.4 Å²	80.4	20%	0.199	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-73	151	176.2	-57.7	-171.7	0	0	0	110.9	W307 L453 A457 I461 T509 F512	W307-L311 HydrophobicContact CH2-CD2 4.07Å; W307-L311 HydrophobicContact CZ3-CD2 4.14Å; L311-L453 HydrophobicContact CD1-CD2 4Å; L311-L453 HydrophobicContact CD2-CD2 4.02Å; L311-A457 HydrophobicContact CB-CB 4.43Å; L311-A457 HydrophobicContact CD1-CB 4.38Å; L311-A457 HydrophobicContact CD2-CB 4.24Å; L311-I461 HydrophobicContact CD2-CD1 3.99Å; L311-T509 HydrophobicContact CD2-CG2 3.69Å; L311-T509 HydrophobicContact CG-CG2 3.94Å; L311-F512 HydrophobicContact CD1-CE1 4.01Å; L311-F512 HydrophobicContact CD1-CZ 4.35Å
312	P	87.9	Confident	89.6	Confident	32 Å²	32	77.2 Å²	77.2	21%	0.208	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-53.1	137.4	172.7	-27.1	35.4	0	0	0	112.8	R314 E456	P312-R314 PolarHBondContact O-N 3.18Å; P312-E456 HydrophobicContact CB-CG 4.34Å
313	P	83.1	Confident	90	Very high	118 Å²	118	71.7 Å²	71.7	77%	0.766	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-70.6	128	179.9	28.5	-34.1	0	0	0	111.3	N315	P313-N315 PolarHBondContact O-N 3.25Å
314	R	82.8	Confident	90.4	Very high	73 Å²	73	71.2 Å²	71.2	28%	0.275	39%	0.386	S	S	.	.			trans	-77.4	86.7	-171.5	-61.6	-163.7	-169.5	-173	8.1	113.5	P312 N316 D427 M452	P312-R314 PolarHBondContact O-N 3.18Å; R314-N316 PolarHBondContact O-N 3.34Å; R314-N316 VanDerWaalsContact O-N 3.13Å; R314-D427 WeakPolarHBondContact CD-OD2 3.13Å; R314-D427 IonicContact CZ-OD2 2.65Å; R314-D427 IonicContact NE-OD2 3.65Å; R314-D427 IonicContact NH1-OD2 2.86Å; R314-D427 PolarHBondContact NH1-OD2 2.79Å; R314-M452 PolarHBondContact NH2-O 2.66Å
315	N	76.3	Confident	90.6	Very high	136 Å²	136	66.8 Å²	66.8	73%	0.727	36%	0.358	S	S	*	.			trans	-82.7	82.3	175.9	-169.8	-2.2	0	0	0	112.8	P313	P313-N315 PolarHBondContact O-N 3.25Å
316	N	79	Confident	90.7	Very high	35 Å²	35	65.4 Å²	65.4	19%	0.187	35%	0.352	C	S	.	.			trans	-104.4	107.6	174.4	-78.4	-84.2	0	0	0	110.7	R314 S426 D427	R314-N316 PolarHBondContact O-N 3.34Å; R314-N316 VanDerWaalsContact O-N 3.13Å; N316-S426 PolarHBondContact OD1-OG 2.83Å; N316-D427 PolarHBondContact ND2-OD1 2.7Å
317	K	78.3	Confident	90.6	Very high	174 Å²	174	62 Å²	62	76%	0.757	33%	0.332	S	S	*	.	S	Bend	trans	-76.5	141	167.1	-60.3	-177.7	-178.5	-177.8	0	109.8
318	D	82.4	Confident	90.3	Very high	155 Å²	155	61.3 Å²	61.3	83%	0.829	33%	0.332	S	S	*	.	S	Bend	trans	41	59.7	177.3	-57.3	-48.6	0	0	0	114.9	I320	D318-I320 PolarHBondContact O-N 3Å
319	P	90.1	Very high	90	Very high	25 Å²	25	58.5 Å²	58.5	16%	0.162	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-59.8	137.2	-172	23.6	-34.3	0	0	0	113.5	Y321 R385 V424	P319-Y321 HydrophobicContact CB-CE1 4.16Å; P319-Y321 HydrophobicContact CB-CE2 4.16Å; P319-Y321 HydrophobicContact CG-CE1 4.43Å; P319-Y321 HydrophobicContact CG-CE2 4Å; P319-Y321 VanDerWaalsContact CG-OH 3.3Å; P319-Y321 WeakPolarHBondContact CG-OH 3.38Å; P319-R385 PolarHBondContact O-NH2 3.28Å; P319-V424 HydrophobicContact CB-CG1 3.6Å; P319-V424 HydrophobicContact CB-CG2 4.18Å
320	I	94.7	Very high	90	Very high	100 Å²	100	57.2 Å²	57.2	51%	0.513	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-103.1	121.1	167	-49.9	177	0	0	0	107.6	D318 E381 V424 I425	D318-I320 PolarHBondContact O-N 3Å; I320-E381 HydrophobicContact CG2-CG 4.17Å; I320-V424 WeakPolarHBondContact O-CG1 3.23Å; I320-I425 HydrophobicContact CG2-CD1 4.16Å; I320-I425 PolarHBondContact O-N 3.13Å
321	Y	96.3	Very high	89.9	Confident	16 Å²	16	49.4 Å²	49.4	6%	0.063	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	159.1	-173.4	-63	-75.4	0	0	0	113	P319 E381 V384 R385 L388 P422 W423 V424 I425	P319-Y321 HydrophobicContact CB-CE1 4.16Å; P319-Y321 HydrophobicContact CB-CE2 4.16Å; P319-Y321 HydrophobicContact CG-CE1 4.43Å; P319-Y321 HydrophobicContact CG-CE2 4Å; P319-Y321 VanDerWaalsContact CG-OH 3.3Å; P319-Y321 WeakPolarHBondContact CG-OH 3.38Å; Y321-E381 PolarHBondContact N-OE1 2.66Å; Y321-E381 WeakPolarHBondContact O-CG 3.14Å; Y321-V384 HydrophobicContact CD2-CG1 4.42Å; Y321-V384 HydrophobicContact CG-CG1 4.11Å; Y321-R385 HydrophobicContact CD2-CG 3.98Å; Y321-R385 HydrophobicContact CE2-CG 4.08Å; Y321-L388 HydrophobicContact CD1-CD1 4.3Å; Y321-L388 HydrophobicContact CD2-CD1 4.13Å; Y321-L388 HydrophobicContact CE1-CD1 3.89Å; Y321-L388 HydrophobicContact CE2-CD1 3.71Å; Y321-L388 HydrophobicContact CG-CD1 4.39Å; Y321-P422 HydrophobicContact CD1-CB 3.68Å; Y321-P422 HydrophobicContact CD1-CG 4.2Å; Y321-P422 HydrophobicContact CE1-CB 3.9Å; Y321-P422 HydrophobicContact CE1-CG 3.9Å; Y321-P422 HydrophobicContact CG-CB 4.48Å; Y321-W423 CarbonylContact C-O 3.54Å; Y321-W423 VanDerWaalsContact CA-O 3.24Å; Y321-W423 WeakPolarHBondContact CA-O 3.33Å; Y321-V424 HydrophobicContact CD1-CG2 4.06Å; Y321-V424 HydrophobicContact CE1-CG2 3.82Å; Y321-I425 VanDerWaalsContact O-CD1 3.23Å; Y321-I425 WeakPolarHBondContact O-CD1 3.48Å
322	S	97.4	Very high	89.7	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.007	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	146.3	158.8	177	0	0	0	0	109.2	K324 W423 H479	S322-K324 PolarHBondContact O-N 3.48Å; S322-K324 PolarHBondContact OG-N 2.78Å; S322-K324 VanDerWaalsContact OG-N 3.11Å; S322-W423 PolarHBondContact N-O 2.65Å; S322-H479 WeakPolarHBondContact CB-O 3.39Å; S322-H479 PolarHBondContact OG-O 3.01Å
323	C	97.8	Very high	89.7	Confident	31 Å²	31	53 Å²	53	21%	0.209	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	-14.8	170.6	-55.1	0	0	0	0	112.8	F378 E381	C323-F378 VanDerWaalsContact CB-O 3.23Å; C323-F378 WeakPolarHBondContact CB-O 3.31Å; C323-F378 PolarHBondContact O-N 3.27Å; C323-E381 PolarHBondContact SG-N 2.98Å
324	K	97.5	Very high	90	Very high	15 Å²	15	48.4 Å²	48.4	7%	0.065	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	136.4	171.2	177.6	173.1	-75.1	178.3	0	110.1	S322 E352 Y375 L376 V377 D477 H479 Y481	S322-K324 PolarHBondContact O-N 3.48Å; S322-K324 PolarHBondContact OG-N 2.78Å; S322-K324 VanDerWaalsContact OG-N 3.11Å; K324-E352 WeakPolarHBondContact CE-OE2 3.44Å; K324-E352 IonicContact NZ-OE1 3.92Å; K324-E352 PolarHBondContact NZ-OE1 2.98Å; K324-E352 IonicContact NZ-OE2 3.67Å; K324-E352 PolarHBondContact NZ-OE2 3.49Å; K324-Y375 HydrophobicContact CD-CD1 4.09Å; K324-Y375 HydrophobicContact CD-CG 4.33Å; K324-Y375 HydrophobicContact CG-CD1 4.08Å; K324-Y375 HydrophobicContact CG-CG 4.48Å; K324-L376 CarbonylContact C-O 3.41Å; K324-L376 VanDerWaalsContact CA-O 3.29Å; K324-L376 WeakPolarHBondContact CA-O 3.2Å; K324-V377 HydrophobicContact CB-CG2 4.14Å; K324-V377 HydrophobicContact CD-CG2 4.3Å; K324-V377 HydrophobicContact CG-CG2 4.04Å; K324-D477 WeakPolarHBondContact CE-OD2 3.19Å; K324-D477 IonicContact NZ-OD2 2.73Å; K324-D477 PolarHBondContact NZ-OD2 3.33Å; K324-H479 HydrophobicContact CB-CB 4.06Å; K324-Y481 HydrophobicContact CB-CD2 3.69Å; K324-Y481 HydrophobicContact CB-CE2 4.49Å; K324-Y481 HydrophobicContact CB-CG 3.94Å; K324-Y481 HydrophobicContact CD-CD1 3.87Å; K324-Y481 HydrophobicContact CD-CD2 4.13Å; K324-Y481 HydrophobicContact CD-CG 3.63Å; K324-Y481 HydrophobicContact CG-CD1 4.25Å; K324-Y481 HydrophobicContact CG-CD2 3.66Å; K324-Y481 HydrophobicContact CG-CE2 4.15Å; K324-Y481 HydrophobicContact CG-CG 3.72Å; K324-Y481 WeakPolarHBondContact O-CD2 3.42Å; K324-Y481 VanDerWaalsContact O-CE2 3.28Å; K324-Y481 WeakPolarHBondContact O-CE2 3.27Å
325	V	96.6	Very high	90.4	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	135.5	-177.2	-177.4	0	0	0	0	108.8	Y375 L376 V384 V420	V325-Y375 CarbonylContact O-C 3.56Å; V325-Y375 WeakPolarHBondContact O-CA 3.41Å; V325-L376 PolarHBondContact N-O 2.94Å; V325-L376 PolarHBondContact O-N 3.22Å; V325-V384 HydrophobicContact CG2-CB 4.3Å; V325-V384 HydrophobicContact CG2-CG1 3.66Å; V325-V384 HydrophobicContact CG2-CG2 3.67Å; V325-V420 HydrophobicContact CG1-CG1 3.61Å
326	F	95.8	Very high	91.1	Very high	41 Å²	41	45 Å²	45	18%	0.18	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	133.1	173	171.8	-84.4	0	0	0	110.4	G328 Y373 Y375 I421 Y481	F326-G328 VanDerWaalsContact CE1-CA 3.49Å; F326-Y373 AromaticContact CE2-CD2 3.66Å; F326-Y373 HydrophobicContact CE2-CD2 3.66Å; F326-Y373 AromaticContact CE2-CG 3.98Å; F326-Y373 HydrophobicContact CE2-CG 3.98Å; F326-Y373 HydrophobicContact CZ-CD2 4.32Å; F326-Y373 HydrophobicContact CZ-CG 4.19Å; F326-Y375 HydrophobicContact CB-CD1 4.03Å; F326-Y375 HydrophobicContact CB-CE1 3.9Å; F326-Y375 HydrophobicContact CD2-CD1 4.32Å; F326-Y375 AromaticContact CD2-CE1 3.72Å; F326-Y375 HydrophobicContact CD2-CE1 3.72Å; F326-Y375 AromaticContact CD2-CZ 3.95Å; F326-Y375 HydrophobicContact CG-CE1 4.32Å; F326-I421 HydrophobicContact CB-CB 4.28Å; F326-I421 HydrophobicContact CD1-CB 4.04Å; F326-I421 HydrophobicContact CD1-CD1 3.75Å; F326-I421 HydrophobicContact CD1-CG1 3.95Å; F326-I421 HydrophobicContact CE1-CD1 3.92Å; F326-I421 PolarHBondContact N-O 2.95Å; F326-I421 PolarHBondContact O-N 2.86Å; F326-Y481 VanDerWaalsContact CB-OH 3.31Å; F326-Y481 WeakPolarHBondContact CB-OH 3.44Å
327	L	94.9	Very high	91.8	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	121.2	167	-65	-175.9	0	0	0	109.6	V330 L339 F343 Y373 V374 L376 V418 Q419 V420	L327-V330 HydrophobicContact CB-CG1 3.92Å; L327-V330 HydrophobicContact CD1-CG1 4.32Å; L327-L339 HydrophobicContact CD1-CD2 4.17Å; L327-F343 HydrophobicContact CD1-CD2 4.42Å; L327-F343 HydrophobicContact CD1-CE2 3.6Å; L327-F343 HydrophobicContact CD1-CZ 3.9Å; L327-Y373 CarbonylContact O-C 3.56Å; L327-Y373 WeakPolarHBondContact O-CA 3.48Å; L327-Y373 WeakPolarHBondContact O-CB 3.36Å; L327-V374 HydrophobicContact CB-CG1 3.91Å; L327-V374 HydrophobicContact CD1-CG1 4.07Å; L327-V374 HydrophobicContact CG-CG1 4.42Å; L327-V374 PolarHBondContact N-O 3.43Å; L327-V374 PolarHBondContact O-N 2.91Å; L327-L376 HydrophobicContact CD1-CD1 3.88Å; L327-L376 HydrophobicContact CD1-CD2 3.91Å; L327-L376 HydrophobicContact CD1-CG 3.79Å; L327-L376 HydrophobicContact CG-CD1 4.29Å; L327-L376 HydrophobicContact CG-CG 4.07Å; L327-V418 HydrophobicContact CB-CG1 4.06Å; L327-V418 HydrophobicContact CD2-CG1 4.34Å; L327-Q419 CarbonylContact C-O 3.52Å; L327-Q419 WeakPolarHBondContact CA-O 3.42Å; L327-V420 HydrophobicContact CD2-CB 4.22Å; L327-V420 HydrophobicContact CD2-CG1 4.08Å; L327-V420 HydrophobicContact CD2-CG2 3.75Å
328	G	92.9	Very high	92.5	Very high	10 Å²	10	39.4 Å²	39.4	10%	0.103	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	139.3	176.3	0	0	0	0	0	112.3	F326 V418 Q419	F326-G328 VanDerWaalsContact CE1-CA 3.49Å; G328-V418 CarbonylContact O-C 3.58Å; G328-V418 WeakPolarHBondContact O-CA 3.42Å; G328-V418 WeakPolarHBondContact O-CG1 3.45Å; G328-Q419 PolarHBondContact N-O 3.5Å; G328-Q419 PolarHBondContact O-N 2.87Å
329	G	91.4	Very high	93	Very high	33 Å²	33	32 Å²	32	34%	0.34	19%	0.185	S	C	.	.	S	Bend	trans	81.9	18.9	177.6	0	0	0	0	0	115.3	G372 K416	G329-G372 VanDerWaalsContact CA-O 3.3Å; G329-G372 WeakPolarHBondContact CA-O 3.27Å; G329-G372 PolarHBondContact N-O 3.01Å; G329-K416 WeakPolarHBondContact O-CD 3.45Å; G329-K416 WeakPolarHBondContact O-CE 3.06Å; G329-K416 PolarHBondContact O-NZ 2.97Å
330	V	92.2	Very high	93.3	Very high	3 Å²	3	33.9 Å²	33.9	2%	0.018	19%	0.193	C	C	.	.			trans	-55.2	154.5	-179.7	-66.5	0	0	0	0	113.5	L327 I334 G372 V374 M408 K416 V418	L327-V330 HydrophobicContact CB-CG1 3.92Å; L327-V330 HydrophobicContact CD1-CG1 4.32Å; V330-I334 HydrophobicContact CB-CG2 4.38Å; V330-I334 HydrophobicContact CG2-CG2 4.45Å; V330-G372 PolarHBondContact N-O 3.22Å; V330-V374 HydrophobicContact CG1-CG1 4.03Å; V330-M408 HydrophobicContact CG1-SD 4.28Å; V330-K416 PolarHBondContact O-NZ 3.08Å; V330-V418 HydrophobicContact CG1-CG1 3.75Å; V330-V418 HydrophobicContact CG1-CG2 4.48Å
331	P	90.6	Very high	93.3	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.006	20%	0.202	C	C	.	.			trans	-60.7	137.2	172.6	-22.6	33.5	0	0	0	111.8	D333 I334 M408 S410 M413 K416	P331-D333 PolarHBondContact O-N 3.35Å; P331-I334 HydrophobicContact CB-CB 4.34Å; P331-I334 WeakPolarHBondContact O-CB 3.37Å; P331-I334 WeakPolarHBondContact O-CG2 3.3Å; P331-I334 PolarHBondContact O-N 3.03Å; P331-M408 VanDerWaalsContact CD-SD 3.52Å; P331-M408 HydrophobicContact CG-CG 4.03Å; P331-M408 HydrophobicContact CG-SD 4.24Å; P331-S410 WeakPolarHBondContact CB-OG 3.13Å; P331-M413 HydrophobicContact CB-CB 4.14Å; P331-M413 HydrophobicContact CB-CG 4.24Å; P331-M413 HydrophobicContact CB-SD 4Å; P331-K416 HydrophobicContact CG-CB 4.4Å; P331-K416 HydrophobicContact CG-CD 4.07Å
332	W	86.3	Confident	93.3	Very high	127 Å²	127	36.7 Å²	36.7	48%	0.481	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-17.7	-175.1	64.6	-95.7	0	0	0	113.8	A370 R412	W332-A370 HydrophobicContact CB-CB 4.23Å; W332-A370 WeakPolarHBondContact O-CB 3.34Å; W332-R412 VanDerWaalsContact CH2-CD 3.43Å; W332-R412 HydrophobicContact CZ2-CB 4.38Å
333	D	86.6	Confident	93.3	Very high	19 Å²	19	36.7 Å²	36.7	10%	0.102	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.7	9.6	176.4	71	-57.7	0	0	0	113.5	P331 S410 R411 R412	P331-D333 PolarHBondContact O-N 3.35Å; D333-S410 WeakPolarHBondContact OD1-CB 3.33Å; D333-S410 PolarHBondContact OD1-OG 2.85Å; D333-S410 WeakPolarHBondContact OD2-CB 3.28Å; D333-S410 PolarHBondContact OD2-OG 3.47Å; D333-S410 VanDerWaalsContact OD2-OG 3.12Å; D333-R411 WeakPolarHBondContact OD2-CA 3.16Å; D333-R411 PolarHBondContact OD2-N 3.45Å; D333-R412 PolarHBondContact OD2-N 3.35Å
334	I	90.2	Very high	93.2	Very high	22 Å²	22	38 Å²	38	11%	0.113	22%	0.222	C	C	.	.			trans	-68.8	149.7	174.4	-156	64.7	0	0	0	110.9	V330 P331 L339 W353 M408	V330-I334 HydrophobicContact CB-CG2 4.38Å; V330-I334 HydrophobicContact CG2-CG2 4.45Å; P331-I334 HydrophobicContact CB-CB 4.34Å; P331-I334 WeakPolarHBondContact O-CB 3.37Å; P331-I334 WeakPolarHBondContact O-CG2 3.3Å; P331-I334 PolarHBondContact O-N 3.03Å; I334-L339 HydrophobicContact CG1-CD2 4.18Å; I334-L339 HydrophobicContact CG1-CG 3.97Å; I334-L339 HydrophobicContact CG2-CD1 4.4Å; I334-L339 HydrophobicContact CG2-CG 4.43Å; I334-W353 HydrophobicContact CG2-CH2 3.88Å; I334-W353 HydrophobicContact CG2-CZ2 4.38Å; I334-M408 HydrophobicContact CD1-CE 3.6Å; I334-M408 HydrophobicContact CG1-CE 3.73Å
335	T	90.5	Very high	93.1	Very high	64 Å²	64	40.9 Å²	40.9	39%	0.393	26%	0.255	S	S	.	.			trans	-115.5	161.1	175.7	62	0	0	0	0	110.8	A337 G338 L339	T335-A337 VanDerWaalsContact C-N 3.28Å; T335-A337 PolarHBondContact O-N 2.86Å; T335-G338 WeakPolarHBondContact O-CA 3.18Å; T335-G338 PolarHBondContact O-N 2.93Å; T335-G338 PolarHBondContact OG1-N 2.87Å; T335-G338 VanDerWaalsContact OG1-N 3.09Å; T335-L339 PolarHBondContact O-N 3.12Å
336	E	91.9	Very high	93.2	Very high	74 Å²	74	43.8 Å²	43.8	35%	0.346	27%	0.267	S	S	.	.	H	α-helix	trans	-52.2	-45.7	172	-173.2	154.7	147.4	0	0	111.7	G338 L339 I340 V351 W353 K356	E336-G338 PolarHBondContact O-N 2.94Å; E336-L339 PolarHBondContact O-N 3.22Å; E336-I340 HydrophobicContact CG-CD1 4.22Å; E336-I340 VanDerWaalsContact O-CG1 3.31Å; E336-I340 WeakPolarHBondContact O-CG1 3.41Å; E336-I340 PolarHBondContact O-N 3.17Å; E336-V351 HydrophobicContact CG-CB 3.94Å; E336-V351 HydrophobicContact CG-CG1 4.32Å; E336-V351 HydrophobicContact CG-CG2 4.33Å; E336-W353 PolarHBondContact OE2-NE1 2.94Å; E336-K356 IonicContact OE1-NZ 2.8Å; E336-K356 PolarHBondContact OE1-NZ 3.06Å; E336-K356 IonicContact OE2-NZ 2.73Å; E336-K356 PolarHBondContact OE2-NZ 2.85Å
337	A	92.4	Very high	93.2	Very high	70 Å²	70	42.6 Å²	42.6	58%	0.579	27%	0.266	S	S	*	.	H	α-helix	trans	-64.3	-34.4	173.6	0	0	0	0	0	113.6	T335 N341	T335-A337 VanDerWaalsContact C-N 3.28Å; T335-A337 PolarHBondContact O-N 2.86Å; A337-N341 VanDerWaalsContact O-CB 3.29Å; A337-N341 WeakPolarHBondContact O-CB 3.03Å; A337-N341 PolarHBondContact O-N 2.9Å
338	G	93	Very high	93.4	Very high	20 Å²	20	45.7 Å²	45.7	21%	0.206	29%	0.286	C	S	.	.	H	α-helix	trans	-64.9	-45.5	174.7	0	0	0	0	0	112.1	T335 E336 N341 T342	T335-G338 WeakPolarHBondContact O-CA 3.18Å; T335-G338 PolarHBondContact O-N 2.93Å; T335-G338 PolarHBondContact OG1-N 2.87Å; T335-G338 VanDerWaalsContact OG1-N 3.09Å; E336-G338 PolarHBondContact O-N 2.94Å; G338-N341 PolarHBondContact O-N 3.35Å; G338-T342 PolarHBondContact O-N 2.97Å; G338-T342 PolarHBondContact O-OG1 2.74Å; G338-T342 VanDerWaalsContact O-OG1 3.08Å
339	L	94.4	Very high	93.6	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-61	-47.8	174.5	-69.4	164	0	0	0	111.4	L327 I334 T335 E336 N341 T342 F343 V351 W353 V374 M408	L327-L339 HydrophobicContact CD1-CD2 4.17Å; I334-L339 HydrophobicContact CG1-CD2 4.18Å; I334-L339 HydrophobicContact CG1-CG 3.97Å; I334-L339 HydrophobicContact CG2-CD1 4.4Å; I334-L339 HydrophobicContact CG2-CG 4.43Å; T335-L339 PolarHBondContact O-N 3.12Å; E336-L339 PolarHBondContact O-N 3.22Å; L339-N341 VanDerWaalsContact C-N 3.33Å; L339-N341 PolarHBondContact O-N 2.98Å; L339-T342 PolarHBondContact O-N 2.84Å; L339-T342 VanDerWaalsContact O-N 3.13Å; L339-F343 HydrophobicContact CD2-CD2 4.39Å; L339-F343 HydrophobicContact CD2-CE2 3.91Å; L339-F343 WeakPolarHBondContact O-CD2 3.45Å; L339-F343 PolarHBondContact O-N 3Å; L339-V351 HydrophobicContact CB-CG2 4.14Å; L339-V351 HydrophobicContact CD1-CG1 3.73Å; L339-W353 HydrophobicContact CD1-CH2 3.99Å; L339-W353 HydrophobicContact CD1-CZ2 3.53Å; L339-V374 HydrophobicContact CD1-CG1 3.93Å; L339-V374 HydrophobicContact CD1-CG2 4.18Å; L339-V374 HydrophobicContact CD2-CG1 4.39Å; L339-M408 HydrophobicContact CD2-CE 3.86Å; L339-M408 HydrophobicContact CD2-SD 4.5Å
340	I	95.9	Very high	93.9	Very high	64 Å²	64	48.8 Å²	48.8	33%	0.328	30%	0.296	S	S	.	.	H	α-helix	trans	-58.8	-45.3	177.2	-67.5	164.8	0	0	0	110.5	E336 T342 F343 S344 V351	E336-I340 HydrophobicContact CG-CD1 4.22Å; E336-I340 VanDerWaalsContact O-CG1 3.31Å; E336-I340 WeakPolarHBondContact O-CG1 3.41Å; E336-I340 PolarHBondContact O-N 3.17Å; I340-T342 VanDerWaalsContact C-N 3.29Å; I340-T342 PolarHBondContact O-N 3.09Å; I340-F343 PolarHBondContact O-N 3.05Å; I340-S344 WeakPolarHBondContact O-CB 3.3Å; I340-S344 PolarHBondContact O-N 2.81Å; I340-S344 PolarHBondContact O-OG 3.41Å; I340-S344 VanDerWaalsContact O-OG 3.09Å; I340-V351 HydrophobicContact CD1-CG2 4.34Å; I340-V351 HydrophobicContact CG1-CG2 3.79Å
341	N	95	Very high	94	Very high	131 Å²	131	49 Å²	49	70%	0.701	30%	0.297	S	S	*	.	H	α-helix	trans	-66.1	-27.8	177.8	-171.6	93.4	0	0	0	113.5	A337 G338 L339	A337-N341 VanDerWaalsContact O-CB 3.29Å; A337-N341 WeakPolarHBondContact O-CB 3.03Å; A337-N341 PolarHBondContact O-N 2.9Å; G338-N341 PolarHBondContact O-N 3.35Å; L339-N341 VanDerWaalsContact C-N 3.33Å; L339-N341 PolarHBondContact O-N 2.98Å
342	T	95.5	Very high	94.1	Very high	45 Å²	45	52.1 Å²	52.1	28%	0.276	31%	0.312	S	S	.	.	H	α-helix	trans	-77.3	-38.3	174.8	-62.6	0	0	0	0	112.5	G338 L339 I340 F406	G338-T342 PolarHBondContact O-N 2.97Å; G338-T342 PolarHBondContact O-OG1 2.74Å; G338-T342 VanDerWaalsContact O-OG1 3.08Å; L339-T342 PolarHBondContact O-N 2.84Å; L339-T342 VanDerWaalsContact O-N 3.13Å; I340-T342 VanDerWaalsContact C-N 3.29Å; I340-T342 PolarHBondContact O-N 3.09Å; T342-F406 HydrophobicContact CG2-CE1 3.53Å; T342-F406 HydrophobicContact CG2-CZ 3.96Å
343	F	97	Very high	94.2	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-107.8	-10.6	-167.8	-63.4	-64.1	0	0	0	115.4	L327 L339 I340 G345 Y346 L349 L376 F378 L387 F406	L327-F343 HydrophobicContact CD1-CD2 4.42Å; L327-F343 HydrophobicContact CD1-CE2 3.6Å; L327-F343 HydrophobicContact CD1-CZ 3.9Å; L339-F343 HydrophobicContact CD2-CD2 4.39Å; L339-F343 HydrophobicContact CD2-CE2 3.91Å; L339-F343 WeakPolarHBondContact O-CD2 3.45Å; L339-F343 PolarHBondContact O-N 3Å; I340-F343 PolarHBondContact O-N 3.05Å; F343-G345 PolarHBondContact O-N 3.35Å; F343-Y346 HydrophobicContact CB-CD2 4.46Å; F343-Y346 HydrophobicContact CD1-CD2 4.16Å; F343-Y346 AromaticContact CD1-CE2 3.99Å; F343-Y346 HydrophobicContact CD1-CE2 3.99Å; F343-Y346 WeakPolarHBondContact O-CD2 3.34Å; F343-Y346 PolarHBondContact O-N 2.96Å; F343-Y346 VanDerWaalsContact O-N 3.12Å; F343-L349 HydrophobicContact CB-CD1 3.95Å; F343-L349 HydrophobicContact CB-CD2 4.08Å; F343-L376 HydrophobicContact CB-CD1 4.04Å; F343-L376 HydrophobicContact CD1-CD1 4.15Å; F343-L376 HydrophobicContact CD2-CD1 3.57Å; F343-L376 HydrophobicContact CD2-CD2 4.15Å; F343-L376 HydrophobicContact CD2-CG 4.5Å; F343-L376 HydrophobicContact CE2-CD1 4.04Å; F343-L376 HydrophobicContact CG-CD1 3.64Å; F343-F378 HydrophobicContact CB-CZ 4.32Å; F343-L387 HydrophobicContact CD1-CD1 3.77Å; F343-L387 HydrophobicContact CD1-CD2 4.48Å; F343-L387 HydrophobicContact CE1-CD1 3.69Å; F343-F406 AromaticContact CE1-CD1 3.73Å; F343-F406 HydrophobicContact CE1-CD1 3.73Å; F343-F406 HydrophobicContact CE1-CD2 4.28Å; F343-F406 AromaticContact CE1-CE1 3.72Å; F343-F406 HydrophobicContact CE1-CE1 3.72Å; F343-F406 HydrophobicContact CE1-CE2 4.26Å; F343-F406 HydrophobicContact CE1-CG 4.02Å; F343-F406 AromaticContact CE1-CZ 3.98Å; F343-F406 HydrophobicContact CE1-CZ 3.98Å; F343-F406 AromaticContact CZ-CD1 3.8Å; F343-F406 HydrophobicContact CZ-CD1 3.8Å; F343-F406 AromaticContact CZ-CE1 3.96Å; F343-F406 HydrophobicContact CZ-CE1 3.96Å; F343-F406 HydrophobicContact CZ-CG 4.39Å
344	S	96.5	Very high	93.9	Very high	60 Å²	60	48.8 Å²	48.8	42%	0.42	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-61.6	-23.4	178.6	59.5	0	0	0	0	114.2	I340 Y346 G347	I340-S344 WeakPolarHBondContact O-CB 3.3Å; I340-S344 PolarHBondContact O-N 2.81Å; I340-S344 PolarHBondContact O-OG 3.41Å; I340-S344 VanDerWaalsContact O-OG 3.09Å; S344-Y346 PolarHBondContact O-N 3.37Å; S344-G347 CarbonylContact O-C 3.58Å; S344-G347 PolarHBondContact O-N 3.13Å
345	G	96.5	Very high	92.8	Very high	75 Å²	75	49.5 Å²	49.5	77%	0.773	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-62.3	-20.1	174.6	0	0	0	0	0	114.4	F343	F343-G345 PolarHBondContact O-N 3.35Å
346	Y	97.5	Very high	91.2	Very high	60 Å²	60	52.3 Å²	52.3	24%	0.235	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-88.2	-16.3	173.2	-53.8	-67.8	0	0	0	112.7	F343 S344 S383 A386 L387 A390 F406	F343-Y346 HydrophobicContact CB-CD2 4.46Å; F343-Y346 HydrophobicContact CD1-CD2 4.16Å; F343-Y346 AromaticContact CD1-CE2 3.99Å; F343-Y346 HydrophobicContact CD1-CE2 3.99Å; F343-Y346 WeakPolarHBondContact O-CD2 3.34Å; F343-Y346 PolarHBondContact O-N 2.96Å; F343-Y346 VanDerWaalsContact O-N 3.12Å; S344-Y346 PolarHBondContact O-N 3.37Å; Y346-S383 WeakPolarHBondContact O-CA 3.34Å; Y346-S383 WeakPolarHBondContact O-CB 3.1Å; Y346-S383 PolarHBondContact O-OG 3.26Å; Y346-A386 VanDerWaalsContact CD1-C 3.49Å; Y346-A386 HydrophobicContact CD1-CB 3.89Å; Y346-A386 WeakPolarHBondContact CE1-O 3.38Å; Y346-L387 HydrophobicContact CD1-CB 4.43Å; Y346-L387 HydrophobicContact CD2-CB 4.14Å; Y346-L387 HydrophobicContact CD2-CD1 4.08Å; Y346-L387 HydrophobicContact CE2-CD1 3.81Å; Y346-L387 HydrophobicContact CG-CB 4.1Å; Y346-A390 HydrophobicContact CE1-CB 3.7Å; Y346-A390 WeakPolarHBondContact OH-CB 3.18Å; Y346-F406 HydrophobicContact CE2-CE2 4.41Å; Y346-F406 WeakPolarHBondContact OH-CE2 3.38Å
347	G	97	Very high	89.2	Confident	16 Å²	16	54.8 Å²	54.8	17%	0.165	34%	0.335	C	S	.	.	S	Bend	trans	140.3	175.5	179.2	0	0	0	0	0	112.8	S344 L349	S344-G347 CarbonylContact O-C 3.58Å; S344-G347 PolarHBondContact O-N 3.13Å; G347-L349 WeakPolarHBondContact O-CD2 3.33Å
348	P	97.3	Very high	86.9	Confident	65 Å²	65	54 Å²	54	42%	0.422	33%	0.334	S	S	.	.			trans	-60.4	138	179	-22.8	34.3	0	0	0	112.5	F378 E379	P348-F378 WeakPolarHBondContact O-CA 3.42Å; P348-E379 HydrophobicContact CB-CB 4.45Å; P348-E379 VanDerWaalsContact CB-CD 3.46Å; P348-E379 HydrophobicContact CB-CG 3.96Å; P348-E379 PolarHBondContact O-N 2.73Å
349	L	97.8	Very high	84.6	Confident	23 Å²	23	60.6 Å²	60.6	12%	0.12	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	159.8	176.9	72.1	150.1	0	0	0	113	F343 G347 V351 L376 V377 F378	F343-L349 HydrophobicContact CB-CD1 3.95Å; F343-L349 HydrophobicContact CB-CD2 4.08Å; G347-L349 WeakPolarHBondContact O-CD2 3.33Å; L349-V351 HydrophobicContact CD1-CG2 4.39Å; L349-L376 HydrophobicContact CD1-CB 4.07Å; L349-L376 HydrophobicContact CD1-CD1 4.09Å; L349-L376 HydrophobicContact CD1-CD2 3.78Å; L349-L376 HydrophobicContact CD1-CG 4.19Å; L349-V377 CarbonylContact C-O 3.57Å; L349-V377 VanDerWaalsContact CA-O 3.23Å; L349-V377 WeakPolarHBondContact CA-O 3.27Å; L349-F378 HydrophobicContact CB-CD1 3.75Å; L349-F378 HydrophobicContact CB-CE1 4.01Å; L349-F378 HydrophobicContact CB-CG 4.17Å; L349-F378 HydrophobicContact CD1-CE1 4.47Å; L349-F378 HydrophobicContact CD1-CZ 4.5Å; L349-F378 HydrophobicContact CD2-CE1 4.12Å; L349-F378 HydrophobicContact CG-CE1 4.43Å
350	T	96.9	Very high	82.2	Confident	86 Å²	86	63.4 Å²	63.4	53%	0.528	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	166.5	161.6	63.5	0	0	0	0	110.4	V377	T350-V377 PolarHBondContact N-O 3.14Å; T350-V377 PolarHBondContact O-N 3.46Å
351	V	95.2	Very high	79.6	Confident	7 Å²	7	64.9 Å²	64.9	4%	0.042	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	114.7	-174.7	179.8	0	0	0	0	109.6	E336 L339 I340 L349 V374 L376	E336-V351 HydrophobicContact CG-CB 3.94Å; E336-V351 HydrophobicContact CG-CG1 4.32Å; E336-V351 HydrophobicContact CG-CG2 4.33Å; L339-V351 HydrophobicContact CB-CG2 4.14Å; L339-V351 HydrophobicContact CD1-CG1 3.73Å; I340-V351 HydrophobicContact CD1-CG2 4.34Å; I340-V351 HydrophobicContact CG1-CG2 3.79Å; L349-V351 HydrophobicContact CD1-CG2 4.39Å; V351-V374 HydrophobicContact CG1-CG2 3.45Å; V351-V374 VanDerWaalsContact CG1-CG2 3.45Å; V351-L376 HydrophobicContact CG2-CD2 4.25Å
352	E	93.1	Very high	77.3	Confident	67 Å²	67	66.7 Å²	66.7	31%	0.313	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	109.7	178.5	-73.9	-177.8	-161.9	0	0	110.2	K324 V374 Y375 V377 H479	K324-E352 WeakPolarHBondContact CE-OE2 3.44Å; K324-E352 IonicContact NZ-OE1 3.92Å; K324-E352 PolarHBondContact NZ-OE1 2.98Å; K324-E352 IonicContact NZ-OE2 3.67Å; K324-E352 PolarHBondContact NZ-OE2 3.49Å; E352-V374 WeakPolarHBondContact O-CG2 3.37Å; E352-Y375 PolarHBondContact N-O 2.92Å; E352-Y375 PolarHBondContact O-N 3.35Å; E352-V377 HydrophobicContact CG-CG2 4.14Å; E352-H479 IonicContact OE1-CE1 3Å
353	W	88.1	Confident	74.6	Confident	54 Å²	54	67.8 Å²	67.8	21%	0.205	39%	0.389	C	S	.	.			trans	-84.5	120.9	171.6	-67.8	97	0	0	0	110.1	I334 E336 L339 G355 K356 V374	I334-W353 HydrophobicContact CG2-CH2 3.88Å; I334-W353 HydrophobicContact CG2-CZ2 4.38Å; E336-W353 PolarHBondContact OE2-NE1 2.94Å; L339-W353 HydrophobicContact CD1-CH2 3.99Å; L339-W353 HydrophobicContact CD1-CZ2 3.53Å; W353-G355 PolarHBondContact O-N 2.99Å; W353-K356 HydrophobicContact CB-CD 4.39Å; W353-K356 WeakPolarHBondContact O-CB 3.46Å; W353-K356 PolarHBondContact O-N 3.36Å; W353-V374 HydrophobicContact CD2-CB 4.29Å; W353-V374 HydrophobicContact CD2-CG2 3.59Å; W353-V374 HydrophobicContact CE3-CB 3.82Å; W353-V374 HydrophobicContact CE3-CG2 3.64Å; W353-V374 HydrophobicContact CG-CG2 4.13Å; W353-V374 HydrophobicContact CH2-CB 4.12Å; W353-V374 HydrophobicContact CH2-CG2 4.15Å; W353-V374 HydrophobicContact CZ2-CG2 4.1Å; W353-V374 HydrophobicContact CZ3-CB 3.73Å; W353-V374 HydrophobicContact CZ3-CG2 3.93Å
354	P	80.8	Confident	71.9	Confident	21 Å²	21	71.8 Å²	71.8	14%	0.136	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	126.2	-177.6	15	-23.4	0	0	0	111.7	K371 Y373 Y375	P354-K371 WeakPolarHBondContact O-CD 3.32Å; P354-K371 PolarHBondContact O-NZ 2.86Å; P354-Y373 HydrophobicContact CB-CE2 4.02Å; P354-Y373 HydrophobicContact CG-CD2 3.62Å; P354-Y373 HydrophobicContact CG-CE2 3.23Å; P354-Y375 HydrophobicContact CB-CE2 4.19Å; P354-Y375 HydrophobicContact CG-CD2 4.5Å; P354-Y375 HydrophobicContact CG-CE2 4.19Å
355	G	67.4	Low	69.3	Low	38 Å²	38	74.8 Å²	74.8	39%	0.392	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.2	37.2	-177.5	0	0	0	0	0	114.4	W353 D357	W353-G355 PolarHBondContact O-N 2.99Å; G355-D357 PolarHBondContact O-N 2.99Å
356	K	56	Low	66.9	Low	122 Å²	122	81.9 Å²	81.9	53%	0.53	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-21.4	170.5	-165.4	163.8	176.7	171.3	0	111.7	E336 W353	E336-K356 IonicContact OE1-NZ 2.8Å; E336-K356 PolarHBondContact OE1-NZ 3.06Å; E336-K356 IonicContact OE2-NZ 2.73Å; E336-K356 PolarHBondContact OE2-NZ 2.85Å; W353-K356 HydrophobicContact CB-CD 4.39Å; W353-K356 WeakPolarHBondContact O-CB 3.46Å; W353-K356 PolarHBondContact O-N 3.36Å
357	D	49.2	Very low	64.3	Low	126 Å²	126	81.4 Å²	81.4	67%	0.674	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	4	-167.7	-41.5	-78.3	0	0	0	115.7	G355 K359	G355-D357 PolarHBondContact O-N 2.99Å; D357-K359 PolarHBondContact O-N 3.25Å
358	G	44.3	Very low	61.9	Low	53 Å²	53	88.4 Å²	88.4	55%	0.546	49%	0.49	S	S	.	.	S	Bend	trans	69.8	-11.1	172.4	0	0	0	0	0	117.7	H360	G358-H360 VanDerWaalsContact C-N 3.34Å; G358-H360 PolarHBondContact O-N 3.44Å
359	K	45.6	Very low	59.7	Low	160 Å²	160	91.1 Å²	91.1	70%	0.696	51%	0.505	S	S	*	.			trans	-68.2	-26.3	-177.9	-65.7	173.3	-174.9	171.5	0	114.4	E198 D357	E198-K359 VanDerWaalsContact OE1-CB 3.22Å; E198-K359 WeakPolarHBondContact OE1-CB 2.8Å; D357-K359 PolarHBondContact O-N 3.25Å
360	H	43.2	Very low	57.6	Low	59 Å²	59	92 Å²	92	27%	0.273	52%	0.515	S	S	.	.	S	Bend	trans	-64.3	122.2	-177.5	-177.1	-106.1	0	0	0	111.6	G358 R362 C363	G358-H360 VanDerWaalsContact C-N 3.34Å; G358-H360 PolarHBondContact O-N 3.44Å; H360-R362 PolarHBondContact ND1-N 3.24Å; H360-R362 PolarHBondContact ND1-O 2.81Å; H360-R362 CarbonylContact O-C 3.57Å; H360-R362 PolarHBondContact O-N 3.36Å; H360-C363 PolarHBondContact O-N 3.09Å; H360-C363 PolarHBondContact O-SG 2.98Å
361	P	42.8	Very low	56.2	Low	94 Å²	94	91.3 Å²	91.3	61%	0.61	51%	0.505	S	S	*	.	S	Bend	trans	-68.8	-7	-171.2	26.4	-35.3	0	0	0	114.7
362	R	46.4	Very low	55.7	Low	170 Å²	170	92.6 Å²	92.6	64%	0.642	52%	0.52	S	S	*	.			trans	-110.5	69.9	162.7	-61	-168.5	-64.9	155.9	-1.7	110.3	H360	H360-R362 PolarHBondContact ND1-N 3.24Å; H360-R362 PolarHBondContact ND1-O 2.81Å; H360-R362 CarbonylContact O-C 3.57Å; H360-R362 PolarHBondContact O-N 3.36Å
363	C	38.7	Very low	55.6	Low	67 Å²	67	93.5 Å²	93.5	45%	0.453	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-82.9	120.8	155.5	-73.3	0	0	0	0	108	H360	H360-C363 PolarHBondContact O-N 3.09Å; H360-C363 PolarHBondContact O-SG 2.98Å
364	P	40.1	Very low	55.9	Low	85 Å²	85	90.9 Å²	90.9	55%	0.552	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-58.2	140.9	167.3	-20.9	32.9	0	0	0	109.7	K366	P364-K366 PolarHBondContact O-N 3.35Å
365	P	41.1	Very low	56.6	Low	123 Å²	123	92 Å²	92	80%	0.799	51%	0.513	S	S	*	.	S	Bend	trans	-58.8	141.5	172.8	26.5	-34.2	0	0	0	109.6	G367	P365-G367 PolarHBondContact O-N 3.42Å
366	K	45.7	Very low	58.1	Low	224 Å²	224	90.2 Å²	90.2	97%	0.974	50%	0.495	S	S	*	.	S	Bend	trans	-32.2	90.6	-171.2	-65.4	176.9	179.4	176	0	114.1	P364	P364-K366 PolarHBondContact O-N 3.35Å
367	G	43.5	Very low	60	Low	49 Å²	49	84.8 Å²	84.8	51%	0.505	47%	0.472	S	S	.	.	S	Bend	trans	-166.7	132.3	-174.6	0	0	0	0	0	111.2	P365 V369	P365-G367 PolarHBondContact O-N 3.42Å; G367-V369 VanDerWaalsContact C-N 3.3Å; G367-V369 PolarHBondContact O-N 3.48Å
368	N	47.5	Very low	62.4	Low	164 Å²	164	79 Å²	79	88%	0.877	44%	0.441	S	S	*	.			trans	-74.3	66.7	-166.3	-70.4	-35.6	0	0	0	114.5	A370	N368-A370 VanDerWaalsContact C-N 3.32Å; N368-A370 PolarHBondContact O-N 2.86Å
369	V	49.4	Very low	64.9	Low	121 Å²	121	83.2 Å²	83.2	73%	0.733	45%	0.446	S	S	*	.			trans	-87.3	81.6	153.8	-172.7	0	0	0	0	107.2	G367 K371	G367-V369 VanDerWaalsContact C-N 3.3Å; G367-V369 PolarHBondContact O-N 3.48Å; V369-K371 PolarHBondContact O-N 3.43Å
370	A	55.2	Low	67.3	Low	41 Å²	41	79.7 Å²	79.7	34%	0.339	44%	0.435	S	S	.	.			trans	-58.2	126.3	175.5	0	0	0	0	0	109.2	W332 N368 G372	W332-A370 HydrophobicContact CB-CB 4.23Å; W332-A370 WeakPolarHBondContact O-CB 3.34Å; N368-A370 VanDerWaalsContact C-N 3.32Å; N368-A370 PolarHBondContact O-N 2.86Å; A370-G372 PolarHBondContact O-N 3.02Å; A370-G372 VanDerWaalsContact O-N 3.12Å
371	K	67.4	Low	69.9	Low	72 Å²	72	78.6 Å²	78.6	31%	0.313	43%	0.43	S	S	.	.			trans	-61.1	119.6	179.3	-67.5	174.3	-177.7	171.8	0	107.2	P354 V369 Y373	P354-K371 WeakPolarHBondContact O-CD 3.32Å; P354-K371 PolarHBondContact O-NZ 2.86Å; V369-K371 PolarHBondContact O-N 3.43Å; K371-Y373 HydrophobicContact CB-CD1 4.29Å; K371-Y373 HydrophobicContact CB-CE1 4.06Å; K371-Y373 PolarHBondContact O-N 3.32Å
372	G	84.7	Confident	72.4	Confident	35 Å²	35	82 Å²	82	36%	0.361	44%	0.435	S	S	.	.	S	Bend	trans	-69.5	24.2	-178.7	0	0	0	0	0	113.9	G329 V330 A370	G329-G372 VanDerWaalsContact CA-O 3.3Å; G329-G372 WeakPolarHBondContact CA-O 3.27Å; G329-G372 PolarHBondContact N-O 3.01Å; V330-G372 PolarHBondContact N-O 3.22Å; A370-G372 PolarHBondContact O-N 3.02Å; A370-G372 VanDerWaalsContact O-N 3.12Å
373	Y	91.2	Very high	74.9	Confident	85 Å²	85	74.4 Å²	74.4	33%	0.333	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	151	179.4	60.9	-79.8	0	0	0	110.6	F326 L327 P354 K371	F326-Y373 AromaticContact CE2-CD2 3.66Å; F326-Y373 HydrophobicContact CE2-CD2 3.66Å; F326-Y373 AromaticContact CE2-CG 3.98Å; F326-Y373 HydrophobicContact CE2-CG 3.98Å; F326-Y373 HydrophobicContact CZ-CD2 4.32Å; F326-Y373 HydrophobicContact CZ-CG 4.19Å; L327-Y373 CarbonylContact O-C 3.56Å; L327-Y373 WeakPolarHBondContact O-CA 3.48Å; L327-Y373 WeakPolarHBondContact O-CB 3.36Å; P354-Y373 HydrophobicContact CB-CE2 4.02Å; P354-Y373 HydrophobicContact CG-CD2 3.62Å; P354-Y373 HydrophobicContact CG-CE2 3.23Å; K371-Y373 HydrophobicContact CB-CD1 4.29Å; K371-Y373 HydrophobicContact CB-CE1 4.06Å; K371-Y373 PolarHBondContact O-N 3.32Å
374	V	94.5	Very high	77.7	Confident	0 Å²	0	71.2 Å²	71.2	0%	0	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	158.7	-176.4	67.2	0	0	0	0	109.6	L327 V330 L339 V351 E352 W353	L327-V374 HydrophobicContact CB-CG1 3.91Å; L327-V374 HydrophobicContact CD1-CG1 4.07Å; L327-V374 HydrophobicContact CG-CG1 4.42Å; L327-V374 PolarHBondContact N-O 3.43Å; L327-V374 PolarHBondContact O-N 2.91Å; V330-V374 HydrophobicContact CG1-CG1 4.03Å; L339-V374 HydrophobicContact CD1-CG1 3.93Å; L339-V374 HydrophobicContact CD1-CG2 4.18Å; L339-V374 HydrophobicContact CD2-CG1 4.39Å; V351-V374 HydrophobicContact CG1-CG2 3.45Å; V351-V374 VanDerWaalsContact CG1-CG2 3.45Å; E352-V374 WeakPolarHBondContact O-CG2 3.37Å; W353-V374 HydrophobicContact CD2-CB 4.29Å; W353-V374 HydrophobicContact CD2-CG2 3.59Å; W353-V374 HydrophobicContact CE3-CB 3.82Å; W353-V374 HydrophobicContact CE3-CG2 3.64Å; W353-V374 HydrophobicContact CG-CG2 4.13Å; W353-V374 HydrophobicContact CH2-CB 4.12Å; W353-V374 HydrophobicContact CH2-CG2 4.15Å; W353-V374 HydrophobicContact CZ2-CG2 4.1Å; W353-V374 HydrophobicContact CZ3-CB 3.73Å; W353-V374 HydrophobicContact CZ3-CG2 3.93Å
375	Y	95.8	Very high	80.3	Confident	45 Å²	45	71.2 Å²	71.2	18%	0.176	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	133.5	169.2	-60.3	-84.1	0	0	0	110.6	K324 V325 F326 E352 P354 Y481	K324-Y375 HydrophobicContact CD-CD1 4.09Å; K324-Y375 HydrophobicContact CD-CG 4.33Å; K324-Y375 HydrophobicContact CG-CD1 4.08Å; K324-Y375 HydrophobicContact CG-CG 4.48Å; V325-Y375 CarbonylContact O-C 3.56Å; V325-Y375 WeakPolarHBondContact O-CA 3.41Å; F326-Y375 HydrophobicContact CB-CD1 4.03Å; F326-Y375 HydrophobicContact CB-CE1 3.9Å; F326-Y375 HydrophobicContact CD2-CD1 4.32Å; F326-Y375 AromaticContact CD2-CE1 3.72Å; F326-Y375 HydrophobicContact CD2-CE1 3.72Å; F326-Y375 AromaticContact CD2-CZ 3.95Å; F326-Y375 HydrophobicContact CG-CE1 4.32Å; E352-Y375 PolarHBondContact N-O 2.92Å; E352-Y375 PolarHBondContact O-N 3.35Å; P354-Y375 HydrophobicContact CB-CE2 4.19Å; P354-Y375 HydrophobicContact CG-CD2 4.5Å; P354-Y375 HydrophobicContact CG-CE2 4.19Å; Y375-Y481 HydrophobicContact CD1-CE1 4.23Å; Y375-Y481 HydrophobicContact CE1-CD1 4.42Å; Y375-Y481 AromaticContact CE1-CE1 3.66Å; Y375-Y481 HydrophobicContact CE1-CE1 3.66Å
376	L	97.3	Very high	83	Confident	0 Å²	0	67 Å²	67	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	140.6	161.1	-52.9	-174	0	0	0	108.3	K324 V325 L327 F343 L349 V351 F378 L387	K324-L376 CarbonylContact C-O 3.41Å; K324-L376 VanDerWaalsContact CA-O 3.29Å; K324-L376 WeakPolarHBondContact CA-O 3.2Å; V325-L376 PolarHBondContact N-O 2.94Å; V325-L376 PolarHBondContact O-N 3.22Å; L327-L376 HydrophobicContact CD1-CD1 3.88Å; L327-L376 HydrophobicContact CD1-CD2 3.91Å; L327-L376 HydrophobicContact CD1-CG 3.79Å; L327-L376 HydrophobicContact CG-CD1 4.29Å; L327-L376 HydrophobicContact CG-CG 4.07Å; F343-L376 HydrophobicContact CB-CD1 4.04Å; F343-L376 HydrophobicContact CD1-CD1 4.15Å; F343-L376 HydrophobicContact CD2-CD1 3.57Å; F343-L376 HydrophobicContact CD2-CD2 4.15Å; F343-L376 HydrophobicContact CD2-CG 4.5Å; F343-L376 HydrophobicContact CE2-CD1 4.04Å; F343-L376 HydrophobicContact CG-CD1 3.64Å; L349-L376 HydrophobicContact CD1-CB 4.07Å; L349-L376 HydrophobicContact CD1-CD1 4.09Å; L349-L376 HydrophobicContact CD1-CD2 3.78Å; L349-L376 HydrophobicContact CD1-CG 4.19Å; V351-L376 HydrophobicContact CG2-CD2 4.25Å; L376-F378 HydrophobicContact CB-CD2 4.5Å; L376-F378 HydrophobicContact CB-CE2 4.07Å; L376-F378 HydrophobicContact CD1-CE2 3.98Å; L376-F378 HydrophobicContact CD1-CZ 4.04Å; L376-L387 HydrophobicContact CD1-CD2 4.32Å
377	V	97.8	Very high	85.4	Confident	8 Å²	8	56.3 Å²	56.3	5%	0.048	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	100.7	171.8	-174.3	0	0	0	0	108.2	K324 L349 T350 E352	K324-V377 HydrophobicContact CB-CG2 4.14Å; K324-V377 HydrophobicContact CD-CG2 4.3Å; K324-V377 HydrophobicContact CG-CG2 4.04Å; L349-V377 CarbonylContact C-O 3.57Å; L349-V377 VanDerWaalsContact CA-O 3.23Å; L349-V377 WeakPolarHBondContact CA-O 3.27Å; T350-V377 PolarHBondContact N-O 3.14Å; T350-V377 PolarHBondContact O-N 3.46Å; E352-V377 HydrophobicContact CG-CG2 4.14Å
378	F	98.3	Very high	87.9	Confident	5 Å²	5	54.5 Å²	54.5	2%	0.022	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	156.7	173.9	-68.2	-86.3	0	0	0	110.7	C323 F343 P348 L349 L376 S383 V384 L387	C323-F378 VanDerWaalsContact CB-O 3.23Å; C323-F378 WeakPolarHBondContact CB-O 3.31Å; C323-F378 PolarHBondContact O-N 3.27Å; F343-F378 HydrophobicContact CB-CZ 4.32Å; P348-F378 WeakPolarHBondContact O-CA 3.42Å; L349-F378 HydrophobicContact CB-CD1 3.75Å; L349-F378 HydrophobicContact CB-CE1 4.01Å; L349-F378 HydrophobicContact CB-CG 4.17Å; L349-F378 HydrophobicContact CD1-CE1 4.47Å; L349-F378 HydrophobicContact CD1-CZ 4.5Å; L349-F378 HydrophobicContact CD2-CE1 4.12Å; L349-F378 HydrophobicContact CG-CE1 4.43Å; L376-F378 HydrophobicContact CB-CD2 4.5Å; L376-F378 HydrophobicContact CB-CE2 4.07Å; L376-F378 HydrophobicContact CD1-CE2 3.98Å; L376-F378 HydrophobicContact CD1-CZ 4.04Å; F378-S383 VanDerWaalsContact CD1-CB 3.42Å; F378-V384 HydrophobicContact CB-CG2 4.42Å; F378-V384 HydrophobicContact CD2-CG2 3.7Å; F378-V384 HydrophobicContact CE2-CG2 4.37Å; F378-V384 HydrophobicContact CG-CG2 4.32Å; F378-L387 HydrophobicContact CE2-CD2 3.94Å; F378-L387 HydrophobicContact CZ-CD2 4.05Å
379	E	97.3	Very high	90.1	Very high	140 Å²	140	54.5 Å²	54.5	65%	0.654	28%	0.277	S	S	*	.	S	Bend	trans	-71	-35.4	167.5	-70.6	178.6	-178.7	0	0	111.6	P348	P348-E379 HydrophobicContact CB-CB 4.45Å; P348-E379 VanDerWaalsContact CB-CD 3.46Å; P348-E379 HydrophobicContact CB-CG 3.96Å; P348-E379 PolarHBondContact O-N 2.73Å
380	N	96.6	Very high	92.3	Very high	86 Å²	86	51.1 Å²	51.1	46%	0.46	26%	0.262	S	S	.	.			trans	-123.5	131.7	-169.4	-73.2	-74.7	0	0	0	112.7	K382 S383	N380-K382 PolarHBondContact O-N 3.34Å; N380-S383 VanDerWaalsContact O-CB 3.26Å; N380-S383 WeakPolarHBondContact O-CB 3.21Å; N380-S383 PolarHBondContact O-N 3Å
381	E	96.1	Very high	94.1	Very high	37 Å²	37	49.9 Å²	49.9	17%	0.173	25%	0.25	C	S	.	.	H	α-helix	trans	-61.4	-26	176.5	-173.2	-85.5	154.8	0	0	112.8	I320 Y321 C323 S383 V384 R385	I320-E381 HydrophobicContact CG2-CG 4.17Å; Y321-E381 PolarHBondContact N-OE1 2.66Å; Y321-E381 WeakPolarHBondContact O-CG 3.14Å; C323-E381 PolarHBondContact SG-N 2.98Å; E381-S383 VanDerWaalsContact C-N 3.29Å; E381-S383 PolarHBondContact O-N 2.92Å; E381-V384 WeakPolarHBondContact O-CB 3.29Å; E381-V384 PolarHBondContact O-N 2.66Å; E381-R385 VanDerWaalsContact CD-NH1 3.29Å; E381-R385 VanDerWaalsContact CD-NH2 3.28Å; E381-R385 PolarHBondContact O-N 3.02Å; E381-R385 IonicContact OE1-CZ 3.47Å; E381-R385 IonicContact OE1-NE 3.72Å; E381-R385 IonicContact OE1-NH1 3.95Å; E381-R385 PolarHBondContact OE1-NH1 2.81Å; E381-R385 IonicContact OE1-NH2 3.85Å; E381-R385 PolarHBondContact OE1-NH2 3.28Å; E381-R385 IonicContact OE2-CZ 2.74Å; E381-R385 IonicContact OE2-NH1 3Å; E381-R385 PolarHBondContact OE2-NH1 3.33Å; E381-R385 IonicContact OE2-NH2 3.87Å; E381-R385 PolarHBondContact OE2-NH2 3.49Å
382	K	96.7	Very high	95.2	Very high	166 Å²	166	49.3 Å²	49.3	72%	0.722	26%	0.255	S	S	*	.	H	α-helix	trans	-60.2	-35.5	170.6	-65.7	-177.5	179.8	179.4	0	112.9	N380 V384 R385 A386	N380-K382 PolarHBondContact O-N 3.34Å; K382-V384 VanDerWaalsContact C-N 3.31Å; K382-V384 PolarHBondContact O-N 3.13Å; K382-R385 PolarHBondContact O-N 2.82Å; K382-A386 PolarHBondContact O-N 3.21Å
383	S	98	Very high	95.2	Very high	9 Å²	9	52 Å²	52	6%	0.063	26%	0.259	C	S	.	.	H	α-helix	trans	-67.2	-33.2	177.5	-59.3	0	0	0	0	112	Y346 F378 N380 E381 A386 L387	Y346-S383 WeakPolarHBondContact O-CA 3.34Å; Y346-S383 WeakPolarHBondContact O-CB 3.1Å; Y346-S383 PolarHBondContact O-OG 3.26Å; F378-S383 VanDerWaalsContact CD1-CB 3.42Å; N380-S383 VanDerWaalsContact O-CB 3.26Å; N380-S383 WeakPolarHBondContact O-CB 3.21Å; N380-S383 PolarHBondContact O-N 3Å; E381-S383 VanDerWaalsContact C-N 3.29Å; E381-S383 PolarHBondContact O-N 2.92Å; S383-A386 PolarHBondContact O-N 3.39Å; S383-L387 PolarHBondContact O-N 3.19Å
384	V	97.6	Very high	94	Very high	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-65.4	-44.5	172.8	179.1	0	0	0	0	110.7	Y321 V325 F378 E381 K382 A386 L387 L388 P422	Y321-V384 HydrophobicContact CD2-CG1 4.42Å; Y321-V384 HydrophobicContact CG-CG1 4.11Å; V325-V384 HydrophobicContact CG2-CB 4.3Å; V325-V384 HydrophobicContact CG2-CG1 3.66Å; V325-V384 HydrophobicContact CG2-CG2 3.67Å; F378-V384 HydrophobicContact CB-CG2 4.42Å; F378-V384 HydrophobicContact CD2-CG2 3.7Å; F378-V384 HydrophobicContact CE2-CG2 4.37Å; F378-V384 HydrophobicContact CG-CG2 4.32Å; E381-V384 WeakPolarHBondContact O-CB 3.29Å; E381-V384 PolarHBondContact O-N 2.66Å; K382-V384 VanDerWaalsContact C-N 3.31Å; K382-V384 PolarHBondContact O-N 3.13Å; V384-A386 VanDerWaalsContact C-N 3.34Å; V384-A386 PolarHBondContact O-N 2.95Å; V384-L387 PolarHBondContact O-N 2.91Å; V384-L388 HydrophobicContact CG1-CD1 4.05Å; V384-L388 HydrophobicContact CG1-CG 4.42Å; V384-L388 VanDerWaalsContact O-CG 3.27Å; V384-L388 WeakPolarHBondContact O-CG 3.43Å; V384-L388 PolarHBondContact O-N 2.69Å; V384-P422 HydrophobicContact CG1-CB 4.37Å
385	R	95.8	Very high	92.2	Very high	86 Å²	86	55.5 Å²	55.5	33%	0.325	29%	0.289	S	S	.	.	H	α-helix	trans	-59.9	-42.8	172.9	-69.1	-159.2	-163.3	74	7.7	112.6	P319 Y321 E381 K382 L387 L388 Q389	P319-R385 PolarHBondContact O-NH2 3.28Å; Y321-R385 HydrophobicContact CD2-CG 3.98Å; Y321-R385 HydrophobicContact CE2-CG 4.08Å; E381-R385 VanDerWaalsContact CD-NH1 3.29Å; E381-R385 VanDerWaalsContact CD-NH2 3.28Å; E381-R385 PolarHBondContact O-N 3.02Å; E381-R385 IonicContact OE1-CZ 3.47Å; E381-R385 IonicContact OE1-NE 3.72Å; E381-R385 IonicContact OE1-NH1 3.95Å; E381-R385 PolarHBondContact OE1-NH1 2.81Å; E381-R385 IonicContact OE1-NH2 3.85Å; E381-R385 PolarHBondContact OE1-NH2 3.28Å; E381-R385 IonicContact OE2-CZ 2.74Å; E381-R385 IonicContact OE2-NH1 3Å; E381-R385 PolarHBondContact OE2-NH1 3.33Å; E381-R385 IonicContact OE2-NH2 3.87Å; E381-R385 PolarHBondContact OE2-NH2 3.49Å; K382-R385 PolarHBondContact O-N 2.82Å; R385-L387 PolarHBondContact O-N 2.93Å; R385-L388 PolarHBondContact O-N 3.07Å; R385-Q389 WeakPolarHBondContact O-CB 3.47Å; R385-Q389 VanDerWaalsContact O-CG 3.29Å; R385-Q389 WeakPolarHBondContact O-CG 3.49Å; R385-Q389 PolarHBondContact O-N 2.91Å
386	A	97.1	Very high	90.3	Very high	33 Å²	33	61.5 Å²	61.5	27%	0.273	32%	0.316	S	S	.	.	H	α-helix	trans	-64.2	-38.2	179.3	0	0	0	0	0	112.6	Y346 K382 S383 V384 A390	Y346-A386 VanDerWaalsContact CD1-C 3.49Å; Y346-A386 HydrophobicContact CD1-CB 3.89Å; Y346-A386 WeakPolarHBondContact CE1-O 3.38Å; K382-A386 PolarHBondContact O-N 3.21Å; S383-A386 PolarHBondContact O-N 3.39Å; V384-A386 VanDerWaalsContact C-N 3.34Å; V384-A386 PolarHBondContact O-N 2.95Å; A386-A390 PolarHBondContact O-N 2.8Å
387	L	96.9	Very high	88.5	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-62.4	-49.3	171.2	170.9	58.9	0	0	0	111.4	F343 Y346 L376 F378 S383 V384 R385 Q389 A390 C391 F406 V420	F343-L387 HydrophobicContact CD1-CD1 3.77Å; F343-L387 HydrophobicContact CD1-CD2 4.48Å; F343-L387 HydrophobicContact CE1-CD1 3.69Å; Y346-L387 HydrophobicContact CD1-CB 4.43Å; Y346-L387 HydrophobicContact CD2-CB 4.14Å; Y346-L387 HydrophobicContact CD2-CD1 4.08Å; Y346-L387 HydrophobicContact CE2-CD1 3.81Å; Y346-L387 HydrophobicContact CG-CB 4.1Å; L376-L387 HydrophobicContact CD1-CD2 4.32Å; F378-L387 HydrophobicContact CE2-CD2 3.94Å; F378-L387 HydrophobicContact CZ-CD2 4.05Å; S383-L387 PolarHBondContact O-N 3.19Å; V384-L387 PolarHBondContact O-N 2.91Å; R385-L387 PolarHBondContact O-N 2.93Å; L387-Q389 VanDerWaalsContact C-N 3.29Å; L387-Q389 PolarHBondContact O-N 2.9Å; L387-A390 CarbonylContact O-C 3.58Å; L387-A390 PolarHBondContact O-N 3.04Å; L387-C391 PolarHBondContact O-N 3.02Å; L387-C391 PolarHBondContact O-SG 2.87Å; L387-F406 HydrophobicContact CD1-CD2 4.06Å; L387-F406 HydrophobicContact CD1-CE2 4.37Å; L387-V420 HydrophobicContact CD2-CG1 4.1Å; L387-V420 HydrophobicContact CG-CG1 4.43Å
388	L	94.7	Very high	86.3	Confident	12 Å²	12	70.3 Å²	70.3	6%	0.063	36%	0.364	C	S	.	.	H	α-helix	trans	-63.6	-33.4	-179	-65.1	172.4	0	0	0	112.5	Y321 V384 R385 A390 C391 Y404 V420 P422	Y321-L388 HydrophobicContact CD1-CD1 4.3Å; Y321-L388 HydrophobicContact CD2-CD1 4.13Å; Y321-L388 HydrophobicContact CE1-CD1 3.89Å; Y321-L388 HydrophobicContact CE2-CD1 3.71Å; Y321-L388 HydrophobicContact CG-CD1 4.39Å; V384-L388 HydrophobicContact CG1-CD1 4.05Å; V384-L388 HydrophobicContact CG1-CG 4.42Å; V384-L388 VanDerWaalsContact O-CG 3.27Å; V384-L388 WeakPolarHBondContact O-CG 3.43Å; V384-L388 PolarHBondContact O-N 2.69Å; R385-L388 PolarHBondContact O-N 3.07Å; L388-A390 PolarHBondContact O-N 2.98Å; L388-C391 PolarHBondContact O-N 2.82Å; L388-Y404 HydrophobicContact CB-CD1 4.42Å; L388-Y404 HydrophobicContact CB-CE1 4.2Å; L388-Y404 HydrophobicContact CD2-CD1 4.07Å; L388-Y404 HydrophobicContact CD2-CD2 3.69Å; L388-Y404 HydrophobicContact CD2-CE1 4.35Å; L388-Y404 HydrophobicContact CD2-CE2 3.99Å; L388-Y404 HydrophobicContact CD2-CG 3.74Å; L388-V420 HydrophobicContact CD2-CG1 4.02Å; L388-P422 HydrophobicContact CD1-CB 3.88Å; L388-P422 HydrophobicContact CD1-CG 3.83Å; L388-P422 HydrophobicContact CD2-CB 4.17Å; L388-P422 HydrophobicContact CD2-CG 3.77Å; L388-P422 HydrophobicContact CG-CG 4.45Å
389	Q	94	Very high	84.1	Confident	164 Å²	164	78.8 Å²	78.8	77%	0.766	40%	0.404	S	S	*	.	H	α-helix	trans	-66.6	-22.6	172.5	-75.4	171.3	-23	0	0	113.7	R385 L387	R385-Q389 WeakPolarHBondContact O-CB 3.47Å; R385-Q389 VanDerWaalsContact O-CG 3.29Å; R385-Q389 WeakPolarHBondContact O-CG 3.49Å; R385-Q389 PolarHBondContact O-N 2.91Å; L387-Q389 VanDerWaalsContact C-N 3.29Å; L387-Q389 PolarHBondContact O-N 2.9Å
390	A	94.7	Very high	82.2	Confident	49 Å²	49	75.4 Å²	75.4	41%	0.405	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.2	0.1	175.9	0	0	0	0	0	113.6	Y346 A386 L387 L388	Y346-A390 HydrophobicContact CE1-CB 3.7Å; Y346-A390 WeakPolarHBondContact OH-CB 3.18Å; A386-A390 PolarHBondContact O-N 2.8Å; L387-A390 CarbonylContact O-C 3.58Å; L387-A390 PolarHBondContact O-N 3.04Å; L388-A390 PolarHBondContact O-N 2.98Å
391	C	94.1	Very high	80.2	Confident	15 Å²	15	74.5 Å²	74.5	10%	0.101	39%	0.391	C	S	.	.	S	Bend	trans	-88.7	144.6	175.4	-64.5	0	0	0	0	111	L387 L388 Y404 Y405	L387-C391 PolarHBondContact O-N 3.02Å; L387-C391 PolarHBondContact O-SG 2.87Å; L388-C391 PolarHBondContact O-N 2.82Å; C391-Y404 HydrophobicContact CB-CD1 4.01Å; C391-Y404 HydrophobicContact CB-CG 4.41Å; C391-Y405 CarbonylContact C-O 3.48Å; C391-Y405 VanDerWaalsContact CA-O 3.31Å; C391-Y405 WeakPolarHBondContact CA-O 3.45Å; C391-Y405 WeakPolarHBondContact CB-O 3.23Å
392	S	90.8	Very high	78.9	Confident	60 Å²	60	76.4 Å²	76.4	42%	0.42	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	139.3	163.8	48.4	0	0	0	0	110.2	Y405	S392-Y405 PolarHBondContact N-O 3.02Å; S392-Y405 PolarHBondContact O-N 2.86Å; S392-Y405 PolarHBondContact OG-O 3.34Å
393	Q	83.3	Confident	78.3	Confident	93 Å²	93	70.6 Å²	70.6	44%	0.435	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	153.8	168.2	-63	170.6	-65.8	0	0	109.1	P395 S401 Y404	Q393-P395 VanDerWaalsContact O-CD 3.25Å; Q393-P395 WeakPolarHBondContact O-CD 3.38Å; Q393-S401 PolarHBondContact NE2-O 3.45Å; Q393-Y404 HydrophobicContact CG-CD1 3.72Å; Q393-Y404 HydrophobicContact CG-CE1 3.82Å
394	D	67.4	Low	78	Confident	50 Å²	50	71.5 Å²	71.5	27%	0.267	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-64.4	118.2	177.3	-179.6	13.5	0	0	0	111.4	F396 H397	D394-F396 PolarHBondContact O-N 2.9Å; D394-F396 WeakPolarHBondContact OD1-CD2 3.4Å; D394-F396 PolarHBondContact OD1-N 2.98Å; D394-H397 IonicContact OD2-CE1 3.76Å; D394-H397 IonicContact OD2-CG 3.78Å; D394-H397 IonicContact OD2-ND1 2.73Å; D394-H397 PolarHBondContact OD2-ND1 2.66Å
395	P	57.2	Low	77.8	Confident	107 Å²	107	74.7 Å²	74.7	70%	0.695	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-19.7	177.5	-18.5	33.2	0	0	0	114.1	Q393	Q393-P395 VanDerWaalsContact O-CD 3.25Å; Q393-P395 WeakPolarHBondContact O-CD 3.38Å
396	F	54.6	Low	77.8	Confident	172 Å²	172	71.9 Å²	71.9	75%	0.754	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	-16.3	-168.9	-62	-76.8	0	0	0	114.1	D394	D394-F396 PolarHBondContact O-N 2.9Å; D394-F396 WeakPolarHBondContact OD1-CD2 3.4Å; D394-F396 PolarHBondContact OD1-N 2.98Å
397	H	59.4	Low	77.6	Confident	106 Å²	106	76.7 Å²	76.7	49%	0.491	39%	0.392	S	S	.	.			trans	-127.9	74	177.8	-58.1	95.2	0	0	0	111.5	D394 E399 D400	D394-H397 IonicContact OD2-CE1 3.76Å; D394-H397 IonicContact OD2-CG 3.78Å; D394-H397 IonicContact OD2-ND1 2.73Å; D394-H397 PolarHBondContact OD2-ND1 2.66Å; H397-E399 PolarHBondContact O-N 3.26Å; H397-D400 HydrophobicContact CB-CB 4.06Å; H397-D400 CarbonylContact O-C 3.57Å; H397-D400 WeakPolarHBondContact O-CA 3.39Å; H397-D400 PolarHBondContact O-N 3.46Å
398	P	51.2	Low	77.3	Confident	87 Å²	87	76.9 Å²	76.9	57%	0.565	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-61.6	-24.3	-179.4	24.3	-34.4	0	0	0	114.2	D400 S401	P398-D400 VanDerWaalsContact C-N 3.26Å; P398-D400 PolarHBondContact O-N 2.76Å; P398-S401 WeakPolarHBondContact O-CB 3.22Å; P398-S401 PolarHBondContact O-N 3.02Å; P398-S401 PolarHBondContact O-OG 3.24Å
399	E	52.3	Low	77.1	Confident	182 Å²	182	79.1 Å²	79.1	85%	0.85	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-66.2	-27.9	171.2	-55.1	-57.7	123.2	0	0	112.4	H397	H397-E399 PolarHBondContact O-N 3.26Å
400	D	57.6	Low	76.8	Confident	69 Å²	69	72.4 Å²	72.4	37%	0.369	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-99.7	34.7	173.9	-84.8	-55.3	0	0	0	111.6	H397 P398 R402 E403 K511	H397-D400 HydrophobicContact CB-CB 4.06Å; H397-D400 CarbonylContact O-C 3.57Å; H397-D400 WeakPolarHBondContact O-CA 3.39Å; H397-D400 PolarHBondContact O-N 3.46Å; P398-D400 VanDerWaalsContact C-N 3.26Å; P398-D400 PolarHBondContact O-N 2.76Å; D400-R402 PolarHBondContact O-N 3Å; D400-E403 PolarHBondContact O-N 3.23Å; D400-E403 VanDerWaalsContact O-N 3.08Å; D400-K511 IonicContact OD1-NZ 3.98Å; D400-K511 PolarHBondContact OD1-NZ 2.75Å; D400-K511 WeakPolarHBondContact OD2-CE 3.5Å; D400-K511 IonicContact OD2-NZ 3.62Å; D400-K511 PolarHBondContact OD2-NZ 3.07Å
401	S	54.7	Low	76.4	Confident	67 Å²	67	79.7 Å²	79.7	47%	0.469	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	22.2	179.4	44.7	0	0	0	0	116.2	Q393 P398	Q393-S401 PolarHBondContact NE2-O 3.45Å; P398-S401 WeakPolarHBondContact O-CB 3.22Å; P398-S401 PolarHBondContact O-N 3.02Å; P398-S401 PolarHBondContact O-OG 3.24Å
402	R	68.6	Low	76	Confident	77 Å²	77	88.1 Å²	88.1	29%	0.291	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.7	0.7	173.3	-73.5	-177.5	149.4	-135.2	-15.7	113.8	D400 Y404 D427	D400-R402 PolarHBondContact O-N 3Å; R402-Y404 WeakPolarHBondContact O-CD2 3.24Å; R402-Y404 WeakPolarHBondContact O-CE2 3.48Å; R402-Y404 PolarHBondContact O-N 3.33Å; R402-D427 IonicContact NH1-OD2 2.6Å
403	E	84.6	Confident	75.8	Confident	45 Å²	45	88 Å²	88	21%	0.21	42%	0.42	C	S	.	.			trans	-83.6	98.6	171.7	-60.1	-154.2	-157.9	0	0	110.1	D400 Y405 Q419 K511	D400-E403 PolarHBondContact O-N 3.23Å; D400-E403 VanDerWaalsContact O-N 3.08Å; E403-Y405 HydrophobicContact CB-CE2 3.99Å; E403-Y405 PolarHBondContact OE2-OH 2.83Å; E403-Q419 PolarHBondContact OE2-NE2 3.49Å; E403-Q419 VanDerWaalsContact OE2-NE2 3.07Å; E403-K511 IonicContact OE1-NZ 2.7Å; E403-K511 PolarHBondContact OE1-NZ 3.02Å
404	Y	91.4	Very high	76.1	Confident	28 Å²	28	93.7 Å²	93.7	11%	0.11	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	140.6	179.1	-61.1	-87.6	0	0	0	111	L388 C391 Q393 R402 Q419 V420 P422	L388-Y404 HydrophobicContact CB-CD1 4.42Å; L388-Y404 HydrophobicContact CB-CE1 4.2Å; L388-Y404 HydrophobicContact CD2-CD1 4.07Å; L388-Y404 HydrophobicContact CD2-CD2 3.69Å; L388-Y404 HydrophobicContact CD2-CE1 4.35Å; L388-Y404 HydrophobicContact CD2-CE2 3.99Å; L388-Y404 HydrophobicContact CD2-CG 3.74Å; C391-Y404 HydrophobicContact CB-CD1 4.01Å; C391-Y404 HydrophobicContact CB-CG 4.41Å; Q393-Y404 HydrophobicContact CG-CD1 3.72Å; Q393-Y404 HydrophobicContact CG-CE1 3.82Å; R402-Y404 WeakPolarHBondContact O-CD2 3.24Å; R402-Y404 WeakPolarHBondContact O-CE2 3.48Å; R402-Y404 PolarHBondContact O-N 3.33Å; Y404-Q419 CarbonylContact O-C 3.37Å; Y404-Q419 WeakPolarHBondContact O-CA 3.36Å; Y404-V420 PolarHBondContact O-N 2.88Å; Y404-P422 HydrophobicContact CD2-CG 4.3Å; Y404-P422 HydrophobicContact CE2-CG 4.23Å
405	Y	93.8	Very high	77	Confident	66 Å²	66	95.5 Å²	95.5	26%	0.259	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	138.1	177.3	-65.8	-88.1	0	0	0	111.2	C391 S392 E403 D417 V418 Q419	C391-Y405 CarbonylContact C-O 3.48Å; C391-Y405 VanDerWaalsContact CA-O 3.31Å; C391-Y405 WeakPolarHBondContact CA-O 3.45Å; C391-Y405 WeakPolarHBondContact CB-O 3.23Å; S392-Y405 PolarHBondContact N-O 3.02Å; S392-Y405 PolarHBondContact O-N 2.86Å; S392-Y405 PolarHBondContact OG-O 3.34Å; E403-Y405 HydrophobicContact CB-CE2 3.99Å; E403-Y405 PolarHBondContact OE2-OH 2.83Å; Y405-D417 HydrophobicContact CD1-CB 4.48Å; Y405-V418 CarbonylContact C-O 3.51Å; Y405-V418 WeakPolarHBondContact CA-O 3.39Å; Y405-Q419 HydrophobicContact CD1-CB 4.16Å; Y405-Q419 HydrophobicContact CD1-CG 4.42Å; Y405-Q419 HydrophobicContact CE1-CB 3.86Å; Y405-Q419 HydrophobicContact CE1-CG 3.9Å
406	F	94.8	Very high	78.6	Confident	28 Å²	28	93.3 Å²	93.3	12%	0.123	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	129.3	177.6	-173.3	-89	0	0	0	110.2	T342 F343 Y346 L387 M408 V418 V420	T342-F406 HydrophobicContact CG2-CE1 3.53Å; T342-F406 HydrophobicContact CG2-CZ 3.96Å; F343-F406 AromaticContact CE1-CD1 3.73Å; F343-F406 HydrophobicContact CE1-CD1 3.73Å; F343-F406 HydrophobicContact CE1-CD2 4.28Å; F343-F406 AromaticContact CE1-CE1 3.72Å; F343-F406 HydrophobicContact CE1-CE1 3.72Å; F343-F406 HydrophobicContact CE1-CE2 4.26Å; F343-F406 HydrophobicContact CE1-CG 4.02Å; F343-F406 AromaticContact CE1-CZ 3.98Å; F343-F406 HydrophobicContact CE1-CZ 3.98Å; F343-F406 AromaticContact CZ-CD1 3.8Å; F343-F406 HydrophobicContact CZ-CD1 3.8Å; F343-F406 AromaticContact CZ-CE1 3.96Å; F343-F406 HydrophobicContact CZ-CE1 3.96Å; F343-F406 HydrophobicContact CZ-CG 4.39Å; Y346-F406 HydrophobicContact CE2-CE2 4.41Å; Y346-F406 WeakPolarHBondContact OH-CE2 3.38Å; L387-F406 HydrophobicContact CD1-CD2 4.06Å; L387-F406 HydrophobicContact CD1-CE2 4.37Å; F406-M408 HydrophobicContact CD1-CB 4.11Å; F406-M408 HydrophobicContact CE1-CB 4.12Å; F406-M408 PolarHBondContact O-N 2.86Å; F406-V418 PolarHBondContact N-O 2.92Å; F406-V418 PolarHBondContact O-N 2.9Å; F406-V420 HydrophobicContact CB-CG2 3.72Å
407	K	93.4	Very high	80.4	Confident	134 Å²	134	88.7 Å²	88.7	58%	0.583	42%	0.416	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.5	110.1	179.2	-76	-179.4	177.5	176.7	0	110.7	D417	K407-D417 VanDerWaalsContact CE-CG 3.48Å; K407-D417 WeakPolarHBondContact CE-OD1 3.48Å; K407-D417 WeakPolarHBondContact CE-OD2 3.44Å; K407-D417 WeakPolarHBondContact CG-OD1 3.48Å; K407-D417 IonicContact NZ-OD1 2.74Å
408	M	90.9	Very high	82	Confident	4 Å²	4	83.7 Å²	83.7	2%	0.02	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	160.2	176.8	73.6	178.5	-54.4	0	0	113.2	V330 P331 I334 L339 F406 C415 K416 V418	V330-M408 HydrophobicContact CG1-SD 4.28Å; P331-M408 VanDerWaalsContact CD-SD 3.52Å; P331-M408 HydrophobicContact CG-CG 4.03Å; P331-M408 HydrophobicContact CG-SD 4.24Å; I334-M408 HydrophobicContact CD1-CE 3.6Å; I334-M408 HydrophobicContact CG1-CE 3.73Å; L339-M408 HydrophobicContact CD2-CE 3.86Å; L339-M408 HydrophobicContact CD2-SD 4.5Å; F406-M408 HydrophobicContact CD1-CB 4.11Å; F406-M408 HydrophobicContact CE1-CB 4.12Å; F406-M408 PolarHBondContact O-N 2.86Å; M408-C415 PolarHBondContact O-N 3.07Å; M408-K416 PolarHBondContact N-O 2.73Å; M408-K416 PolarHBondContact O-N 3.22Å; M408-V418 HydrophobicContact CG-CB 4.46Å; M408-V418 HydrophobicContact CG-CG2 3.66Å; M408-V418 HydrophobicContact SD-CB 4.37Å; M408-V418 HydrophobicContact SD-CG1 4.47Å; M408-V418 HydrophobicContact SD-CG2 3.72Å
409	S	89.7	Confident	84.1	Confident	59 Å²	59	82.2 Å²	82.2	41%	0.413	38%	0.379	S	S	.	.			trans	-126.6	146	175.1	-60.6	0	0	0	0	110.6	M413 C415	S409-M413 CarbonylContact C-O 3.57Å; S409-M413 WeakPolarHBondContact CA-O 3.31Å; S409-C415 PolarHBondContact OG-N 3.33Å
410	S	88.1	Confident	86.1	Confident	22 Å²	22	73.6 Å²	73.6	15%	0.154	34%	0.338	C	S	.	.			trans	-113.8	-161.8	169.5	65.4	0	0	0	0	109.6	P331 D333 M413	P331-S410 WeakPolarHBondContact CB-OG 3.13Å; D333-S410 WeakPolarHBondContact OD1-CB 3.33Å; D333-S410 PolarHBondContact OD1-OG 2.85Å; D333-S410 WeakPolarHBondContact OD2-CB 3.28Å; D333-S410 PolarHBondContact OD2-OG 3.47Å; D333-S410 VanDerWaalsContact OD2-OG 3.12Å; S410-M413 PolarHBondContact N-O 3.36Å; S410-M413 PolarHBondContact OG-N 2.86Å; S410-M413 PolarHBondContact OG-O 3.02Å
411	R	86.5	Confident	87.8	Confident	202 Å²	202	73.4 Å²	73.4	76%	0.762	34%	0.337	S	S	*	.	S	Bend	trans	-78.8	-29.4	176.9	-70.7	179.4	-70.4	-168.9	-4.2	112	D333	D333-R411 WeakPolarHBondContact OD2-CA 3.16Å; D333-R411 PolarHBondContact OD2-N 3.45Å
412	R	86.4	Confident	89.8	Confident	193 Å²	193	71 Å²	71	73%	0.728	32%	0.32	S	S	*	.	S	Bend	trans	-111.8	-20.6	-176.5	-61.3	-177.4	178.1	-144.9	2.5	114.4	W332 D333	W332-R412 VanDerWaalsContact CH2-CD 3.43Å; W332-R412 HydrophobicContact CZ2-CB 4.38Å; D333-R412 PolarHBondContact OD2-N 3.35Å
413	M	85.7	Confident	91	Very high	57 Å²	57	67.7 Å²	67.7	28%	0.281	31%	0.307	S	S	.	.			trans	-117	132	175.2	-51.4	-167.1	74.9	0	0	109.7	P331 S409 S410 K416	P331-M413 HydrophobicContact CB-CB 4.14Å; P331-M413 HydrophobicContact CB-CG 4.24Å; P331-M413 HydrophobicContact CB-SD 4Å; S409-M413 CarbonylContact C-O 3.57Å; S409-M413 WeakPolarHBondContact CA-O 3.31Å; S410-M413 PolarHBondContact N-O 3.36Å; S410-M413 PolarHBondContact OG-N 2.86Å; S410-M413 PolarHBondContact OG-O 3.02Å; M413-K416 HydrophobicContact CE-CD 3.83Å; M413-K416 HydrophobicContact CE-CG 4.42Å; M413-K416 HydrophobicContact SD-CD 3.96Å
414	R	89.2	Confident	91.6	Very high	212 Å²	212	65.6 Å²	65.6	80%	0.8	30%	0.298	S	S	*	.			trans	-113.6	144.3	176	-65.9	-177.4	-179.1	128.1	-0.3	110.2	K416	R414-K416 PolarHBondContact O-N 2.92Å; R414-K416 VanDerWaalsContact O-N 3.17Å
415	C	88.1	Confident	91.8	Very high	89 Å²	89	66.6 Å²	66.6	60%	0.601	30%	0.304	S	S	*	.	S	Bend	trans	49.4	40.8	174.1	-54.7	0	0	0	0	113.9	M408 S409	M408-C415 PolarHBondContact O-N 3.07Å; S409-C415 PolarHBondContact OG-N 3.33Å
416	K	90.8	Very high	91.8	Very high	60 Å²	60	66.6 Å²	66.6	26%	0.261	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	125.3	176.5	-166.5	-172.5	-172.3	-173	0	108.9	G329 V330 P331 M408 M413 R414	G329-K416 WeakPolarHBondContact O-CD 3.45Å; G329-K416 WeakPolarHBondContact O-CE 3.06Å; G329-K416 PolarHBondContact O-NZ 2.97Å; V330-K416 PolarHBondContact O-NZ 3.08Å; P331-K416 HydrophobicContact CG-CB 4.4Å; P331-K416 HydrophobicContact CG-CD 4.07Å; M408-K416 PolarHBondContact N-O 2.73Å; M408-K416 PolarHBondContact O-N 3.22Å; M413-K416 HydrophobicContact CE-CD 3.83Å; M413-K416 HydrophobicContact CE-CG 4.42Å; M413-K416 HydrophobicContact SD-CD 3.96Å; R414-K416 PolarHBondContact O-N 2.92Å; R414-K416 VanDerWaalsContact O-N 3.17Å
417	D	91.6	Very high	91.8	Very high	76 Å²	76	65.7 Å²	65.7	41%	0.406	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	127.3	167.7	-69.5	-71.5	0	0	0	110.3	Y405 K407	Y405-D417 HydrophobicContact CD1-CB 4.48Å; K407-D417 VanDerWaalsContact CE-CG 3.48Å; K407-D417 WeakPolarHBondContact CE-OD1 3.48Å; K407-D417 WeakPolarHBondContact CE-OD2 3.44Å; K407-D417 WeakPolarHBondContact CG-OD1 3.48Å; K407-D417 IonicContact NZ-OD1 2.74Å
418	V	93.6	Very high	92	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	124.6	-179.8	171.5	0	0	0	0	108	L327 G328 V330 Y405 F406 M408	L327-V418 HydrophobicContact CB-CG1 4.06Å; L327-V418 HydrophobicContact CD2-CG1 4.34Å; G328-V418 CarbonylContact O-C 3.58Å; G328-V418 WeakPolarHBondContact O-CA 3.42Å; G328-V418 WeakPolarHBondContact O-CG1 3.45Å; V330-V418 HydrophobicContact CG1-CG1 3.75Å; V330-V418 HydrophobicContact CG1-CG2 4.48Å; Y405-V418 CarbonylContact C-O 3.51Å; Y405-V418 WeakPolarHBondContact CA-O 3.39Å; F406-V418 PolarHBondContact N-O 2.92Å; F406-V418 PolarHBondContact O-N 2.9Å; M408-V418 HydrophobicContact CG-CB 4.46Å; M408-V418 HydrophobicContact CG-CG2 3.66Å; M408-V418 HydrophobicContact SD-CB 4.37Å; M408-V418 HydrophobicContact SD-CG1 4.47Å; M408-V418 HydrophobicContact SD-CG2 3.72Å
419	Q	94	Very high	92.3	Very high	56 Å²	56	63.7 Å²	63.7	26%	0.262	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	130.1	-178.5	-163.4	-179.6	36.9	0	0	109.7	L327 G328 E403 Y404 Y405 I421	L327-Q419 CarbonylContact C-O 3.52Å; L327-Q419 WeakPolarHBondContact CA-O 3.42Å; G328-Q419 PolarHBondContact N-O 3.5Å; G328-Q419 PolarHBondContact O-N 2.87Å; E403-Q419 PolarHBondContact OE2-NE2 3.49Å; E403-Q419 VanDerWaalsContact OE2-NE2 3.07Å; Y404-Q419 CarbonylContact O-C 3.37Å; Y404-Q419 WeakPolarHBondContact O-CA 3.36Å; Y405-Q419 HydrophobicContact CD1-CB 4.16Å; Y405-Q419 HydrophobicContact CD1-CG 4.42Å; Y405-Q419 HydrophobicContact CE1-CB 3.86Å; Y405-Q419 HydrophobicContact CE1-CG 3.9Å; Q419-I421 HydrophobicContact CG-CD1 4.46Å; Q419-I421 HydrophobicContact CG-CG1 4.07Å
420	V	95.4	Very high	92.6	Very high	1 Å²	1	64 Å²	64	1%	0.006	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	112.5	178	-172.3	0	0	0	0	107.7	V325 L327 L387 L388 Y404 F406 P422	V325-V420 HydrophobicContact CG1-CG1 3.61Å; L327-V420 HydrophobicContact CD2-CB 4.22Å; L327-V420 HydrophobicContact CD2-CG1 4.08Å; L327-V420 HydrophobicContact CD2-CG2 3.75Å; L387-V420 HydrophobicContact CD2-CG1 4.1Å; L387-V420 HydrophobicContact CG-CG1 4.43Å; L388-V420 HydrophobicContact CD2-CG1 4.02Å; Y404-V420 PolarHBondContact O-N 2.88Å; F406-V420 HydrophobicContact CB-CG2 3.72Å; V420-P422 WeakPolarHBondContact O-CD 2.96Å
421	I	93.6	Very high	92.9	Very high	65 Å²	65	66.4 Å²	66.4	33%	0.333	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	99.1	-179.2	-52.2	-177.3	0	0	0	108.6	F326 Q419	F326-I421 HydrophobicContact CB-CB 4.28Å; F326-I421 HydrophobicContact CD1-CB 4.04Å; F326-I421 HydrophobicContact CD1-CD1 3.75Å; F326-I421 HydrophobicContact CD1-CG1 3.95Å; F326-I421 HydrophobicContact CE1-CD1 3.92Å; F326-I421 PolarHBondContact N-O 2.95Å; F326-I421 PolarHBondContact O-N 2.86Å; Q419-I421 HydrophobicContact CG-CD1 4.46Å; Q419-I421 HydrophobicContact CG-CG1 4.07Å
422	P	94.8	Very high	93.2	Very high	17 Å²	17	63.5 Å²	63.5	11%	0.11	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	151.2	172.4	35.9	-36.9	0	0	0	110.7	Y321 V384 L388 Y404 V420	Y321-P422 HydrophobicContact CD1-CB 3.68Å; Y321-P422 HydrophobicContact CD1-CG 4.2Å; Y321-P422 HydrophobicContact CE1-CB 3.9Å; Y321-P422 HydrophobicContact CE1-CG 3.9Å; Y321-P422 HydrophobicContact CG-CB 4.48Å; V384-P422 HydrophobicContact CG1-CB 4.37Å; L388-P422 HydrophobicContact CD1-CB 3.88Å; L388-P422 HydrophobicContact CD1-CG 3.83Å; L388-P422 HydrophobicContact CD2-CB 4.17Å; L388-P422 HydrophobicContact CD2-CG 3.77Å; L388-P422 HydrophobicContact CG-CG 4.45Å; Y404-P422 HydrophobicContact CD2-CG 4.3Å; Y404-P422 HydrophobicContact CE2-CG 4.23Å; V420-P422 WeakPolarHBondContact O-CD 2.96Å
423	W	95.5	Very high	93.3	Very high	7 Å²	7	56.9 Å²	56.9	3%	0.027	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	135.2	168.4	-171.3	-104.5	0	0	0	111.1	Y321 S322 D427 S428 N454 I474 Y481 P482	Y321-W423 CarbonylContact C-O 3.54Å; Y321-W423 VanDerWaalsContact CA-O 3.24Å; Y321-W423 WeakPolarHBondContact CA-O 3.33Å; S322-W423 PolarHBondContact N-O 2.65Å; W423-D427 HydrophobicContact CH2-CB 4.14Å; W423-D427 HydrophobicContact CZ2-CB 3.7Å; W423-S428 PolarHBondContact NE1-OG 2.81Å; W423-N454 HydrophobicContact CH2-CB 4.23Å; W423-I474 HydrophobicContact CZ2-CG1 4.46Å; W423-Y481 HydrophobicContact CB-CD2 3.74Å; W423-Y481 HydrophobicContact CB-CE2 3.66Å; W423-P482 HydrophobicContact CD2-CG 3.41Å; W423-P482 VanDerWaalsContact CD2-CG 3.41Å; W423-P482 HydrophobicContact CE3-CG 3.64Å; W423-P482 HydrophobicContact CG-CG 4Å; W423-P482 HydrophobicContact CH2-CG 3.74Å; W423-P482 HydrophobicContact CZ2-CG 3.53Å; W423-P482 HydrophobicContact CZ3-CG 3.79Å
424	V	95.3	Very high	93.2	Very high	2 Å²	2	59.9 Å²	59.9	1%	0.012	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	129.4	173.5	-163.9	0	0	0	0	109.1	P319 I320 Y321 S426 D427	P319-V424 HydrophobicContact CB-CG1 3.6Å; P319-V424 HydrophobicContact CB-CG2 4.18Å; I320-V424 WeakPolarHBondContact O-CG1 3.23Å; Y321-V424 HydrophobicContact CD1-CG2 4.06Å; Y321-V424 HydrophobicContact CE1-CG2 3.82Å; V424-S426 VanDerWaalsContact C-N 3.25Å; V424-S426 VanDerWaalsContact CG1-OG 3.23Å; V424-S426 WeakPolarHBondContact CG1-OG 3.44Å; V424-S426 PolarHBondContact O-N 2.92Å; V424-D427 HydrophobicContact CB-CB 4.47Å; V424-D427 WeakPolarHBondContact O-CB 3.31Å; V424-D427 PolarHBondContact O-N 3.21Å
425	I	95.9	Very high	92.9	Very high	49 Å²	49	54.4 Å²	54.4	25%	0.251	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-64.7	-29.5	-172.5	-66.2	169	0	0	0	112.4	I320 Y321 D427 S428 K480	I320-I425 HydrophobicContact CG2-CD1 4.16Å; I320-I425 PolarHBondContact O-N 3.13Å; Y321-I425 VanDerWaalsContact O-CD1 3.23Å; Y321-I425 WeakPolarHBondContact O-CD1 3.48Å; I425-D427 VanDerWaalsContact C-N 3.34Å; I425-S428 WeakPolarHBondContact O-CB 3.15Å; I425-S428 PolarHBondContact O-N 3.11Å; I425-K480 HydrophobicContact CD1-CB 4.43Å; I425-K480 HydrophobicContact CD1-CD 3.82Å; I425-K480 HydrophobicContact CG1-CB 4.15Å; I425-K480 HydrophobicContact CG1-CD 4.25Å; I425-K480 HydrophobicContact CG2-CD 4.02Å
426	S	94.7	Very high	92.6	Very high	66 Å²	66	54.8 Å²	54.8	46%	0.462	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-65.1	-31.6	173.2	38.1	0	0	0	0	113.5	N316 V424 S428 N429	N316-S426 PolarHBondContact OD1-OG 2.83Å; V424-S426 VanDerWaalsContact C-N 3.25Å; V424-S426 VanDerWaalsContact CG1-OG 3.23Å; V424-S426 WeakPolarHBondContact CG1-OG 3.44Å; V424-S426 PolarHBondContact O-N 2.92Å; S426-S428 PolarHBondContact O-N 3Å; S426-S428 VanDerWaalsContact O-N 3.07Å; S426-N429 PolarHBondContact O-N 3.03Å
427	D	95.2	Very high	92.5	Very high	8 Å²	8	63.5 Å²	63.5	4%	0.043	33%	0.333	C	S	.	.	G	3₁₀ helix	trans	-64.2	-13.5	177.6	-78.9	-27.2	0	0	0	112.3	R314 N316 R402 W423 V424 I425 N454 A455	R314-D427 WeakPolarHBondContact CD-OD2 3.13Å; R314-D427 IonicContact CZ-OD2 2.65Å; R314-D427 IonicContact NE-OD2 3.65Å; R314-D427 IonicContact NH1-OD2 2.86Å; R314-D427 PolarHBondContact NH1-OD2 2.79Å; N316-D427 PolarHBondContact ND2-OD1 2.7Å; R402-D427 IonicContact NH1-OD2 2.6Å; W423-D427 HydrophobicContact CH2-CB 4.14Å; W423-D427 HydrophobicContact CZ2-CB 3.7Å; V424-D427 HydrophobicContact CB-CB 4.47Å; V424-D427 WeakPolarHBondContact O-CB 3.31Å; V424-D427 PolarHBondContact O-N 3.21Å; I425-D427 VanDerWaalsContact C-N 3.34Å; D427-N454 HydrophobicContact CB-CB 3.69Å; D427-N454 WeakPolarHBondContact O-CB 3.23Å; D427-N454 PolarHBondContact OD1-ND2 2.88Å; D427-N454 VanDerWaalsContact OD1-ND2 3.14Å; D427-A455 WeakPolarHBondContact O-CB 3.26Å; D427-A455 PolarHBondContact O-N 3.03Å
428	S	97.1	Very high	92.5	Very high	5 Å²	5	63.8 Å²	63.8	4%	0.035	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-78.4	-14.6	179.5	-59.9	0	0	0	0	115.5	W423 I425 S426 G473 I474	W423-S428 PolarHBondContact NE1-OG 2.81Å; I425-S428 WeakPolarHBondContact O-CB 3.15Å; I425-S428 PolarHBondContact O-N 3.11Å; S426-S428 PolarHBondContact O-N 3Å; S426-S428 VanDerWaalsContact O-N 3.07Å; S428-G473 WeakPolarHBondContact O-CA 3.25Å; S428-I474 PolarHBondContact O-N 2.75Å
429	N	96.3	Very high	92.3	Very high	92 Å²	92	66.3 Å²	66.3	49%	0.492	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	133.7	-176.9	-72.6	-87.8	0	0	0	112.8	S426 Y471	S426-N429 PolarHBondContact O-N 3.03Å; N429-Y471 HydrophobicContact CB-CE2 4.44Å; N429-Y471 WeakPolarHBondContact OD1-CE2 3.16Å; N429-Y471 PolarHBondContact OD1-OH 3.39Å
430	Y	96.3	Very high	92.1	Very high	65 Å²	65	66.1 Å²	66.1	26%	0.255	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	127.6	172.6	171.3	-88.1	0	0	0	109.7	R432 E456 A459 Y471 A472	Y430-R432 HydrophobicContact CE1-CB 4.06Å; Y430-E456 HydrophobicContact CD2-CB 3.96Å; Y430-E456 HydrophobicContact CD2-CG 4.02Å; Y430-E456 HydrophobicContact CE2-CG 4.29Å; Y430-A459 HydrophobicContact CD1-CB 3.29Å; Y430-A459 HydrophobicContact CE1-CB 3.61Å; Y430-A459 HydrophobicContact CG-CB 3.84Å; Y430-Y471 WeakPolarHBondContact O-CA 3.2Å; Y430-Y471 WeakPolarHBondContact O-CD2 3.46Å; Y430-A472 PolarHBondContact N-O 2.88Å; Y430-A472 PolarHBondContact O-N 2.85Å
431	V	95.1	Very high	92	Very high	72 Å²	72	69 Å²	69	44%	0.436	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	118	-179.1	-178.9	0	0	0	0	109.1	P434 Y471	V431-P434 HydrophobicContact CG1-CB 4.29Å; V431-P434 HydrophobicContact CG1-CG 3.96Å; V431-Y471 HydrophobicContact CG2-CD2 3.91Å; V431-Y471 HydrophobicContact CG2-CE2 4.36Å
432	R	92.5	Very high	92.1	Very high	141 Å²	141	68 Å²	68	53%	0.532	36%	0.364	S	S	.	.	S	Bend	trans	-77.5	-31.8	-179.4	-167.4	175.3	-172.7	135.5	7.7	113.5	Y430 N463 V469 M470	Y430-R432 HydrophobicContact CE1-CB 4.06Å; R432-N463 PolarHBondContact NH1-OD1 2.97Å; R432-V469 VanDerWaalsContact CD-O 3.25Å; R432-V469 WeakPolarHBondContact CD-O 3.44Å; R432-M470 HydrophobicContact CB-CE 4.31Å; R432-M470 WeakPolarHBondContact CB-O 3.47Å; R432-M470 PolarHBondContact N-O 3.05Å
433	C	87.9	Confident	92.2	Very high	54 Å²	54	67.6 Å²	67.6	37%	0.365	36%	0.361	S	S	.	.			trans	-148.4	103	175.3	-175.6	0	0	0	0	110.3	A435 Q436 M470	C433-A435 PolarHBondContact O-N 3.09Å; C433-A435 VanDerWaalsContact O-N 3.16Å; C433-Q436 PolarHBondContact O-N 3.28Å; C433-M470 HydrophobicContact CB-CE 3.64Å
434	P	85.1	Confident	92.3	Very high	120 Å²	120	67.3 Å²	67.3	78%	0.779	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-19.1	-176.9	-26.2	35.7	0	0	0	115.6	V431	V431-P434 HydrophobicContact CG1-CB 4.29Å; V431-P434 HydrophobicContact CG1-CG 3.96Å
435	A	83.1	Confident	92.4	Very high	98 Å²	98	70.4 Å²	70.4	81%	0.81	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.2	-17.1	179.4	0	0	0	0	0	113.7	C433	C433-A435 PolarHBondContact O-N 3.09Å; C433-A435 VanDerWaalsContact O-N 3.16Å
436	Q	81.5	Confident	92.5	Very high	97 Å²	97	68.1 Å²	68.1	45%	0.453	36%	0.362	S	S	.	.	S	Bend	trans	-91.5	125.1	-176.4	-173.3	167.3	0.2	0	0	111.4	C433 L438 M470	C433-Q436 PolarHBondContact O-N 3.28Å; Q436-L438 PolarHBondContact O-N 2.75Å; Q436-M470 HydrophobicContact CB-CE 4.41Å
437	R	87.1	Confident	92.5	Very high	243 Å²	243	65.3 Å²	65.3	92%	0.917	34%	0.343	S	S	*	.	P	Polyproline II helix	trans	-63.6	134	170.8	-79.3	-174.8	164	-170.4	-6.1	110.7
438	L	91.8	Very high	92.5	Very high	81 Å²	81	65.6 Å²	65.6	42%	0.424	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-77.8	149.3	174.4	-57	-177.6	0	0	0	110.6	Q436 M470 Y471 T489	Q436-L438 PolarHBondContact O-N 2.75Å; L438-M470 HydrophobicContact CD2-CB 4.35Å; L438-Y471 HydrophobicContact CD1-CD1 3.64Å; L438-Y471 HydrophobicContact CD1-CD2 4.05Å; L438-Y471 HydrophobicContact CD1-CE1 4.29Å; L438-Y471 HydrophobicContact CD1-CG 3.49Å; L438-Y471 VanDerWaalsContact CD1-CG 3.49Å; L438-Y471 HydrophobicContact CD2-CG 4.44Å; L438-T489 HydrophobicContact CB-CG2 4.23Å; L438-T489 HydrophobicContact CD2-CG2 4.19Å
439	D	90.4	Very high	92.4	Very high	54 Å²	54	65.8 Å²	65.8	29%	0.289	35%	0.347	S	S	.	.			trans	-120.1	112.8	-174.4	-176	-17.2	0	0	0	109.8	S441 K442 T443	D439-S441 PolarHBondContact O-N 3.41Å; D439-S441 VanDerWaalsContact OD1-CB 3.31Å; D439-S441 WeakPolarHBondContact OD1-CB 3.42Å; D439-S441 PolarHBondContact OD1-N 2.62Å; D439-S441 PolarHBondContact OD1-OG 3.43Å; D439-S441 PolarHBondContact OD2-OG 2.83Å; D439-K442 HydrophobicContact CB-CB 4.41Å; D439-K442 HydrophobicContact CB-CD 4.33Å; D439-K442 PolarHBondContact O-N 3.17Å; D439-K442 VanDerWaalsContact O-N 3.09Å; D439-K442 IonicContact OD2-NZ 3.66Å; D439-K442 PolarHBondContact OD2-NZ 2.93Å; D439-T443 PolarHBondContact O-N 2.96Å; D439-T443 PolarHBondContact O-OG1 3.18Å
440	P	89.7	Confident	92.3	Very high	52 Å²	52	63.1 Å²	63.1	34%	0.338	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-56.9	-34	177.7	-26.2	35.4	0	0	0	113.3	K442 T443 E523	P440-K442 PolarHBondContact O-N 3.06Å; P440-K442 VanDerWaalsContact O-N 3.09Å; P440-T443 WeakPolarHBondContact O-CB 3.33Å; P440-T443 PolarHBondContact O-N 2.93Å; P440-E523 VanDerWaalsContact CB-CD 3.44Å; P440-E523 HydrophobicContact CB-CG 4.38Å; P440-E523 WeakPolarHBondContact CB-OE1 3.11Å; P440-E523 WeakPolarHBondContact CG-OE1 3.13Å
441	S	92.5	Very high	92	Very high	60 Å²	60	62.7 Å²	62.7	42%	0.42	35%	0.347	S	S	.	.	G	3₁₀ helix	trans	-67.1	-11.5	179.4	75.1	0	0	0	0	114.3	D439 Y496	D439-S441 PolarHBondContact O-N 3.41Å; D439-S441 VanDerWaalsContact OD1-CB 3.31Å; D439-S441 WeakPolarHBondContact OD1-CB 3.42Å; D439-S441 PolarHBondContact OD1-N 2.62Å; D439-S441 PolarHBondContact OD1-OG 3.43Å; D439-S441 PolarHBondContact OD2-OG 2.83Å; S441-Y496 WeakPolarHBondContact O-CE1 3.44Å
442	K	95.8	Very high	91.8	Very high	45 Å²	45	62.5 Å²	62.5	20%	0.196	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-117.1	16.2	175.7	-62.6	171	-174.3	59.9	0	112.1	D439 P440 F490 Y496	D439-K442 HydrophobicContact CB-CB 4.41Å; D439-K442 HydrophobicContact CB-CD 4.33Å; D439-K442 PolarHBondContact O-N 3.17Å; D439-K442 VanDerWaalsContact O-N 3.09Å; D439-K442 IonicContact OD2-NZ 3.66Å; D439-K442 PolarHBondContact OD2-NZ 2.93Å; P440-K442 PolarHBondContact O-N 3.06Å; P440-K442 VanDerWaalsContact O-N 3.09Å; K442-F490 VanDerWaalsContact CB-O 3.31Å; K442-F490 WeakPolarHBondContact CB-O 3.35Å; K442-F490 PolarHBondContact O-N 3.47Å; K442-Y496 VanDerWaalsContact C-CD2 3.47Å
443	T	97.3	Very high	91.9	Very high	9 Å²	9	56 Å²	56	6%	0.055	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	131.3	-178.9	-59.1	0	0	0	0	110.6	D439 P440 R487 V488 T489 Y496 Y521	D439-T443 PolarHBondContact O-N 2.96Å; D439-T443 PolarHBondContact O-OG1 3.18Å; P440-T443 WeakPolarHBondContact O-CB 3.33Å; P440-T443 PolarHBondContact O-N 2.93Å; T443-R487 HydrophobicContact CG2-CB 4.19Å; T443-V488 CarbonylContact C-O 3.47Å; T443-V488 WeakPolarHBondContact CA-O 3.38Å; T443-T489 WeakPolarHBondContact OG1-CB 3.41Å; T443-T489 WeakPolarHBondContact OG1-CG2 3.4Å; T443-T489 PolarHBondContact OG1-OG1 2.94Å; T443-Y496 WeakPolarHBondContact O-CE2 3.32Å; T443-Y521 HydrophobicContact CG2-CD1 4.48Å; T443-Y521 HydrophobicContact CG2-CG 4.15Å; T443-Y521 WeakPolarHBondContact O-CB 3.19Å; T443-Y521 PolarHBondContact O-N 3.44Å; T443-Y521 VanDerWaalsContact O-N 3.13Å
444	V	97.8	Very high	92.2	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	147.6	170	-62.3	0	0	0	0	110.6	V446 M462 R487 V488 F490 Y496 A499 V500 I518 D519	V444-V446 HydrophobicContact CG2-CG2 4.13Å; V444-M462 HydrophobicContact CG2-CE 3.79Å; V444-R487 VanDerWaalsContact O-CA 3.31Å; V444-R487 WeakPolarHBondContact O-CA 3.02Å; V444-V488 HydrophobicContact CG2-CB 3.94Å; V444-V488 PolarHBondContact N-O 2.99Å; V444-V488 PolarHBondContact O-N 2.93Å; V444-F490 HydrophobicContact CG1-CE2 4.13Å; V444-F490 HydrophobicContact CG2-CE2 3.91Å; V444-Y496 HydrophobicContact CG1-CD2 3.69Å; V444-Y496 HydrophobicContact CG1-CE2 3.8Å; V444-A499 HydrophobicContact CG1-CB 4.28Å; V444-V500 HydrophobicContact CG1-CG2 3.67Å; V444-I518 HydrophobicContact CB-CG2 3.76Å; V444-I518 HydrophobicContact CG1-CG2 3.99Å; V444-I518 HydrophobicContact CG2-CG2 3.9Å; V444-D519 WeakPolarHBondContact CA-O 3.48Å
445	F	97.6	Very high	92.8	Very high	68 Å²	68	47.9 Å²	47.9	30%	0.298	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	140	162.6	176.4	-102.6	0	0	0	109.1	S485 I518 D519	F445-S485 VanDerWaalsContact CE2-CB 3.48Å; F445-S485 VanDerWaalsContact CZ-CB 3.44Å; F445-I518 WeakPolarHBondContact O-CA 3.47Å; F445-D519 PolarHBondContact N-O 3.07Å; F445-D519 PolarHBondContact O-N 3.3Å
446	V	97.7	Very high	93.5	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	113.8	176.7	-165.9	0	0	0	0	109.5	V444 L449 L458 M462 S485 G486 V488 V516 Q517 I518	V444-V446 HydrophobicContact CG2-CG2 4.13Å; V446-L449 HydrophobicContact CB-CD2 4.23Å; V446-L449 HydrophobicContact CG1-CD2 3.57Å; V446-L449 HydrophobicContact CG1-CG 4.46Å; V446-L458 HydrophobicContact CG1-CD1 4.4Å; V446-M462 HydrophobicContact CG2-CE 4.04Å; V446-S485 CarbonylContact O-C 3.59Å; V446-S485 VanDerWaalsContact O-CA 3.22Å; V446-S485 WeakPolarHBondContact O-CA 3.45Å; V446-S485 WeakPolarHBondContact O-CB 3.38Å; V446-G486 PolarHBondContact N-O 2.93Å; V446-G486 PolarHBondContact O-N 3.17Å; V446-V488 HydrophobicContact CG2-CG2 3.93Å; V446-V516 HydrophobicContact CG1-CB 4.27Å; V446-V516 HydrophobicContact CG1-CG2 4.22Å; V446-Q517 CarbonylContact C-O 3.59Å; V446-Q517 VanDerWaalsContact CA-O 3.26Å; V446-Q517 WeakPolarHBondContact CA-O 3.5Å; V446-I518 HydrophobicContact CG1-CG1 4.42Å
447	G	95.5	Very high	94.2	Very high	7 Å²	7	42.5 Å²	42.5	7%	0.072	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	164	-179	0	0	0	0	0	113.9	L449 Q517	G447-L449 VanDerWaalsContact C-N 3.3Å; G447-L449 PolarHBondContact O-N 3.47Å; G447-Q517 PolarHBondContact N-O 3.26Å; G447-Q517 PolarHBondContact O-N 3.09Å
448	A	94.3	Very high	94.7	Very high	15 Å²	15	31 Å²	31	12%	0.124	18%	0.179	C	C	.	.	S	Bend	trans	60.1	31.7	179.3	0	0	0	0	0	114.7	A298 G484 K514	A298-A448 HydrophobicContact CB-CB 4.12Å; A448-G484 PolarHBondContact N-O 3.42Å; A448-G484 VanDerWaalsContact N-O 3.09Å; A448-K514 WeakPolarHBondContact O-CE 3.49Å
449	L	96	Very high	95	Very high	8 Å²	8	27.3 Å²	27.3	4%	0.042	16%	0.16	C	C	.	.			trans	-58.2	142.5	176.7	-64	-177.4	0	0	0	111.9	V446 G447 L453 L458 I474 G484 S485 V516	V446-L449 HydrophobicContact CB-CD2 4.23Å; V446-L449 HydrophobicContact CG1-CD2 3.57Å; V446-L449 HydrophobicContact CG1-CG 4.46Å; G447-L449 VanDerWaalsContact C-N 3.3Å; G447-L449 PolarHBondContact O-N 3.47Å; L449-L453 HydrophobicContact CB-CD1 4.46Å; L449-L453 HydrophobicContact CD2-CD1 4.1Å; L449-L458 HydrophobicContact CD1-CD2 4.04Å; L449-L458 HydrophobicContact CD2-CD1 4.04Å; L449-L458 HydrophobicContact CD2-CD2 4.44Å; L449-I474 HydrophobicContact CD1-CD1 3.78Å; L449-G484 PolarHBondContact N-O 3.28Å; L449-S485 VanDerWaalsContact CD1-C 3.48Å; L449-V516 HydrophobicContact CD2-CG1 4.11Å
450	H	93.4	Very high	95.4	Very high	37 Å²	37	26.7 Å²	26.7	17%	0.171	16%	0.161	C	C	.	.			trans	-72.9	139.8	172.1	-161.9	-101.6	0	0	0	110.9	F202 M452 L453 F512 K514	F202-H450 AromaticContact CD1-CD2 3.89Å; F202-H450 HydrophobicContact CE1-CB 4.48Å; F202-H450 AromaticContact CE1-CD2 3.42Å; F202-H450 VanDerWaalsContact CE1-CD2 3.42Å; F202-H450 WeakPolarHBondContact CE1-CD2 3.14Å; H450-M452 PolarHBondContact O-N 2.85Å; H450-L453 HydrophobicContact CB-CD1 4.32Å; H450-L453 HydrophobicContact CB-CG 4.35Å; H450-L453 WeakPolarHBondContact O-CB 3.3Å; H450-L453 PolarHBondContact O-N 3.39Å; H450-F512 HydrophobicContact CB-CD2 3.8Å; H450-F512 HydrophobicContact CB-CE1 4.34Å; H450-F512 HydrophobicContact CB-CE2 3.51Å; H450-F512 HydrophobicContact CB-CG 4.34Å; H450-F512 HydrophobicContact CB-CZ 3.82Å; H450-F512 AromaticContact CD2-CD2 3.76Å; H450-F512 AromaticContact CD2-CG 3.84Å; H450-F512 AromaticContact CE1-CD1 3.59Å; H450-F512 AromaticContact CE1-CG 3.48Å; H450-F512 VanDerWaalsContact CE1-CG 3.48Å; H450-F512 WeakPolarHBondContact CE1-CG 3.44Å; H450-F512 AromaticContact CG-CD1 3.92Å; H450-F512 AromaticContact CG-CD2 3.49Å; H450-F512 VanDerWaalsContact CG-CD2 3.49Å; H450-F512 AromaticContact CG-CE2 3.72Å; H450-F512 AromaticContact CG-CG 3.61Å; H450-F512 AromaticContact ND1-CD1 3.27Å; H450-F512 VanDerWaalsContact ND1-CD1 3.27Å; H450-F512 WeakPolarHBondContact ND1-CD1 3.49Å; H450-F512 AromaticContact ND1-CD2 3.74Å; H450-F512 AromaticContact ND1-CE1 3.59Å; H450-F512 AromaticContact ND1-CG 3.36Å; H450-F512 WeakPolarHBondContact ND1-CG 3.42Å; H450-F512 AromaticContact ND1-CZ 3.97Å; H450-F512 AromaticContact NE2-CG 3.79Å; H450-K514 HydrophobicContact CB-CB 4.26Å; H450-K514 HydrophobicContact CB-CG 4.32Å
451	G	90.6	Very high	95.8	Very high	55 Å²	55	24.3 Å²	24.3	57%	0.567	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-7.9	-177.7	0	0	0	0	0	115.6
452	M	90	Very high	96.1	Very high	69 Å²	69	21.6 Å²	21.6	34%	0.34	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92	-9.1	174	-58.1	-178.4	83.1	0	0	113.8	R314 H450 K511 F512	R314-M452 PolarHBondContact NH2-O 2.66Å; H450-M452 PolarHBondContact O-N 2.85Å; M452-K511 HydrophobicContact CE-CB 4.1Å; M452-K511 HydrophobicContact CE-CD 3.77Å; M452-K511 HydrophobicContact SD-CB 4.17Å; M452-F512 HydrophobicContact CB-CD1 4.23Å; M452-F512 HydrophobicContact CB-CE1 3.9Å; M452-F512 HydrophobicContact SD-CD1 3.89Å; M452-F512 HydrophobicContact SD-CE1 4.45Å
453	L	94.6	Very high	96.1	Very high	4 Å²	4	21.7 Å²	21.7	2%	0.021	13%	0.128	C	C	.	.			trans	-80	123.9	174.7	-66.8	171.7	0	0	0	110	L311 L449 H450 A457 I461 I507 F512	L311-L453 HydrophobicContact CD1-CD2 4Å; L311-L453 HydrophobicContact CD2-CD2 4.02Å; L449-L453 HydrophobicContact CB-CD1 4.46Å; L449-L453 HydrophobicContact CD2-CD1 4.1Å; H450-L453 HydrophobicContact CB-CD1 4.32Å; H450-L453 HydrophobicContact CB-CG 4.35Å; H450-L453 WeakPolarHBondContact O-CB 3.3Å; H450-L453 PolarHBondContact O-N 3.39Å; L453-A457 HydrophobicContact CD2-CB 4.05Å; L453-I461 HydrophobicContact CD2-CD1 3.7Å; L453-I507 HydrophobicContact CD1-CD1 3.85Å; L453-F512 HydrophobicContact CD2-CZ 4.01Å; L453-F512 HydrophobicContact CG-CZ 4.05Å
454	N	95.4	Very high	96.2	Very high	4 Å²	4	25.6 Å²	25.6	2%	0.021	15%	0.149	C	C	.	.			trans	-95.9	173.9	162.2	69.3	-11.6	0	0	0	110.1	W423 D427 E456 A457 L458	W423-N454 HydrophobicContact CH2-CB 4.23Å; D427-N454 HydrophobicContact CB-CB 3.69Å; D427-N454 WeakPolarHBondContact O-CB 3.23Å; D427-N454 PolarHBondContact OD1-ND2 2.88Å; D427-N454 VanDerWaalsContact OD1-ND2 3.14Å; N454-E456 VanDerWaalsContact C-N 3.28Å; N454-E456 PolarHBondContact O-N 2.86Å; N454-A457 PolarHBondContact O-N 2.86Å; N454-A457 WeakPolarHBondContact OD1-CB 3.08Å; N454-A457 PolarHBondContact OD1-N 3.42Å; N454-L458 PolarHBondContact O-N 3Å
455	A	97.6	Very high	96.2	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-60.6	-36.1	-179.5	0	0	0	0	0	112.9	D427 L458 A459 A472 I474	D427-A455 WeakPolarHBondContact O-CB 3.26Å; D427-A455 PolarHBondContact O-N 3.03Å; A455-L458 PolarHBondContact O-N 2.92Å; A455-A459 WeakPolarHBondContact O-CB 3.46Å; A455-A459 PolarHBondContact O-N 2.93Å; A455-A472 HydrophobicContact CB-CB 4.45Å; A455-A472 WeakPolarHBondContact CB-O 3.31Å; A455-A472 WeakPolarHBondContact O-CB 3.47Å; A455-I474 HydrophobicContact CB-CG1 4.21Å
456	E	96.3	Very high	96.2	Very high	81 Å²	81	24 Å²	24	38%	0.379	14%	0.143	S	C	.	.	H	α-helix	trans	-65.5	-47	177.3	-179.3	175.2	-143.5	0	0	112.2	P312 Y430 N454 L458 A459 S460	P312-E456 HydrophobicContact CB-CG 4.34Å; Y430-E456 HydrophobicContact CD2-CB 3.96Å; Y430-E456 HydrophobicContact CD2-CG 4.02Å; Y430-E456 HydrophobicContact CE2-CG 4.29Å; N454-E456 VanDerWaalsContact C-N 3.28Å; N454-E456 PolarHBondContact O-N 2.86Å; E456-L458 VanDerWaalsContact C-N 3.35Å; E456-L458 PolarHBondContact O-N 3.47Å; E456-A459 PolarHBondContact O-N 3.37Å; E456-S460 PolarHBondContact O-N 3.37Å
457	A	96.9	Very high	96.2	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-59.9	-44.5	174.2	0	0	0	0	0	111.7	L311 L453 N454 A459 S460 I461	L311-A457 HydrophobicContact CB-CB 4.43Å; L311-A457 HydrophobicContact CD1-CB 4.38Å; L311-A457 HydrophobicContact CD2-CB 4.24Å; L453-A457 HydrophobicContact CD2-CB 4.05Å; N454-A457 PolarHBondContact O-N 2.86Å; N454-A457 WeakPolarHBondContact OD1-CB 3.08Å; N454-A457 PolarHBondContact OD1-N 3.42Å; A457-A459 VanDerWaalsContact C-N 3.34Å; A457-A459 PolarHBondContact O-N 2.73Å; A457-S460 PolarHBondContact O-N 3.21Å; A457-I461 WeakPolarHBondContact O-CD1 3.37Å; A457-I461 VanDerWaalsContact O-CG1 3.22Å; A457-I461 WeakPolarHBondContact O-CG1 3.15Å; A457-I461 PolarHBondContact O-N 3.44Å
458	L	98.2	Very high	96.2	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.005	16%	0.16	C	C	.	.	H	α-helix	trans	-61.4	-41.7	175.7	-179.6	60.3	0	0	0	111.7	V446 L449 N454 A455 E456 M462 A472 I474 V488	V446-L458 HydrophobicContact CG1-CD1 4.4Å; L449-L458 HydrophobicContact CD1-CD2 4.04Å; L449-L458 HydrophobicContact CD2-CD1 4.04Å; L449-L458 HydrophobicContact CD2-CD2 4.44Å; N454-L458 PolarHBondContact O-N 3Å; A455-L458 PolarHBondContact O-N 2.92Å; E456-L458 VanDerWaalsContact C-N 3.35Å; E456-L458 PolarHBondContact O-N 3.47Å; L458-M462 HydrophobicContact CD1-CG 3.9Å; L458-M462 HydrophobicContact CG-CG 4.46Å; L458-M462 VanDerWaalsContact O-CB 3.3Å; L458-M462 WeakPolarHBondContact O-CB 3.5Å; L458-M462 WeakPolarHBondContact O-CG 3.33Å; L458-M462 PolarHBondContact O-N 3.4Å; L458-M462 VanDerWaalsContact O-N 3.08Å; L458-A472 HydrophobicContact CD2-CB 4.47Å; L458-A472 HydrophobicContact CG-CB 4.43Å; L458-I474 HydrophobicContact CD2-CD1 4.05Å; L458-V488 HydrophobicContact CD1-CG2 4.34Å; L458-V488 HydrophobicContact CD2-CG2 3.82Å; L458-V488 HydrophobicContact CG-CG2 3.82Å
459	A	98.1	Very high	96.4	Very high	4 Å²	4	25 Å²	25	3%	0.033	15%	0.154	C	C	.	.	H	α-helix	trans	-64.1	-42	176.4	0	0	0	0	0	112.5	Y430 A455 E456 A457 N463 V469 A472	Y430-A459 HydrophobicContact CD1-CB 3.29Å; Y430-A459 HydrophobicContact CE1-CB 3.61Å; Y430-A459 HydrophobicContact CG-CB 3.84Å; A455-A459 WeakPolarHBondContact O-CB 3.46Å; A455-A459 PolarHBondContact O-N 2.93Å; E456-A459 PolarHBondContact O-N 3.37Å; A457-A459 VanDerWaalsContact C-N 3.34Å; A457-A459 PolarHBondContact O-N 2.73Å; A459-N463 WeakPolarHBondContact O-CB 3.29Å; A459-N463 PolarHBondContact O-N 2.87Å; A459-V469 HydrophobicContact CB-CG1 4.02Å; A459-A472 HydrophobicContact CB-CB 3.82Å
460	S	97.7	Very high	96.4	Very high	42 Å²	42	25.4 Å²	25.4	29%	0.294	16%	0.156	S	C	.	.	H	α-helix	trans	-61.5	-56.6	176.2	-163.7	0	0	0	0	110.8	E456 A457 M462 N463 D464	E456-S460 PolarHBondContact O-N 3.37Å; A457-S460 PolarHBondContact O-N 3.21Å; S460-M462 VanDerWaalsContact C-N 3.28Å; S460-M462 PolarHBondContact O-N 2.96Å; S460-N463 CarbonylContact O-C 3.56Å; S460-N463 WeakPolarHBondContact O-CA 3.43Å; S460-N463 WeakPolarHBondContact O-CB 3.39Å; S460-N463 PolarHBondContact O-N 2.94Å; S460-D464 PolarHBondContact O-N 2.86Å
461	I	98.2	Very high	96.6	Very high	2 Å²	2	25 Å²	25	1%	0.01	15%	0.153	C	C	.	.	H	α-helix	trans	-53.5	-45.9	-178.7	-67.4	164.7	0	0	0	111.3	W307 L311 L453 A457 D464 L465 I507	W307-I461 HydrophobicContact CB-CG2 4.03Å; W307-I461 HydrophobicContact CD2-CB 4.37Å; W307-I461 HydrophobicContact CD2-CG1 3.75Å; W307-I461 HydrophobicContact CD2-CG2 4.16Å; W307-I461 HydrophobicContact CE3-CD1 4.29Å; W307-I461 HydrophobicContact CE3-CG1 3.95Å; W307-I461 HydrophobicContact CG-CB 4.42Å; W307-I461 HydrophobicContact CG-CG1 4.31Å; W307-I461 HydrophobicContact CG-CG2 3.87Å; W307-I461 HydrophobicContact CH2-CD1 4.49Å; W307-I461 HydrophobicContact CH2-CG1 4.02Å; W307-I461 HydrophobicContact CZ2-CG1 3.82Å; W307-I461 HydrophobicContact CZ3-CD1 4.26Å; W307-I461 HydrophobicContact CZ3-CG1 4.08Å; L311-I461 HydrophobicContact CD2-CD1 3.99Å; L453-I461 HydrophobicContact CD2-CD1 3.7Å; A457-I461 WeakPolarHBondContact O-CD1 3.37Å; A457-I461 VanDerWaalsContact O-CG1 3.22Å; A457-I461 WeakPolarHBondContact O-CG1 3.15Å; A457-I461 PolarHBondContact O-N 3.44Å; I461-D464 PolarHBondContact O-N 2.84Å; I461-L465 HydrophobicContact CG2-CD1 4.2Å; I461-L465 WeakPolarHBondContact O-CG 3.23Å; I461-L465 PolarHBondContact O-N 3.42Å; I461-L465 VanDerWaalsContact O-N 3.13Å; I461-I507 HydrophobicContact CD1-CD1 4.12Å; I461-I507 HydrophobicContact CD1-CG2 3.91Å; I461-I507 HydrophobicContact CG2-CD1 4.25Å; I461-I507 HydrophobicContact CG2-CG1 4.21Å
462	M	98.3	Very high	97	Very high	3 Å²	3	22.4 Å²	22.4	2%	0.015	13%	0.126	C	C	.	.	H	α-helix	trans	-74	-29.9	-178.8	-65.5	-76	-78.1	0	0	112.4	V444 V446 L458 S460 F466 V469 V488 F490 I518	V444-M462 HydrophobicContact CG2-CE 3.79Å; V446-M462 HydrophobicContact CG2-CE 4.04Å; L458-M462 HydrophobicContact CD1-CG 3.9Å; L458-M462 HydrophobicContact CG-CG 4.46Å; L458-M462 VanDerWaalsContact O-CB 3.3Å; L458-M462 WeakPolarHBondContact O-CB 3.5Å; L458-M462 WeakPolarHBondContact O-CG 3.33Å; L458-M462 PolarHBondContact O-N 3.4Å; L458-M462 VanDerWaalsContact O-N 3.08Å; S460-M462 VanDerWaalsContact C-N 3.28Å; S460-M462 PolarHBondContact O-N 2.96Å; M462-F466 HydrophobicContact CE-CD2 4.19Å; M462-F466 HydrophobicContact CE-CE2 4.18Å; M462-F466 WeakPolarHBondContact O-CB 3.35Å; M462-F466 PolarHBondContact O-N 3.35Å; M462-F466 HydrophobicContact SD-CD2 3.95Å; M462-F466 HydrophobicContact SD-CE2 3.71Å; M462-V469 HydrophobicContact CB-CG2 3.9Å; M462-V488 HydrophobicContact CB-CG1 4.1Å; M462-V488 HydrophobicContact CE-CB 4.16Å; M462-V488 HydrophobicContact CE-CG1 4.25Å; M462-V488 HydrophobicContact CE-CG2 4.19Å; M462-V488 HydrophobicContact CG-CG1 4.41Å; M462-V488 HydrophobicContact CG-CG2 4.23Å; M462-F490 HydrophobicContact CE-CZ 4.08Å; M462-I518 HydrophobicContact CE-CD1 3.92Å; M462-I518 HydrophobicContact CE-CG1 4.43Å; M462-I518 HydrophobicContact SD-CD1 3.95Å
463	N	97.8	Very high	97.4	Very high	46 Å²	46	19.1 Å²	19.1	25%	0.246	11%	0.11	C	C	.	.	H	α-helix	trans	-71	-38	172.4	-179.7	87.2	0	0	0	111.7	R432 A459 S460 G467 G468 V469	R432-N463 PolarHBondContact NH1-OD1 2.97Å; A459-N463 WeakPolarHBondContact O-CB 3.29Å; A459-N463 PolarHBondContact O-N 2.87Å; S460-N463 CarbonylContact O-C 3.56Å; S460-N463 WeakPolarHBondContact O-CA 3.43Å; S460-N463 WeakPolarHBondContact O-CB 3.39Å; S460-N463 PolarHBondContact O-N 2.94Å; N463-G467 WeakPolarHBondContact O-CA 3.47Å; N463-G467 PolarHBondContact O-N 3.26Å; N463-G468 PolarHBondContact OD1-N 2.87Å; N463-V469 HydrophobicContact CB-CB 4.16Å; N463-V469 HydrophobicContact CB-CG2 3.96Å
464	D	97.9	Very high	97.6	Very high	92 Å²	92	19.4 Å²	19.4	49%	0.492	11%	0.111	S	C	.	.	H	α-helix	trans	-68.2	-40.3	178.7	-57.3	-23.5	0	0	0	111.2	W307 S460 I461	W307-D464 PolarHBondContact NE1-OD2 3.01Å; S460-D464 PolarHBondContact O-N 2.86Å; I461-D464 PolarHBondContact O-N 2.84Å
465	L	97.9	Very high	97.6	Very high	23 Å²	23	20.1 Å²	20.1	12%	0.12	12%	0.116	C	C	.	.	H	α-helix	trans	-76.8	-41.4	179.1	-70.4	174.3	0	0	0	113.8	F305 W307 I461 K498 V505	F305-L465 HydrophobicContact CB-CD2 4.29Å; F305-L465 HydrophobicContact CD1-CD2 4.49Å; W307-L465 HydrophobicContact CB-CD1 4.06Å; W307-L465 HydrophobicContact CB-CD2 4.17Å; W307-L465 HydrophobicContact CB-CG 4.18Å; I461-L465 HydrophobicContact CG2-CD1 4.2Å; I461-L465 WeakPolarHBondContact O-CG 3.23Å; I461-L465 PolarHBondContact O-N 3.42Å; I461-L465 VanDerWaalsContact O-N 3.13Å; L465-K498 PolarHBondContact O-NZ 3.43Å; L465-V505 HydrophobicContact CD1-CB 4.43Å; L465-V505 HydrophobicContact CD1-CG1 3.47Å; L465-V505 VanDerWaalsContact CD1-CG1 3.47Å; L465-V505 HydrophobicContact CD1-CG2 4.04Å
466	F	98.3	Very high	97.6	Very high	12 Å²	12	22.1 Å²	22.1	5%	0.053	13%	0.128	C	C	.	.	H	α-helix	trans	-123.3	-18.4	-166.8	-51.4	-63.4	0	0	0	114.3	M462 F490 S495 K498 A499 A502 V505 I518	M462-F466 HydrophobicContact CE-CD2 4.19Å; M462-F466 HydrophobicContact CE-CE2 4.18Å; M462-F466 WeakPolarHBondContact O-CB 3.35Å; M462-F466 PolarHBondContact O-N 3.35Å; M462-F466 HydrophobicContact SD-CD2 3.95Å; M462-F466 HydrophobicContact SD-CE2 3.71Å; F466-F490 HydrophobicContact CB-CE1 3.83Å; F466-F490 HydrophobicContact CB-CZ 4.08Å; F466-F490 HydrophobicContact CD2-CZ 4.28Å; F466-F490 HydrophobicContact CG-CZ 4.47Å; F466-S495 WeakPolarHBondContact O-CB 3.39Å; F466-S495 PolarHBondContact O-OG 3.01Å; F466-K498 HydrophobicContact CD1-CB 4.16Å; F466-K498 HydrophobicContact CD1-CD 3.85Å; F466-K498 HydrophobicContact CD1-CG 3.78Å; F466-K498 HydrophobicContact CE1-CG 4.22Å; F466-A499 HydrophobicContact CB-CB 4.5Å; F466-A499 HydrophobicContact CD1-CB 4.1Å; F466-A499 HydrophobicContact CD2-CB 3.79Å; F466-A499 HydrophobicContact CE1-CB 4.3Å; F466-A499 HydrophobicContact CE2-CB 3.99Å; F466-A499 HydrophobicContact CG-CB 3.86Å; F466-A499 HydrophobicContact CZ-CB 4.24Å; F466-A502 HydrophobicContact CE1-CB 3.66Å; F466-A502 HydrophobicContact CZ-CB 3.65Å; F466-V505 HydrophobicContact CE2-CG2 4.28Å; F466-V505 HydrophobicContact CZ-CG2 3.96Å; F466-I518 HydrophobicContact CE2-CD1 3.84Å; F466-I518 HydrophobicContact CZ-CD1 4.07Å
467	G	97.6	Very high	97.5	Very high	24 Å²	24	19.7 Å²	19.7	25%	0.247	12%	0.117	C	C	.	.			trans	73.5	159.3	-177.6	0	0	0	0	0	114.2	N463 V469 F490 S495	N463-G467 WeakPolarHBondContact O-CA 3.47Å; N463-G467 PolarHBondContact O-N 3.26Å; G467-V469 PolarHBondContact O-N 2.87Å; G467-F490 VanDerWaalsContact O-CD1 3.29Å; G467-F490 WeakPolarHBondContact O-CD1 3.4Å; G467-S495 VanDerWaalsContact O-CB 3.24Å; G467-S495 WeakPolarHBondContact O-CB 3.22Å; G467-S495 PolarHBondContact O-OG 3.41Å
468	G	95.8	Very high	97.3	Very high	17 Å²	17	26.6 Å²	26.6	18%	0.175	15%	0.147	C	C	.	.			trans	71.5	24.9	163.6	0	0	0	0	0	116.2	N463 M470 F490 N491	N463-G468 PolarHBondContact OD1-N 2.87Å; G468-M470 PolarHBondContact O-N 3.28Å; G468-F490 CarbonylContact O-C 3.59Å; G468-F490 WeakPolarHBondContact O-CA 3.38Å; G468-N491 WeakPolarHBondContact CA-OD1 3.45Å; G468-N491 PolarHBondContact O-N 3.36Å; G468-N491 PolarHBondContact O-OD1 3.06Å
469	V	97.7	Very high	97.2	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.006	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	128.5	174.6	177.1	0	0	0	0	110.5	R432 A459 M462 N463 G467 V488 F490	R432-V469 VanDerWaalsContact CD-O 3.25Å; R432-V469 WeakPolarHBondContact CD-O 3.44Å; A459-V469 HydrophobicContact CB-CG1 4.02Å; M462-V469 HydrophobicContact CB-CG2 3.9Å; N463-V469 HydrophobicContact CB-CB 4.16Å; N463-V469 HydrophobicContact CB-CG2 3.96Å; G467-V469 PolarHBondContact O-N 2.87Å; V469-V488 HydrophobicContact CG1-CG1 3.82Å; V469-V488 HydrophobicContact CG2-CG1 3.9Å; V469-F490 HydrophobicContact CG2-CD1 3.93Å; V469-F490 HydrophobicContact CG2-CE1 3.62Å
470	M	96.9	Very high	97.1	Very high	16 Å²	16	34 Å²	34	8%	0.079	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	-34	176.1	-68	-54.4	-52	0	0	113.2	R432 C433 Q436 L438 G468 T489 N491	R432-M470 HydrophobicContact CB-CE 4.31Å; R432-M470 WeakPolarHBondContact CB-O 3.47Å; R432-M470 PolarHBondContact N-O 3.05Å; C433-M470 HydrophobicContact CB-CE 3.64Å; Q436-M470 HydrophobicContact CB-CE 4.41Å; L438-M470 HydrophobicContact CD2-CB 4.35Å; G468-M470 PolarHBondContact O-N 3.28Å; M470-T489 PolarHBondContact N-O 3.07Å; M470-N491 HydrophobicContact CG-CB 3.61Å; M470-N491 HydrophobicContact SD-CB 3.92Å
471	Y	97.8	Very high	97	Very high	29 Å²	29	33.1 Å²	33.1	11%	0.114	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	144.1	-178.2	167.8	-104.4	0	0	0	110	N429 Y430 V431 L438 G473 V488 T489	N429-Y471 HydrophobicContact CB-CE2 4.44Å; N429-Y471 WeakPolarHBondContact OD1-CE2 3.16Å; N429-Y471 PolarHBondContact OD1-OH 3.39Å; Y430-Y471 WeakPolarHBondContact O-CA 3.2Å; Y430-Y471 WeakPolarHBondContact O-CD2 3.46Å; V431-Y471 HydrophobicContact CG2-CD2 3.91Å; V431-Y471 HydrophobicContact CG2-CE2 4.36Å; L438-Y471 HydrophobicContact CD1-CD1 3.64Å; L438-Y471 HydrophobicContact CD1-CD2 4.05Å; L438-Y471 HydrophobicContact CD1-CE1 4.29Å; L438-Y471 HydrophobicContact CD1-CG 3.49Å; L438-Y471 VanDerWaalsContact CD1-CG 3.49Å; L438-Y471 HydrophobicContact CD2-CG 4.44Å; Y471-G473 WeakPolarHBondContact OH-CA 3.39Å; Y471-V488 WeakPolarHBondContact O-CA 3.47Å; Y471-T489 PolarHBondContact N-O 3.24Å; Y471-T489 PolarHBondContact O-N 2.81Å
472	A	98.3	Very high	96.9	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	142.5	158.8	0	0	0	0	0	109.5	Y430 A455 L458 A459 R487 V488	Y430-A472 PolarHBondContact N-O 2.88Å; Y430-A472 PolarHBondContact O-N 2.85Å; A455-A472 HydrophobicContact CB-CB 4.45Å; A455-A472 WeakPolarHBondContact CB-O 3.31Å; A455-A472 WeakPolarHBondContact O-CB 3.47Å; L458-A472 HydrophobicContact CD2-CB 4.47Å; L458-A472 HydrophobicContact CG-CB 4.43Å; A459-A472 HydrophobicContact CB-CB 3.82Å; A472-R487 CarbonylContact C-O 3.56Å; A472-R487 VanDerWaalsContact CA-O 3.3Å; A472-R487 WeakPolarHBondContact CA-O 3.47Å; A472-V488 HydrophobicContact CB-CG2 4.16Å
473	G	97.7	Very high	96.7	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	140.9	173	0	0	0	0	0	110.4	S428 Y471 G486 R487	S428-G473 WeakPolarHBondContact O-CA 3.25Å; Y471-G473 WeakPolarHBondContact OH-CA 3.39Å; G473-G486 CarbonylContact O-C 3.58Å; G473-G486 WeakPolarHBondContact O-CA 3.22Å; G473-R487 PolarHBondContact N-O 3.26Å; G473-R487 PolarHBondContact O-N 3.28Å
474	I	98.3	Very high	96.5	Very high	10 Å²	10	34.4 Å²	34.4	5%	0.051	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	129.6	164.8	-53.4	-58.5	0	0	0	107	W423 S428 L449 A455 L458 P482	W423-I474 HydrophobicContact CZ2-CG1 4.46Å; S428-I474 PolarHBondContact O-N 2.75Å; L449-I474 HydrophobicContact CD1-CD1 3.78Å; A455-I474 HydrophobicContact CB-CG1 4.21Å; L458-I474 HydrophobicContact CD2-CD1 4.05Å; I474-P482 HydrophobicContact CG2-CB 3.72Å; I474-P482 HydrophobicContact CG2-CG 3.96Å
475	D	96.6	Very high	96.4	Very high	20 Å²	20	30.3 Å²	30.3	11%	0.107	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	139.3	175.8	-58.9	-44	0	0	0	109.6	P482 I483 S485 G486 R487	D475-P482 WeakPolarHBondContact O-CA 3.33Å; D475-I483 HydrophobicContact CB-CD1 4Å; D475-I483 HydrophobicContact CB-CG1 3.96Å; D475-I483 PolarHBondContact O-N 2.78Å; D475-S485 WeakPolarHBondContact CB-OG 3.45Å; D475-S485 PolarHBondContact N-O 2.78Å; D475-S485 PolarHBondContact OD2-OG 3.25Å; D475-G486 WeakPolarHBondContact OD2-CA 3.31Å; D475-G486 PolarHBondContact OD2-N 3.26Å; D475-R487 IonicContact OD1-CZ 3.04Å; D475-R487 VanDerWaalsContact OD1-CZ 3.25Å; D475-R487 IonicContact OD1-NE 3.56Å; D475-R487 PolarHBondContact OD1-NE 3.04Å; D475-R487 IonicContact OD1-NH2 3.26Å; D475-R487 PolarHBondContact OD1-NH2 3.17Å
476	T	96.6	Very high	96.4	Very high	41 Å²	41	29.2 Å²	29.2	25%	0.252	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	152.7	-172.7	62.5	0	0	0	0	113.3	Y481	T476-Y481 CarbonylContact C-O 3.56Å; T476-Y481 WeakPolarHBondContact CA-O 3.33Å; T476-Y481 WeakPolarHBondContact CB-O 3.13Å
477	D	94.3	Very high	96.4	Very high	30 Å²	30	31.7 Å²	31.7	16%	0.16	16%	0.163	C	C	.	.			trans	-70.4	179.8	169.5	80.8	-9.1	0	0	0	112.7	K324 H479 K480 Y481 I483	K324-D477 WeakPolarHBondContact CE-OD2 3.19Å; K324-D477 IonicContact NZ-OD2 2.73Å; K324-D477 PolarHBondContact NZ-OD2 3.33Å; D477-H479 PolarHBondContact O-N 2.87Å; D477-H479 VanDerWaalsContact O-N 3.11Å; D477-H479 WeakPolarHBondContact OD1-CA 3.24Å; D477-H479 WeakPolarHBondContact OD1-CB 3.29Å; D477-H479 IonicContact OD1-CG 3.07Å; D477-H479 PolarHBondContact OD1-N 3.11Å; D477-H479 IonicContact OD1-ND1 2.75Å; D477-H479 IonicContact OD2-CE1 2.8Å; D477-H479 IonicContact OD2-CG 3.44Å; D477-H479 IonicContact OD2-ND1 2.85Å; D477-H479 PolarHBondContact OD2-ND1 2.88Å; D477-K480 WeakPolarHBondContact O-CA 3.3Å; D477-K480 PolarHBondContact O-N 2.96Å; D477-K480 PolarHBondContact OD1-N 3.32Å; D477-Y481 PolarHBondContact N-O 2.94Å; D477-Y481 WeakPolarHBondContact OD1-CB 3.42Å; D477-Y481 PolarHBondContact OD1-N 2.8Å; D477-I483 HydrophobicContact CB-CG2 4.03Å
478	K	94.2	Very high	96.4	Very high	146 Å²	146	30.6 Å²	30.6	64%	0.635	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56	-22.2	175.6	67.4	-170.7	179.2	-171.1	0	114.9	K480	K478-K480 VanDerWaalsContact C-N 3.31Å
479	H	95.1	Very high	96.5	Very high	43 Å²	43	30 Å²	30	20%	0.199	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	4.2	176.1	-42.6	108.2	0	0	0	112.4	S322 K324 E352 D477 Y481	S322-H479 WeakPolarHBondContact CB-O 3.39Å; S322-H479 PolarHBondContact OG-O 3.01Å; K324-H479 HydrophobicContact CB-CB 4.06Å; E352-H479 IonicContact OE1-CE1 3Å; D477-H479 PolarHBondContact O-N 2.87Å; D477-H479 VanDerWaalsContact O-N 3.11Å; D477-H479 WeakPolarHBondContact OD1-CA 3.24Å; D477-H479 WeakPolarHBondContact OD1-CB 3.29Å; D477-H479 IonicContact OD1-CG 3.07Å; D477-H479 PolarHBondContact OD1-N 3.11Å; D477-H479 IonicContact OD1-ND1 2.75Å; D477-H479 IonicContact OD2-CE1 2.8Å; D477-H479 IonicContact OD2-CG 3.44Å; D477-H479 IonicContact OD2-ND1 2.85Å; D477-H479 PolarHBondContact OD2-ND1 2.88Å; H479-Y481 VanDerWaalsContact C-N 3.3Å
480	K	96.1	Very high	96.5	Very high	116 Å²	116	30.1 Å²	30.1	50%	0.504	15%	0.145	S	C	.	.	S	Bend	trans	64.4	31.2	-173.3	-53.9	171.6	-177.9	174.8	0	113	I425 D477 K478	I425-K480 HydrophobicContact CD1-CB 4.43Å; I425-K480 HydrophobicContact CD1-CD 3.82Å; I425-K480 HydrophobicContact CG1-CB 4.15Å; I425-K480 HydrophobicContact CG1-CD 4.25Å; I425-K480 HydrophobicContact CG2-CD 4.02Å; D477-K480 WeakPolarHBondContact O-CA 3.3Å; D477-K480 PolarHBondContact O-N 2.96Å; D477-K480 PolarHBondContact OD1-N 3.32Å; K478-K480 VanDerWaalsContact C-N 3.31Å
481	Y	96.3	Very high	96.5	Very high	25 Å²	25	33 Å²	33	10%	0.098	16%	0.161	C	C	.	.			trans	-101.3	138.2	177.4	-160.2	-86.4	0	0	0	111.8	K324 F326 Y375 W423 T476 D477 H479	K324-Y481 HydrophobicContact CB-CD2 3.69Å; K324-Y481 HydrophobicContact CB-CE2 4.49Å; K324-Y481 HydrophobicContact CB-CG 3.94Å; K324-Y481 HydrophobicContact CD-CD1 3.87Å; K324-Y481 HydrophobicContact CD-CD2 4.13Å; K324-Y481 HydrophobicContact CD-CG 3.63Å; K324-Y481 HydrophobicContact CG-CD1 4.25Å; K324-Y481 HydrophobicContact CG-CD2 3.66Å; K324-Y481 HydrophobicContact CG-CE2 4.15Å; K324-Y481 HydrophobicContact CG-CG 3.72Å; K324-Y481 WeakPolarHBondContact O-CD2 3.42Å; K324-Y481 VanDerWaalsContact O-CE2 3.28Å; K324-Y481 WeakPolarHBondContact O-CE2 3.27Å; F326-Y481 VanDerWaalsContact CB-OH 3.31Å; F326-Y481 WeakPolarHBondContact CB-OH 3.44Å; Y375-Y481 HydrophobicContact CD1-CE1 4.23Å; Y375-Y481 HydrophobicContact CE1-CD1 4.42Å; Y375-Y481 AromaticContact CE1-CE1 3.66Å; Y375-Y481 HydrophobicContact CE1-CE1 3.66Å; W423-Y481 HydrophobicContact CB-CD2 3.74Å; W423-Y481 HydrophobicContact CB-CE2 3.66Å; T476-Y481 CarbonylContact C-O 3.56Å; T476-Y481 WeakPolarHBondContact CA-O 3.33Å; T476-Y481 WeakPolarHBondContact CB-O 3.13Å; D477-Y481 PolarHBondContact N-O 2.94Å; D477-Y481 WeakPolarHBondContact OD1-CB 3.42Å; D477-Y481 PolarHBondContact OD1-N 2.8Å; H479-Y481 VanDerWaalsContact C-N 3.3Å
482	P	96.4	Very high	96.4	Very high	26 Å²	26	33.8 Å²	33.8	17%	0.169	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	138.6	-177.7	-29.5	36.7	0	0	0	115.4	W423 I474 D475	W423-P482 HydrophobicContact CD2-CG 3.41Å; W423-P482 VanDerWaalsContact CD2-CG 3.41Å; W423-P482 HydrophobicContact CE3-CG 3.64Å; W423-P482 HydrophobicContact CG-CG 4Å; W423-P482 HydrophobicContact CH2-CG 3.74Å; W423-P482 HydrophobicContact CZ2-CG 3.53Å; W423-P482 HydrophobicContact CZ3-CG 3.79Å; I474-P482 HydrophobicContact CG2-CB 3.72Å; I474-P482 HydrophobicContact CG2-CG 3.96Å; D475-P482 WeakPolarHBondContact O-CA 3.33Å
483	I	92.4	Very high	96.3	Very high	34 Å²	34	37.5 Å²	37.5	17%	0.174	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	4.8	177.2	68.5	175.7	0	0	0	114.5	T199 D475 D477	T199-I483 PolarHBondContact OG1-O 3.5Å; D475-I483 HydrophobicContact CB-CD1 4Å; D475-I483 HydrophobicContact CB-CG1 3.96Å; D475-I483 PolarHBondContact O-N 2.78Å; D477-I483 HydrophobicContact CB-CG2 4.03Å
484	G	93.9	Very high	96.3	Very high	17 Å²	17	47.6 Å²	47.6	18%	0.175	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	88.4	10.4	-178.5	0	0	0	0	0	115	A448 L449	A448-G484 PolarHBondContact N-O 3.42Å; A448-G484 VanDerWaalsContact N-O 3.09Å; L449-G484 PolarHBondContact N-O 3.28Å
485	S	96.6	Very high	96.3	Very high	6 Å²	6	47.7 Å²	47.7	4%	0.042	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	170	170.1	69.2	0	0	0	0	112.5	F445 V446 L449 D475	F445-S485 VanDerWaalsContact CE2-CB 3.48Å; F445-S485 VanDerWaalsContact CZ-CB 3.44Å; V446-S485 CarbonylContact O-C 3.59Å; V446-S485 VanDerWaalsContact O-CA 3.22Å; V446-S485 WeakPolarHBondContact O-CA 3.45Å; V446-S485 WeakPolarHBondContact O-CB 3.38Å; L449-S485 VanDerWaalsContact CD1-C 3.48Å; D475-S485 WeakPolarHBondContact CB-OG 3.45Å; D475-S485 PolarHBondContact N-O 2.78Å; D475-S485 PolarHBondContact OD2-OG 3.25Å
486	G	97.3	Very high	96.3	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.7	-177.1	175.1	0	0	0	0	0	112	V446 G473 D475	V446-G486 PolarHBondContact N-O 2.93Å; V446-G486 PolarHBondContact O-N 3.17Å; G473-G486 CarbonylContact O-C 3.58Å; G473-G486 WeakPolarHBondContact O-CA 3.22Å; D475-G486 WeakPolarHBondContact OD2-CA 3.31Å; D475-G486 PolarHBondContact OD2-N 3.26Å
487	R	97.6	Very high	96.3	Very high	65 Å²	65	47.6 Å²	47.6	25%	0.245	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	143.6	-177.6	-71.9	168.1	-74.7	150.9	-1	110.3	T443 V444 A472 G473 D475 Y521	T443-R487 HydrophobicContact CG2-CB 4.19Å; V444-R487 VanDerWaalsContact O-CA 3.31Å; V444-R487 WeakPolarHBondContact O-CA 3.02Å; A472-R487 CarbonylContact C-O 3.56Å; A472-R487 VanDerWaalsContact CA-O 3.3Å; A472-R487 WeakPolarHBondContact CA-O 3.47Å; G473-R487 PolarHBondContact N-O 3.26Å; G473-R487 PolarHBondContact O-N 3.28Å; D475-R487 IonicContact OD1-CZ 3.04Å; D475-R487 VanDerWaalsContact OD1-CZ 3.25Å; D475-R487 IonicContact OD1-NE 3.56Å; D475-R487 PolarHBondContact OD1-NE 3.04Å; D475-R487 IonicContact OD1-NH2 3.26Å; D475-R487 PolarHBondContact OD1-NH2 3.17Å; R487-Y521 HydrophobicContact CG-CD2 4.01Å; R487-Y521 HydrophobicContact CG-CE2 4.13Å
488	V	98.5	Very high	96.4	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	123.9	-178.6	-178.6	0	0	0	0	109.7	T443 V444 V446 L458 M462 V469 Y471 A472 F490	T443-V488 CarbonylContact C-O 3.47Å; T443-V488 WeakPolarHBondContact CA-O 3.38Å; V444-V488 HydrophobicContact CG2-CB 3.94Å; V444-V488 PolarHBondContact N-O 2.99Å; V444-V488 PolarHBondContact O-N 2.93Å; V446-V488 HydrophobicContact CG2-CG2 3.93Å; L458-V488 HydrophobicContact CD1-CG2 4.34Å; L458-V488 HydrophobicContact CD2-CG2 3.82Å; L458-V488 HydrophobicContact CG-CG2 3.82Å; M462-V488 HydrophobicContact CB-CG1 4.1Å; M462-V488 HydrophobicContact CE-CB 4.16Å; M462-V488 HydrophobicContact CE-CG1 4.25Å; M462-V488 HydrophobicContact CE-CG2 4.19Å; M462-V488 HydrophobicContact CG-CG1 4.41Å; M462-V488 HydrophobicContact CG-CG2 4.23Å; V469-V488 HydrophobicContact CG1-CG1 3.82Å; V469-V488 HydrophobicContact CG2-CG1 3.9Å; Y471-V488 WeakPolarHBondContact O-CA 3.47Å; A472-V488 HydrophobicContact CB-CG2 4.16Å; V488-F490 HydrophobicContact CG1-CE1 4.47Å; V488-F490 HydrophobicContact CG1-CE2 4.49Å; V488-F490 HydrophobicContact CG1-CZ 4.23Å
489	T	98.1	Very high	96.6	Very high	5 Å²	5	43.6 Å²	43.6	3%	0.031	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	127.5	-178.6	-52.5	0	0	0	0	110.8	L438 T443 M470 Y471	L438-T489 HydrophobicContact CB-CG2 4.23Å; L438-T489 HydrophobicContact CD2-CG2 4.19Å; T443-T489 WeakPolarHBondContact OG1-CB 3.41Å; T443-T489 WeakPolarHBondContact OG1-CG2 3.4Å; T443-T489 PolarHBondContact OG1-OG1 2.94Å; M470-T489 PolarHBondContact N-O 3.07Å; Y471-T489 PolarHBondContact N-O 3.24Å; Y471-T489 PolarHBondContact O-N 2.81Å
490	F	97.8	Very high	96.6	Very high	3 Å²	3	41.8 Å²	41.8	1%	0.013	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	150.4	177.3	-60.8	-79	0	0	0	112	K442 V444 M462 F466 G467 G468 V469 V488 N492 A499	K442-F490 VanDerWaalsContact CB-O 3.31Å; K442-F490 WeakPolarHBondContact CB-O 3.35Å; K442-F490 PolarHBondContact O-N 3.47Å; V444-F490 HydrophobicContact CG1-CE2 4.13Å; V444-F490 HydrophobicContact CG2-CE2 3.91Å; M462-F490 HydrophobicContact CE-CZ 4.08Å; F466-F490 HydrophobicContact CB-CE1 3.83Å; F466-F490 HydrophobicContact CB-CZ 4.08Å; F466-F490 HydrophobicContact CD2-CZ 4.28Å; F466-F490 HydrophobicContact CG-CZ 4.47Å; G467-F490 VanDerWaalsContact O-CD1 3.29Å; G467-F490 WeakPolarHBondContact O-CD1 3.4Å; G468-F490 CarbonylContact O-C 3.59Å; G468-F490 WeakPolarHBondContact O-CA 3.38Å; V469-F490 HydrophobicContact CG2-CD1 3.93Å; V469-F490 HydrophobicContact CG2-CE1 3.62Å; V488-F490 HydrophobicContact CG1-CE1 4.47Å; V488-F490 HydrophobicContact CG1-CE2 4.49Å; V488-F490 HydrophobicContact CG1-CZ 4.23Å; F490-N492 VanDerWaalsContact C-N 3.27Å; F490-N492 PolarHBondContact O-N 3.01Å; F490-A499 HydrophobicContact CE2-CB 3.73Å; F490-A499 HydrophobicContact CZ-CB 3.69Å
491	N	95.9	Very high	96.5	Very high	78 Å²	78	40.1 Å²	40.1	42%	0.417	20%	0.196	S	C	.	.	S	Bend	trans	-74.5	-13.8	172.2	60.6	13.3	0	0	0	113.9	G468 M470	G468-N491 WeakPolarHBondContact CA-OD1 3.45Å; G468-N491 PolarHBondContact O-N 3.36Å; G468-N491 PolarHBondContact O-OD1 3.06Å; M470-N491 HydrophobicContact CG-CB 3.61Å; M470-N491 HydrophobicContact SD-CB 3.92Å
492	N	95.9	Very high	96.5	Very high	45 Å²	45	39 Å²	39	24%	0.241	19%	0.192	C	C	.	.	S	Bend	trans	-143.5	152.1	-171.1	80.1	87.9	0	0	0	112.8	F490 R494 S495 Y496	F490-N492 VanDerWaalsContact C-N 3.27Å; F490-N492 PolarHBondContact O-N 3.01Å; N492-R494 VanDerWaalsContact C-N 3.33Å; N492-R494 PolarHBondContact O-N 3.23Å; N492-R494 WeakPolarHBondContact OD1-CA 3.4Å; N492-R494 WeakPolarHBondContact OD1-CB 3.48Å; N492-R494 PolarHBondContact OD1-N 3.16Å; N492-S495 WeakPolarHBondContact ND2-CB 3.26Å; N492-S495 PolarHBondContact ND2-OG 3.41Å; N492-S495 PolarHBondContact OD1-N 3.48Å; N492-S495 PolarHBondContact OD1-OG 3.46Å; N492-Y496 PolarHBondContact O-N 2.93Å
493	Q	96.5	Very high	96.4	Very high	78 Å²	78	38 Å²	38	36%	0.364	19%	0.186	S	C	.	.	H	α-helix	trans	-68.9	-28.5	-175.8	-158.8	65.2	19.4	0	0	113.6	Y496 L497	Q493-Y496 VanDerWaalsContact NE2-CD1 3.31Å; Q493-L497 HydrophobicContact CG-CD1 4.1Å; Q493-L497 HydrophobicContact CG-CG 4.33Å; Q493-L497 WeakPolarHBondContact O-CB 3.24Å; Q493-L497 WeakPolarHBondContact O-CG 3.22Å; Q493-L497 PolarHBondContact O-N 2.78Å
494	R	97.4	Very high	96.6	Very high	212 Å²	212	37 Å²	37	80%	0.8	18%	0.18	S	C	*	.	H	α-helix	trans	-69.4	-44.6	-176.8	-175.1	-174.4	-67.9	139.6	-3	111	N492 K498	N492-R494 VanDerWaalsContact C-N 3.33Å; N492-R494 PolarHBondContact O-N 3.23Å; N492-R494 WeakPolarHBondContact OD1-CA 3.4Å; N492-R494 WeakPolarHBondContact OD1-CB 3.48Å; N492-R494 PolarHBondContact OD1-N 3.16Å; R494-K498 VanDerWaalsContact O-CB 3.27Å; R494-K498 WeakPolarHBondContact O-CB 3.36Å; R494-K498 PolarHBondContact O-N 2.99Å
495	S	98.1	Very high	96.8	Very high	12 Å²	12	36.2 Å²	36.2	8%	0.084	17%	0.172	C	C	.	.	H	α-helix	trans	-64.9	-43.2	174.9	-61.5	0	0	0	0	112	F466 G467 N492 K498 A499	F466-S495 WeakPolarHBondContact O-CB 3.39Å; F466-S495 PolarHBondContact O-OG 3.01Å; G467-S495 VanDerWaalsContact O-CB 3.24Å; G467-S495 WeakPolarHBondContact O-CB 3.22Å; G467-S495 PolarHBondContact O-OG 3.41Å; N492-S495 WeakPolarHBondContact ND2-CB 3.26Å; N492-S495 PolarHBondContact ND2-OG 3.41Å; N492-S495 PolarHBondContact OD1-N 3.48Å; N492-S495 PolarHBondContact OD1-OG 3.46Å; S495-K498 PolarHBondContact O-N 2.86Å; S495-A499 WeakPolarHBondContact O-CB 3.22Å; S495-A499 PolarHBondContact O-N 2.86Å
496	Y	97.9	Very high	96.9	Very high	12 Å²	12	37.9 Å²	37.9	5%	0.047	18%	0.179	C	C	.	.	H	α-helix	trans	-57.2	-54.2	174.1	166.1	-101.3	0	0	0	112.2	S441 K442 T443 V444 N492 Q493 K498 A499 V500 F545	S441-Y496 WeakPolarHBondContact O-CE1 3.44Å; K442-Y496 VanDerWaalsContact C-CD2 3.47Å; T443-Y496 WeakPolarHBondContact O-CE2 3.32Å; V444-Y496 HydrophobicContact CG1-CD2 3.69Å; V444-Y496 HydrophobicContact CG1-CE2 3.8Å; N492-Y496 PolarHBondContact O-N 2.93Å; Q493-Y496 VanDerWaalsContact NE2-CD1 3.31Å; Y496-K498 PolarHBondContact O-N 2.99Å; Y496-A499 PolarHBondContact O-N 3.13Å; Y496-V500 HydrophobicContact CD2-CG2 4.28Å; Y496-V500 HydrophobicContact CE1-CG2 4.43Å; Y496-V500 HydrophobicContact CE2-CG2 3.83Å; Y496-V500 WeakPolarHBondContact O-CG2 3.43Å; Y496-V500 PolarHBondContact O-N 2.95Å; Y496-F545 HydrophobicContact CE1-CE1 4.35Å; Y496-F545 HydrophobicContact CE1-CZ 4.14Å
497	L	96.1	Very high	96.9	Very high	47 Å²	47	37.9 Å²	37.9	25%	0.246	18%	0.179	C	C	.	.	H	α-helix	trans	-63.6	-40.1	179.2	-69.9	175	0	0	0	111.7	Q493 A499 V500 C501 F545	Q493-L497 HydrophobicContact CG-CD1 4.1Å; Q493-L497 HydrophobicContact CG-CG 4.33Å; Q493-L497 WeakPolarHBondContact O-CB 3.24Å; Q493-L497 WeakPolarHBondContact O-CG 3.22Å; Q493-L497 PolarHBondContact O-N 2.78Å; L497-A499 VanDerWaalsContact C-N 3.3Å; L497-A499 PolarHBondContact O-N 2.84Å; L497-V500 PolarHBondContact O-N 2.94Å; L497-C501 WeakPolarHBondContact O-CB 3.44Å; L497-C501 PolarHBondContact O-N 3.22Å; L497-C501 PolarHBondContact O-SG 3.04Å; L497-F545 HydrophobicContact CD2-CE1 4.32Å; L497-F545 HydrophobicContact CD2-CZ 4.09Å
498	K	96.9	Very high	96.9	Very high	92 Å²	92	38.8 Å²	38.8	40%	0.4	19%	0.185	S	C	.	.	H	α-helix	trans	-59.4	-40.4	175.4	-169.6	-172.5	170.3	-163.7	0	111.8	L465 F466 R494 S495 Y496 A502	L465-K498 PolarHBondContact O-NZ 3.43Å; F466-K498 HydrophobicContact CD1-CB 4.16Å; F466-K498 HydrophobicContact CD1-CD 3.85Å; F466-K498 HydrophobicContact CD1-CG 3.78Å; F466-K498 HydrophobicContact CE1-CG 4.22Å; R494-K498 VanDerWaalsContact O-CB 3.27Å; R494-K498 WeakPolarHBondContact O-CB 3.36Å; R494-K498 PolarHBondContact O-N 2.99Å; S495-K498 PolarHBondContact O-N 2.86Å; Y496-K498 PolarHBondContact O-N 2.99Å; K498-A502 VanDerWaalsContact O-CB 3.31Å; K498-A502 WeakPolarHBondContact O-CB 3.32Å; K498-A502 PolarHBondContact O-N 3.38Å
499	A	97.6	Very high	96.7	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-69.1	-41.6	177.2	0	0	0	0	0	112.5	V444 F466 F490 S495 Y496 L497 A502 A503 I518	V444-A499 HydrophobicContact CG1-CB 4.28Å; F466-A499 HydrophobicContact CB-CB 4.5Å; F466-A499 HydrophobicContact CD1-CB 4.1Å; F466-A499 HydrophobicContact CD2-CB 3.79Å; F466-A499 HydrophobicContact CE1-CB 4.3Å; F466-A499 HydrophobicContact CE2-CB 3.99Å; F466-A499 HydrophobicContact CG-CB 3.86Å; F466-A499 HydrophobicContact CZ-CB 4.24Å; F490-A499 HydrophobicContact CE2-CB 3.73Å; F490-A499 HydrophobicContact CZ-CB 3.69Å; S495-A499 WeakPolarHBondContact O-CB 3.22Å; S495-A499 PolarHBondContact O-N 2.86Å; Y496-A499 PolarHBondContact O-N 3.13Å; L497-A499 VanDerWaalsContact C-N 3.3Å; L497-A499 PolarHBondContact O-N 2.84Å; A499-A502 WeakPolarHBondContact O-CB 3.45Å; A499-A502 PolarHBondContact O-N 3.25Å; A499-A503 PolarHBondContact O-N 2.65Å; A499-I518 HydrophobicContact CB-CG2 4.33Å; A499-I518 WeakPolarHBondContact O-CG2 3.26Å
500	V	95.8	Very high	96.4	Very high	4 Å²	4	44.9 Å²	44.9	2%	0.024	22%	0.224	C	C	.	.	H	α-helix	trans	-63.9	-45.7	175.3	170.1	0	0	0	0	111.7	V444 Y496 L497 A502 A503 P520 F545	V444-V500 HydrophobicContact CG1-CG2 3.67Å; Y496-V500 HydrophobicContact CD2-CG2 4.28Å; Y496-V500 HydrophobicContact CE1-CG2 4.43Å; Y496-V500 HydrophobicContact CE2-CG2 3.83Å; Y496-V500 WeakPolarHBondContact O-CG2 3.43Å; Y496-V500 PolarHBondContact O-N 2.95Å; L497-V500 PolarHBondContact O-N 2.94Å; V500-A502 VanDerWaalsContact C-N 3.29Å; V500-A502 PolarHBondContact O-N 3.14Å; V500-A503 PolarHBondContact O-N 3.08Å; V500-P520 HydrophobicContact CG1-CG 3.75Å; V500-P520 HydrophobicContact CG2-CG 4.01Å; V500-F545 HydrophobicContact CG1-CE2 3.98Å; V500-F545 HydrophobicContact CG1-CZ 4.4Å
501	C	94.4	Very high	95.9	Very high	82 Å²	82	49.4 Å²	49.4	55%	0.554	24%	0.244	S	C	*	.	H	α-helix	trans	-66.6	-29.4	176.8	-65.4	0	0	0	0	112.8	L497 A503	L497-C501 WeakPolarHBondContact O-CB 3.44Å; L497-C501 PolarHBondContact O-N 3.22Å; L497-C501 PolarHBondContact O-SG 3.04Å; C501-A503 VanDerWaalsContact C-N 3.34Å
502	A	95.6	Very high	95.7	Very high	1 Å²	1	46.6 Å²	46.6	1%	0.008	23%	0.228	C	C	.	.	H	α-helix	trans	-64.6	-37.1	175.6	0	0	0	0	0	112.7	T304 F305 F466 K498 A499 V500 F504	T304-A502 WeakPolarHBondContact CB-O 3.31Å; T304-A502 PolarHBondContact OG1-O 3.21Å; F305-A502 HydrophobicContact CD2-CB 3.45Å; F305-A502 VanDerWaalsContact CD2-CB 3.45Å; F305-A502 HydrophobicContact CE2-CB 3.63Å; F466-A502 HydrophobicContact CE1-CB 3.66Å; F466-A502 HydrophobicContact CZ-CB 3.65Å; K498-A502 VanDerWaalsContact O-CB 3.31Å; K498-A502 WeakPolarHBondContact O-CB 3.32Å; K498-A502 PolarHBondContact O-N 3.38Å; A499-A502 WeakPolarHBondContact O-CB 3.45Å; A499-A502 PolarHBondContact O-N 3.25Å; V500-A502 VanDerWaalsContact C-N 3.29Å; V500-A502 PolarHBondContact O-N 3.14Å; A502-F504 PolarHBondContact O-N 3.2Å
503	A	94.9	Very high	95.7	Very high	4 Å²	4	48.3 Å²	48.3	3%	0.033	24%	0.24	C	C	.	.			trans	59.2	-42.4	172.2	0	0	0	0	0	118.3	A499 V500 C501 Q517 I518	A499-A503 PolarHBondContact O-N 2.65Å; V500-A503 PolarHBondContact O-N 3.08Å; C501-A503 VanDerWaalsContact C-N 3.34Å; A503-Q517 CarbonylContact O-C 3.59Å; A503-Q517 WeakPolarHBondContact O-CA 3.36Å; A503-I518 PolarHBondContact O-N 3.35Å
504	F	96.5	Very high	95.6	Very high	13 Å²	13	46.3 Å²	46.3	6%	0.057	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	125.1	177.5	-57.9	-70.6	0	0	0	109.4	A297 N301 E302 A303 T304 A502 K515 V516 Q517	A297-F504 HydrophobicContact CB-CE1 3.93Å; A297-F504 HydrophobicContact CB-CZ 3.65Å; N301-F504 HydrophobicContact CB-CD1 4.45Å; N301-F504 HydrophobicContact CB-CD2 3.64Å; N301-F504 HydrophobicContact CB-CE1 4.23Å; N301-F504 HydrophobicContact CB-CE2 3.37Å; N301-F504 HydrophobicContact CB-CG 4.19Å; N301-F504 HydrophobicContact CB-CZ 3.71Å; E302-F504 WeakPolarHBondContact O-CB 3.38Å; A303-F504 WeakPolarHBondContact CA-O 3.48Å; T304-F504 PolarHBondContact N-O 3.21Å; T304-F504 VanDerWaalsContact N-O 3.07Å; A502-F504 PolarHBondContact O-N 3.2Å; F504-K515 HydrophobicContact CB-CG 4.45Å; F504-V516 WeakPolarHBondContact CA-O 3.46Å; F504-Q517 HydrophobicContact CD1-CB 4.02Å; F504-Q517 HydrophobicContact CD1-CG 4.25Å; F504-Q517 HydrophobicContact CE1-CB 3.91Å; F504-Q517 HydrophobicContact CE1-CG 3.73Å
505	V	97.6	Very high	95.5	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.006	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	130.4	177.9	172.1	0	0	0	0	108.6	F305 L465 F466 I507 K515 V516 I518	F305-V505 HydrophobicContact CB-CG2 4.34Å; F305-V505 WeakPolarHBondContact O-CA 3.47Å; L465-V505 HydrophobicContact CD1-CB 4.43Å; L465-V505 HydrophobicContact CD1-CG1 3.47Å; L465-V505 VanDerWaalsContact CD1-CG1 3.47Å; L465-V505 HydrophobicContact CD1-CG2 4.04Å; F466-V505 HydrophobicContact CE2-CG2 4.28Å; F466-V505 HydrophobicContact CZ-CG2 3.96Å; V505-I507 HydrophobicContact CG1-CG1 4.18Å; V505-K515 CarbonylContact O-C 3.47Å; V505-K515 WeakPolarHBondContact O-CA 3.33Å; V505-V516 HydrophobicContact CB-CG2 3.93Å; V505-V516 HydrophobicContact CG1-CG2 4.47Å; V505-V516 PolarHBondContact N-O 2.95Å; V505-V516 WeakPolarHBondContact O-CG2 3.45Å; V505-V516 PolarHBondContact O-N 3.09Å; V505-I518 HydrophobicContact CB-CD1 4.46Å; V505-I518 HydrophobicContact CG2-CD1 3.55Å
506	E	97.6	Very high	95.4	Very high	41 Å²	41	37.4 Å²	37.4	19%	0.192	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	122.4	168.8	-169.5	178.1	-137.4	0	0	110.3	A303 F305 T306 W307 K508 T513	A303-E506 HydrophobicContact CB-CB 3.75Å; F305-E506 PolarHBondContact O-N 2.74Å; T306-E506 CarbonylContact C-O 3.6Å; T306-E506 WeakPolarHBondContact CA-O 3.49Å; T306-E506 HydrophobicContact CG2-CB 4.42Å; W307-E506 PolarHBondContact N-O 2.73Å; E506-K508 HydrophobicContact CG-CG 4.38Å; E506-K508 IonicContact OE1-NZ 2.69Å; E506-K508 WeakPolarHBondContact OE2-CE 3.38Å; E506-K508 IonicContact OE2-NZ 2.76Å; E506-K508 PolarHBondContact OE2-NZ 3.24Å; E506-T513 HydrophobicContact CG-CG2 3.9Å; E506-T513 WeakPolarHBondContact OE1-CG2 3.46Å
507	I	97.8	Very high	95.4	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.005	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	115.4	176.3	-60.3	172.6	0	0	0	107.7	W307 L453 I461 V505 T509 F512 T513 K514 V516	W307-I507 HydrophobicContact CE3-CG2 4.08Å; W307-I507 HydrophobicContact CZ3-CG2 4.37Å; L453-I507 HydrophobicContact CD1-CD1 3.85Å; I461-I507 HydrophobicContact CD1-CD1 4.12Å; I461-I507 HydrophobicContact CD1-CG2 3.91Å; I461-I507 HydrophobicContact CG2-CD1 4.25Å; I461-I507 HydrophobicContact CG2-CG1 4.21Å; V505-I507 HydrophobicContact CG1-CG1 4.18Å; I507-T509 HydrophobicContact CG2-CG2 4.2Å; I507-F512 HydrophobicContact CB-CE2 4.44Å; I507-F512 HydrophobicContact CG2-CE2 3.93Å; I507-F512 HydrophobicContact CG2-CZ 4.18Å; I507-T513 CarbonylContact O-C 3.59Å; I507-T513 VanDerWaalsContact O-CA 3.32Å; I507-T513 WeakPolarHBondContact O-CA 3.43Å; I507-K514 PolarHBondContact N-O 2.8Å; I507-K514 PolarHBondContact O-N 3.31Å; I507-V516 HydrophobicContact CD1-CG1 3.82Å; I507-V516 HydrophobicContact CD1-CG2 3.85Å; I507-V516 HydrophobicContact CG1-CG2 4.32Å
508	K	97.6	Very high	95.4	Very high	84 Å²	84	35 Å²	35	37%	0.365	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	123.1	176.6	-78.8	170.6	167.9	144	0	110.4	T306 W307 S308 G309 E506 T513	T306-K508 HydrophobicContact CG2-CD 3.85Å; T306-K508 HydrophobicContact CG2-CG 4.47Å; W307-K508 PolarHBondContact O-N 3.08Å; S308-K508 WeakPolarHBondContact CA-O 3.46Å; G309-K508 PolarHBondContact N-O 3.12Å; E506-K508 HydrophobicContact CG-CG 4.38Å; E506-K508 IonicContact OE1-NZ 2.69Å; E506-K508 WeakPolarHBondContact OE2-CE 3.38Å; E506-K508 IonicContact OE2-NZ 2.76Å; E506-K508 PolarHBondContact OE2-NZ 3.24Å; K508-T513 HydrophobicContact CG-CG2 3.63Å
509	T	94.5	Very high	95.3	Very high	19 Å²	19	31.2 Å²	31.2	12%	0.117	17%	0.168	C	C	.	.			trans	-132.4	165.5	174.5	71.1	0	0	0	0	109.9	W307 G309 L311 I507 K511 F512	W307-T509 HydrophobicContact CZ3-CG2 4.19Å; G309-T509 WeakPolarHBondContact O-CA 3.46Å; L311-T509 HydrophobicContact CD2-CG2 3.69Å; L311-T509 HydrophobicContact CG-CG2 3.94Å; I507-T509 HydrophobicContact CG2-CG2 4.2Å; T509-K511 PolarHBondContact O-N 3.49Å; T509-K511 PolarHBondContact OG1-N 3.07Å; T509-F512 HydrophobicContact CG2-CD1 4.37Å; T509-F512 HydrophobicContact CG2-CE1 3.8Å; T509-F512 HydrophobicContact CG2-CE2 4.27Å; T509-F512 HydrophobicContact CG2-CZ 3.74Å; T509-F512 PolarHBondContact N-O 2.78Å; T509-F512 VanDerWaalsContact O-O 3.1Å; T509-F512 WeakPolarHBondContact OG1-CD1 3.1Å; T509-F512 WeakPolarHBondContact OG1-CE1 3.49Å; T509-F512 PolarHBondContact OG1-N 2.65Å; T509-F512 PolarHBondContact OG1-O 3.22Å
510	P	91.2	Very high	95.2	Very high	114 Å²	114	31.5 Å²	31.5	74%	0.74	17%	0.17	S	C	*	.	S	Bend	trans	-59.7	-25.4	173.1	-25.7	35.7	0	0	0	114.8
511	K	87.8	Confident	95.2	Very high	98 Å²	98	34.6 Å²	34.6	43%	0.426	18%	0.182	S	C	.	.	S	Bend	trans	-101.4	-18.8	-176.8	-66.1	-166.9	174.1	-175.8	0	114.4	D400 E403 M452 T509	D400-K511 IonicContact OD1-NZ 3.98Å; D400-K511 PolarHBondContact OD1-NZ 2.75Å; D400-K511 WeakPolarHBondContact OD2-CE 3.5Å; D400-K511 IonicContact OD2-NZ 3.62Å; D400-K511 PolarHBondContact OD2-NZ 3.07Å; E403-K511 IonicContact OE1-NZ 2.7Å; E403-K511 PolarHBondContact OE1-NZ 3.02Å; M452-K511 HydrophobicContact CE-CB 4.1Å; M452-K511 HydrophobicContact CE-CD 3.77Å; M452-K511 HydrophobicContact SD-CB 4.17Å; T509-K511 PolarHBondContact O-N 3.49Å; T509-K511 PolarHBondContact OG1-N 3.07Å
512	F	92.4	Very high	95.1	Very high	19 Å²	19	31.7 Å²	31.7	8%	0.083	16%	0.161	C	C	.	.			trans	-159.8	156.4	175	70	-89.1	0	0	0	113.2	L311 H450 M452 L453 I507 T509 K514	L311-F512 HydrophobicContact CD1-CE1 4.01Å; L311-F512 HydrophobicContact CD1-CZ 4.35Å; H450-F512 HydrophobicContact CB-CD2 3.8Å; H450-F512 HydrophobicContact CB-CE1 4.34Å; H450-F512 HydrophobicContact CB-CE2 3.51Å; H450-F512 HydrophobicContact CB-CG 4.34Å; H450-F512 HydrophobicContact CB-CZ 3.82Å; H450-F512 AromaticContact CD2-CD2 3.76Å; H450-F512 AromaticContact CD2-CG 3.84Å; H450-F512 AromaticContact CE1-CD1 3.59Å; H450-F512 AromaticContact CE1-CG 3.48Å; H450-F512 VanDerWaalsContact CE1-CG 3.48Å; H450-F512 WeakPolarHBondContact CE1-CG 3.44Å; H450-F512 AromaticContact CG-CD1 3.92Å; H450-F512 AromaticContact CG-CD2 3.49Å; H450-F512 VanDerWaalsContact CG-CD2 3.49Å; H450-F512 AromaticContact CG-CE2 3.72Å; H450-F512 AromaticContact CG-CG 3.61Å; H450-F512 AromaticContact ND1-CD1 3.27Å; H450-F512 VanDerWaalsContact ND1-CD1 3.27Å; H450-F512 WeakPolarHBondContact ND1-CD1 3.49Å; H450-F512 AromaticContact ND1-CD2 3.74Å; H450-F512 AromaticContact ND1-CE1 3.59Å; H450-F512 AromaticContact ND1-CG 3.36Å; H450-F512 WeakPolarHBondContact ND1-CG 3.42Å; H450-F512 AromaticContact ND1-CZ 3.97Å; H450-F512 AromaticContact NE2-CG 3.79Å; M452-F512 HydrophobicContact CB-CD1 4.23Å; M452-F512 HydrophobicContact CB-CE1 3.9Å; M452-F512 HydrophobicContact SD-CD1 3.89Å; M452-F512 HydrophobicContact SD-CE1 4.45Å; L453-F512 HydrophobicContact CD2-CZ 4.01Å; L453-F512 HydrophobicContact CG-CZ 4.05Å; I507-F512 HydrophobicContact CB-CE2 4.44Å; I507-F512 HydrophobicContact CG2-CE2 3.93Å; I507-F512 HydrophobicContact CG2-CZ 4.18Å; T509-F512 HydrophobicContact CG2-CD1 4.37Å; T509-F512 HydrophobicContact CG2-CE1 3.8Å; T509-F512 HydrophobicContact CG2-CE2 4.27Å; T509-F512 HydrophobicContact CG2-CZ 3.74Å; T509-F512 PolarHBondContact N-O 2.78Å; T509-F512 VanDerWaalsContact O-O 3.1Å; T509-F512 WeakPolarHBondContact OG1-CD1 3.1Å; T509-F512 WeakPolarHBondContact OG1-CE1 3.49Å; T509-F512 PolarHBondContact OG1-N 2.65Å; T509-F512 PolarHBondContact OG1-O 3.22Å; F512-K514 HydrophobicContact CD2-CB 3.9Å; F512-K514 HydrophobicContact CE2-CB 4.15Å
513	T	95.4	Very high	94.8	Very high	81 Å²	81	36.2 Å²	36.2	50%	0.497	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	131.3	160.2	-63.2	0	0	0	0	109.2	E506 I507 K508	E506-T513 HydrophobicContact CG-CG2 3.9Å; E506-T513 WeakPolarHBondContact OE1-CG2 3.46Å; I507-T513 CarbonylContact O-C 3.59Å; I507-T513 VanDerWaalsContact O-CA 3.32Å; I507-T513 WeakPolarHBondContact O-CA 3.43Å; K508-T513 HydrophobicContact CG-CG2 3.63Å
514	K	94.4	Very high	94.6	Very high	35 Å²	35	42.3 Å²	42.3	15%	0.152	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	131.1	-179.7	-178.8	65.1	174.8	-167	0	111.5	G201 F202 A448 H450 I507 F512 V516	G201-K514 PolarHBondContact O-NZ 2.92Å; F202-K514 HydrophobicContact CD1-CD 4Å; F202-K514 HydrophobicContact CE1-CD 3.69Å; F202-K514 VanDerWaalsContact CE1-CE 3.48Å; F202-K514 HydrophobicContact CE1-CG 4.24Å; A448-K514 WeakPolarHBondContact O-CE 3.49Å; H450-K514 HydrophobicContact CB-CB 4.26Å; H450-K514 HydrophobicContact CB-CG 4.32Å; I507-K514 PolarHBondContact N-O 2.8Å; I507-K514 PolarHBondContact O-N 3.31Å; F512-K514 HydrophobicContact CD2-CB 3.9Å; F512-K514 HydrophobicContact CE2-CB 4.15Å; K514-V516 HydrophobicContact CG-CG1 4.38Å
515	K	95.8	Very high	94.4	Very high	36 Å²	36	43.4 Å²	43.4	16%	0.157	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	124.3	167.6	-162.5	173.3	-72.1	167.9	0	109.2	N301 E302 A303 F504 V505	N301-K515 WeakPolarHBondContact O-CD 3.29Å; N301-K515 WeakPolarHBondContact O-CE 3.29Å; N301-K515 PolarHBondContact O-NZ 2.59Å; E302-K515 IonicContact OE1-NZ 3.25Å; E302-K515 PolarHBondContact OE1-NZ 2.83Å; E302-K515 IonicContact OE2-NZ 3.63Å; E302-K515 PolarHBondContact OE2-NZ 2.82Å; A303-K515 HydrophobicContact CB-CD 4.33Å; A303-K515 HydrophobicContact CB-CG 4.29Å; F504-K515 HydrophobicContact CB-CG 4.45Å; V505-K515 CarbonylContact O-C 3.47Å; V505-K515 WeakPolarHBondContact O-CA 3.33Å
516	V	96.7	Very high	94.3	Very high	2 Å²	2	47.8 Å²	47.8	1%	0.012	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	152.1	175.8	-58.1	0	0	0	0	110	V446 L449 F504 V505 I507 K514	V446-V516 HydrophobicContact CG1-CB 4.27Å; V446-V516 HydrophobicContact CG1-CG2 4.22Å; L449-V516 HydrophobicContact CD2-CG1 4.11Å; F504-V516 WeakPolarHBondContact CA-O 3.46Å; V505-V516 HydrophobicContact CB-CG2 3.93Å; V505-V516 HydrophobicContact CG1-CG2 4.47Å; V505-V516 PolarHBondContact N-O 2.95Å; V505-V516 WeakPolarHBondContact O-CG2 3.45Å; V505-V516 PolarHBondContact O-N 3.09Å; I507-V516 HydrophobicContact CD1-CG1 3.82Å; I507-V516 HydrophobicContact CD1-CG2 3.85Å; I507-V516 HydrophobicContact CG1-CG2 4.32Å; K514-V516 HydrophobicContact CG-CG1 4.38Å
517	Q	96.1	Very high	94.3	Very high	9 Å²	9	45.9 Å²	45.9	4%	0.042	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	135.5	-177.2	171.3	170.3	-24.2	0	0	110.2	H294 A298 V446 G447 A503 F504 D519	H294-Q517 PolarHBondContact CD2-NE2 3.02Å; H294-Q517 VanDerWaalsContact CD2-NE2 3.26Å; H294-Q517 PolarHBondContact NE2-NE2 3.2Å; H294-Q517 VanDerWaalsContact NE2-NE2 3.17Å; H294-Q517 PolarHBondContact O-NE2 3.37Å; H294-Q517 PolarHBondContact O-OE1 2.88Å; A298-Q517 HydrophobicContact CB-CB 3.96Å; A298-Q517 VanDerWaalsContact N-OE1 3.08Å; V446-Q517 CarbonylContact C-O 3.59Å; V446-Q517 VanDerWaalsContact CA-O 3.26Å; V446-Q517 WeakPolarHBondContact CA-O 3.5Å; G447-Q517 PolarHBondContact N-O 3.26Å; G447-Q517 PolarHBondContact O-N 3.09Å; A503-Q517 CarbonylContact O-C 3.59Å; A503-Q517 WeakPolarHBondContact O-CA 3.36Å; F504-Q517 HydrophobicContact CD1-CB 4.02Å; F504-Q517 HydrophobicContact CD1-CG 4.25Å; F504-Q517 HydrophobicContact CE1-CB 3.91Å; F504-Q517 HydrophobicContact CE1-CG 3.73Å; Q517-D519 PolarHBondContact NE2-OD2 3.43Å
518	I	97	Very high	94.2	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	123.3	178.3	-54.7	171.5	0	0	0	107.9	V444 F445 V446 M462 F466 A499 A503 V505	V444-I518 HydrophobicContact CB-CG2 3.76Å; V444-I518 HydrophobicContact CG1-CG2 3.99Å; V444-I518 HydrophobicContact CG2-CG2 3.9Å; F445-I518 WeakPolarHBondContact O-CA 3.47Å; V446-I518 HydrophobicContact CG1-CG1 4.42Å; M462-I518 HydrophobicContact CE-CD1 3.92Å; M462-I518 HydrophobicContact CE-CG1 4.43Å; M462-I518 HydrophobicContact SD-CD1 3.95Å; F466-I518 HydrophobicContact CE2-CD1 3.84Å; F466-I518 HydrophobicContact CZ-CD1 4.07Å; A499-I518 HydrophobicContact CB-CG2 4.33Å; A499-I518 WeakPolarHBondContact O-CG2 3.26Å; A503-I518 PolarHBondContact O-N 3.35Å; V505-I518 HydrophobicContact CB-CD1 4.46Å; V505-I518 HydrophobicContact CG2-CD1 3.55Å
519	D	95.4	Very high	94.1	Very high	12 Å²	12	49.6 Å²	49.6	6%	0.064	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	159.3	173.5	-75.7	-58.8	0	0	0	109.5	H294 V444 F445 Q517 R540 L568	H294-D519 IonicContact CD2-OD2 3.32Å; H294-D519 PolarHBondContact CD2-OD2 3.41Å; H294-D519 IonicContact CE1-OD1 3.68Å; H294-D519 VanDerWaalsContact NE2-CG 3.32Å; H294-D519 IonicContact NE2-OD1 2.65Å; H294-D519 PolarHBondContact NE2-OD1 2.91Å; H294-D519 IonicContact NE2-OD2 3.17Å; H294-D519 PolarHBondContact NE2-OD2 3.45Å; V444-D519 WeakPolarHBondContact CA-O 3.48Å; F445-D519 PolarHBondContact N-O 3.07Å; F445-D519 PolarHBondContact O-N 3.3Å; Q517-D519 PolarHBondContact NE2-OD2 3.43Å; D519-R540 IonicContact OD1-NH1 2.81Å; D519-R540 PolarHBondContact OD1-NH1 2.61Å; D519-L568 HydrophobicContact CB-CD1 4.03Å
520	P	95.6	Very high	94.2	Very high	5 Å²	5	50.7 Å²	50.7	3%	0.032	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-52.7	140.2	169.9	-26.6	36.2	0	0	0	111.9	V500 L522 F538 F545 L568	V500-P520 HydrophobicContact CG1-CG 3.75Å; V500-P520 HydrophobicContact CG2-CG 4.01Å; P520-L522 HydrophobicContact CB-CD2 4.15Å; P520-L522 PolarHBondContact O-N 3.46Å; P520-F538 HydrophobicContact CB-CE1 4.19Å; P520-F538 HydrophobicContact CG-CD1 4.32Å; P520-F538 HydrophobicContact CG-CE1 3.82Å; P520-F545 HydrophobicContact CG-CE2 4.36Å; P520-F545 HydrophobicContact CG-CZ 4.33Å; P520-L568 HydrophobicContact CG-CD1 4.38Å
521	Y	94.6	Very high	94.5	Very high	70 Å²	70	51.2 Å²	51.2	28%	0.275	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-72	121.9	169.8	-176.5	-108.4	0	0	0	109.8	T443 R487 E523	T443-Y521 HydrophobicContact CG2-CD1 4.48Å; T443-Y521 HydrophobicContact CG2-CG 4.15Å; T443-Y521 WeakPolarHBondContact O-CB 3.19Å; T443-Y521 PolarHBondContact O-N 3.44Å; T443-Y521 VanDerWaalsContact O-N 3.13Å; R487-Y521 HydrophobicContact CG-CD2 4.01Å; R487-Y521 HydrophobicContact CG-CE2 4.13Å; Y521-E523 HydrophobicContact CD1-CG 4.34Å; Y521-E523 HydrophobicContact CE1-CG 4.26Å
522	L	92.9	Very high	94.8	Very high	21 Å²	21	56.7 Å²	56.7	11%	0.11	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-98.2	128	-171.7	-58.7	-174.1	0	0	0	112.9	P520 F538 Y547 L568 R570	P520-L522 HydrophobicContact CB-CD2 4.15Å; P520-L522 PolarHBondContact O-N 3.46Å; L522-F538 HydrophobicContact CD1-CB 4.15Å; L522-F538 HydrophobicContact CD2-CB 3.59Å; L522-F538 HydrophobicContact CD2-CD1 3.99Å; L522-F538 HydrophobicContact CD2-CD2 4.15Å; L522-F538 HydrophobicContact CD2-CG 3.63Å; L522-Y547 WeakPolarHBondContact CA-OH 3.42Å; L522-Y547 HydrophobicContact CB-CE1 4.48Å; L522-Y547 HydrophobicContact CD2-CE1 4.08Å; L522-L568 HydrophobicContact CD1-CB 3.91Å; L522-R570 HydrophobicContact CB-CB 4.4Å; L522-R570 WeakPolarHBondContact O-CD 3.39Å
523	E	90	Very high	94.9	Very high	95 Å²	95	61.4 Å²	61.4	44%	0.444	30%	0.302	S	S	.	.			trans	-108.4	158.3	177.8	-60.1	-166.7	118.5	0	0	111.5	P440 Y521 S525 Y547	P440-E523 VanDerWaalsContact CB-CD 3.44Å; P440-E523 HydrophobicContact CB-CG 4.38Å; P440-E523 WeakPolarHBondContact CB-OE1 3.11Å; P440-E523 WeakPolarHBondContact CG-OE1 3.13Å; Y521-E523 HydrophobicContact CD1-CG 4.34Å; Y521-E523 HydrophobicContact CE1-CG 4.26Å; E523-S525 PolarHBondContact O-N 2.92Å; E523-S525 PolarHBondContact O-OG 3Å; E523-Y547 PolarHBondContact N-OH 3.42Å
524	D	90.1	Very high	94.9	Very high	133 Å²	133	61.2 Å²	61.2	71%	0.711	30%	0.302	S	S	*	.			trans	-70.1	94.5	178	-66.7	-63.1	0	0	0	110.6	R570	D524-R570 VanDerWaalsContact CG-NH1 3.27Å; D524-R570 IonicContact OD1-CZ 3.01Å; D524-R570 IonicContact OD1-NH1 3.66Å; D524-R570 PolarHBondContact OD1-NH1 2.85Å; D524-R570 IonicContact OD1-NH2 2.73Å; D524-R570 PolarHBondContact OD1-NH2 2.83Å; D524-R570 IonicContact OD2-CZ 3.85Å; D524-R570 IonicContact OD2-NH1 2.96Å; D524-R570 PolarHBondContact OD2-NH1 3.34Å; D524-R570 IonicContact OD2-NH2 3.73Å; D524-R570 PolarHBondContact OD2-NH2 3.05Å
525	S	92.1	Very high	94.9	Very high	35 Å²	35	59.7 Å²	59.7	25%	0.245	30%	0.297	C	S	.	.			trans	-112.2	154.2	-172	-61.8	0	0	0	0	112.8	E523 G535 Y547	E523-S525 PolarHBondContact O-N 2.92Å; E523-S525 PolarHBondContact O-OG 3Å; S525-G535 PolarHBondContact O-N 3.09Å; S525-Y547 VanDerWaalsContact OG-CE2 3.27Å; S525-Y547 WeakPolarHBondContact OG-CE2 3.42Å
526	M	96.1	Very high	94.8	Very high	94 Å²	94	60.1 Å²	60.1	46%	0.463	30%	0.303	S	S	.	.	B	Isolated β-bridge	trans	-77.1	153.5	166.3	-68.2	-66.4	-78.4	0	0	110.7	Q528 L531	M526-Q528 PolarHBondContact O-N 3.14Å; M526-Q528 VanDerWaalsContact O-N 3.13Å; M526-L531 WeakPolarHBondContact CE-O 3.16Å
527	C	96.8	Very high	94.6	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	30%	0.304	C	S	.	.			trans	-60.1	115.1	174.1	174.6	0	0	0	0	110.4	V529 C530 L531 Q533 C549	C527-V529 PolarHBondContact O-N 3.49Å; C527-V529 VanDerWaalsContact O-N 3.16Å; C527-C530 PolarHBondContact O-N 2.84Å; C527-L531 VanDerWaalsContact O-CA 3.29Å; C527-L531 WeakPolarHBondContact O-CA 3.31Å; C527-L531 PolarHBondContact O-N 3.41Å; C527-Q533 WeakPolarHBondContact CB-O 3.43Å; C527-Q533 PolarHBondContact N-O 2.97Å; C527-C549 HydrophobicContact CB-CB 3.87Å; C527-C549 PolarHBondContact SG-N 3.14Å; C527-C549 VanDerWaalsContact SG-SG 3.68Å
528	Q	96.3	Very high	94.6	Very high	100 Å²	100	60.3 Å²	60.3	47%	0.467	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-4.9	-174.3	-66.8	177.8	-80.1	0	0	113.8	M526 K546 Y547	M526-Q528 PolarHBondContact O-N 3.14Å; M526-Q528 VanDerWaalsContact O-N 3.13Å; Q528-K546 HydrophobicContact CB-CB 4.38Å; Q528-K546 HydrophobicContact CB-CG 4.32Å; Q528-Y547 PolarHBondContact N-O 3.43Å
529	V	95.9	Very high	94.4	Very high	64 Å²	64	60.3 Å²	60.3	39%	0.388	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-47.2	174.4	-178.9	0	0	0	0	111.7	C527 Y548 C552	C527-V529 PolarHBondContact O-N 3.49Å; C527-V529 VanDerWaalsContact O-N 3.16Å; V529-Y548 HydrophobicContact CG2-CD1 3.71Å; V529-Y548 HydrophobicContact CG2-CE1 3.51Å; V529-C552 HydrophobicContact CB-CB 4.01Å; V529-C552 HydrophobicContact CG1-CB 4.27Å; V529-C552 HydrophobicContact CG2-CB 4.34Å
530	C	96	Very high	94.2	Very high	41 Å²	41	62.1 Å²	62.1	28%	0.277	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	-17.5	-173.8	73.6	0	0	0	0	114.9	C527 R532	C527-C530 PolarHBondContact O-N 2.84Å; C530-R532 WeakPolarHBondContact O-CG 3.37Å; C530-R532 PolarHBondContact O-N 3.06Å
531	L	96.6	Very high	94	Very high	126 Å²	126	64.3 Å²	64.3	66%	0.66	32%	0.321	S	S	*	.	S	Bend	trans	55.3	4.8	-179.1	-56.7	172.8	0	0	0	116.2	M526 C527	M526-L531 WeakPolarHBondContact CE-O 3.16Å; C527-L531 VanDerWaalsContact O-CA 3.29Å; C527-L531 WeakPolarHBondContact O-CA 3.31Å; C527-L531 PolarHBondContact O-N 3.41Å
532	R	95.1	Very high	93.8	Very high	213 Å²	213	66.9 Å²	66.9	80%	0.804	34%	0.336	S	S	*	.	S	Bend	trans	-96.9	-17.5	-174.7	-73.1	171.6	-172.1	-152.4	1.4	115	C530	C530-R532 WeakPolarHBondContact O-CG 3.37Å; C530-R532 PolarHBondContact O-N 3.06Å
533	Q	94.2	Very high	93.7	Very high	117 Å²	117	69.7 Å²	69.7	55%	0.547	36%	0.362	S	S	.	.	S	Bend	trans	-142.2	157.2	-172.3	-69	-63.4	-19.8	0	0	110.3	C527 C549	C527-Q533 WeakPolarHBondContact CB-O 3.43Å; C527-Q533 PolarHBondContact N-O 2.97Å; Q533-C549 HydrophobicContact CB-CB 4.3Å
534	P	94.8	Very high	93.8	Very high	77 Å²	77	65.4 Å²	65.4	50%	0.5	34%	0.342	S	S	.	.	B	Isolated β-bridge	trans	-52.8	146.5	170.4	-25.9	35.4	0	0	0	112.2	P536 C549	P534-P536 VanDerWaalsContact C-CD 3.43Å; P534-P536 WeakPolarHBondContact O-CD 3.46Å; P534-C549 VanDerWaalsContact O-CB 3.27Å; P534-C549 WeakPolarHBondContact O-CB 3.25Å
535	G	94.8	Very high	94	Very high	3 Å²	3	61.4 Å²	61.4	3%	0.031	32%	0.318	C	S	.	.			trans	-111.4	75.2	176.8	0	0	0	0	0	111.5	S525 F537 Y547 Y548	S525-G535 PolarHBondContact O-N 3.09Å; G535-F537 PolarHBondContact O-N 2.89Å; G535-Y547 WeakPolarHBondContact O-CD1 3.14Å; G535-Y548 CarbonylContact C-O 3.49Å; G535-Y548 VanDerWaalsContact CA-O 3.26Å; G535-Y548 WeakPolarHBondContact CA-O 3.36Å
536	P	93.1	Very high	94.1	Very high	45 Å²	45	64 Å²	64	29%	0.292	33%	0.326	S	S	.	.			trans	-69.4	-17.7	-175.9	29.4	-36.8	0	0	0	114.1	P534 M569	P534-P536 VanDerWaalsContact C-CD 3.43Å; P534-P536 WeakPolarHBondContact O-CD 3.46Å; P536-M569 WeakPolarHBondContact O-CG 3.35Å
537	F	93.8	Very high	94	Very high	5 Å²	5	60.9 Å²	60.9	2%	0.022	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	124	-178.4	-48.8	-61.4	0	0	0	110.6	I287 E288 G535 Y547 Y548 R550 W553 P567 L568 M569	I287-F537 HydrophobicContact CB-CE1 4.18Å; I287-F537 HydrophobicContact CB-CZ 4.22Å; I287-F537 HydrophobicContact CD1-CD2 4.38Å; I287-F537 HydrophobicContact CD1-CE2 4.2Å; I287-F537 HydrophobicContact CG2-CB 4.49Å; I287-F537 HydrophobicContact CG2-CD1 3.46Å; I287-F537 VanDerWaalsContact CG2-CD1 3.46Å; I287-F537 HydrophobicContact CG2-CD2 4.09Å; I287-F537 HydrophobicContact CG2-CE1 3.57Å; I287-F537 HydrophobicContact CG2-CE2 4.18Å; I287-F537 HydrophobicContact CG2-CG 3.74Å; I287-F537 HydrophobicContact CG2-CZ 3.95Å; E288-F537 HydrophobicContact CG-CE1 4.14Å; E288-F537 HydrophobicContact CG-CZ 4.2Å; E288-F537 WeakPolarHBondContact OE1-CZ 3.47Å; G535-F537 PolarHBondContact O-N 2.89Å; F537-Y547 CarbonylContact O-C 3.36Å; F537-Y547 WeakPolarHBondContact O-CA 3.17Å; F537-Y548 PolarHBondContact N-O 3.1Å; F537-Y548 PolarHBondContact O-N 3.45Å; F537-R550 HydrophobicContact CE2-CB 4.04Å; F537-W553 HydrophobicContact CB-CE3 3.83Å; F537-W553 HydrophobicContact CB-CZ3 4.37Å; F537-P567 HydrophobicContact CB-CB 4.5Å; F537-L568 CarbonylContact C-O 3.55Å; F537-L568 WeakPolarHBondContact CA-O 3.39Å; F537-M569 HydrophobicContact CD1-CB 4.37Å; F537-M569 HydrophobicContact CD1-SD 4.17Å; F537-M569 HydrophobicContact CE1-SD 3.69Å
538	F	94.7	Very high	94	Very high	10 Å²	10	61 Å²	61	4%	0.044	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	130.2	172.6	-174.4	-90.1	0	0	0	110.2	P520 L522 F545 K546 Y547 L568	P520-F538 HydrophobicContact CB-CE1 4.19Å; P520-F538 HydrophobicContact CG-CD1 4.32Å; P520-F538 HydrophobicContact CG-CE1 3.82Å; L522-F538 HydrophobicContact CD1-CB 4.15Å; L522-F538 HydrophobicContact CD2-CB 3.59Å; L522-F538 HydrophobicContact CD2-CD1 3.99Å; L522-F538 HydrophobicContact CD2-CD2 4.15Å; L522-F538 HydrophobicContact CD2-CG 3.63Å; F538-F545 HydrophobicContact CE1-CD2 4.17Å; F538-F545 HydrophobicContact CE1-CE2 4.05Å; F538-F545 HydrophobicContact CE1-CZ 4.3Å; F538-F545 AromaticContact CZ-CD1 3.9Å; F538-F545 HydrophobicContact CZ-CD1 3.9Å; F538-F545 HydrophobicContact CZ-CD2 4.06Å; F538-F545 AromaticContact CZ-CE1 3.9Å; F538-F545 HydrophobicContact CZ-CE1 3.9Å; F538-F545 HydrophobicContact CZ-CE2 4.06Å; F538-F545 AromaticContact CZ-CG 3.99Å; F538-F545 HydrophobicContact CZ-CG 3.99Å; F538-F545 AromaticContact CZ-CZ 3.98Å; F538-F545 HydrophobicContact CZ-CZ 3.98Å; F538-K546 WeakPolarHBondContact CA-O 3.44Å; F538-K546 WeakPolarHBondContact CD2-O 3.43Å; F538-Y547 HydrophobicContact CB-CD1 4.01Å; F538-Y547 HydrophobicContact CB-CE1 4.04Å; F538-Y547 AromaticContact CD2-CD1 3.83Å; F538-Y547 HydrophobicContact CD2-CD1 3.83Å; F538-Y547 AromaticContact CD2-CD2 3.77Å; F538-Y547 HydrophobicContact CD2-CD2 3.77Å; F538-Y547 AromaticContact CD2-CE1 3.8Å; F538-Y547 HydrophobicContact CD2-CE1 3.8Å; F538-Y547 AromaticContact CD2-CE2 3.71Å; F538-Y547 HydrophobicContact CD2-CE2 3.71Å; F538-Y547 AromaticContact CD2-CG 3.83Å; F538-Y547 HydrophobicContact CD2-CG 3.83Å; F538-Y547 AromaticContact CD2-CZ 3.74Å; F538-Y547 HydrophobicContact CE2-CD2 4.15Å; F538-Y547 AromaticContact CE2-CE2 3.99Å; F538-Y547 HydrophobicContact CE2-CE2 3.99Å; F538-Y547 HydrophobicContact CG-CD1 4.42Å; F538-Y547 HydrophobicContact CG-CE1 4.33Å; F538-L568 HydrophobicContact CB-CB 4.32Å; F538-L568 HydrophobicContact CD1-CD1 4.34Å; F538-L568 PolarHBondContact N-O 3.26Å; F538-L568 WeakPolarHBondContact O-CB 3.27Å; F538-L568 PolarHBondContact O-N 2.81Å
539	C	94	Very high	93.9	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	118.7	172.9	-171.4	0	0	0	0	109.5	D541 C544 F545 K546 Y548 W553 H557 H565	C539-D541 VanDerWaalsContact C-N 3.34Å; C539-C544 HydrophobicContact CB-CB 3.64Å; C539-C544 WeakPolarHBondContact SG-CB 3.38Å; C539-F545 VanDerWaalsContact O-CA 3.25Å; C539-F545 WeakPolarHBondContact O-CA 3.29Å; C539-F545 PolarHBondContact O-N 3.19Å; C539-K546 PolarHBondContact N-O 3.43Å; C539-Y548 HydrophobicContact CB-CD2 4.23Å; C539-Y548 HydrophobicContact CB-CE2 3.71Å; C539-W553 HydrophobicContact CB-CH2 3.87Å; C539-W553 HydrophobicContact CB-CZ3 3.58Å; C539-H557 PolarHBondContact SG-NE2 2.86Å; C539-H557 VanDerWaalsContact SG-NE2 3.42Å; C539-H565 PolarHBondContact SG-ND1 2.87Å; C539-H565 VanDerWaalsContact SG-ND1 3.43Å
540	R	91.4	Very high	93.7	Very high	51 Å²	51	58 Å²	58	19%	0.192	29%	0.289	C	S	.	.			trans	-75.7	-18.9	-178.9	49.2	174.5	-83.8	142.8	-5.6	114.6	D519 F545 L568	D519-R540 IonicContact OD1-NH1 2.81Å; D519-R540 PolarHBondContact OD1-NH1 2.61Å; R540-F545 WeakPolarHBondContact O-CD2 3.43Å; R540-L568 HydrophobicContact CB-CD1 3.86Å; R540-L568 HydrophobicContact CB-CG 4.23Å; R540-L568 HydrophobicContact CG-CD1 4.33Å; R540-L568 HydrophobicContact CG-CD2 4.44Å; R540-L568 HydrophobicContact CG-CG 4.23Å
541	D	91.5	Very high	93.6	Very high	51 Å²	51	60.4 Å²	60.4	27%	0.273	31%	0.306	S	S	.	.	S	Bend	trans	-74.7	135.9	-174.3	-61.9	-74.1	0	0	0	111.9	C539 A543 C544 F545 H565	C539-D541 VanDerWaalsContact C-N 3.34Å; D541-A543 PolarHBondContact O-N 2.8Å; D541-A543 VanDerWaalsContact O-N 3.07Å; D541-C544 PolarHBondContact O-N 3.27Å; D541-F545 PolarHBondContact O-N 3.29Å; D541-H565 WeakPolarHBondContact OD2-CA 3.44Å; D541-H565 WeakPolarHBondContact OD2-CB 3.38Å; D541-H565 IonicContact OD2-CD2 3.71Å; D541-H565 IonicContact OD2-CG 2.72Å
542	Q	89	Confident	93.5	Very high	124 Å²	124	55.3 Å²	55.3	58%	0.579	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-26.7	-165.5	-172.4	64.3	33.2	0	0	114.3	C544	Q542-C544 VanDerWaalsContact C-N 3.3Å
543	A	90.8	Very high	93.4	Very high	79 Å²	79	45.9 Å²	45.9	65%	0.653	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72	-23.6	176	0	0	0	0	0	113.2	D541	D541-A543 PolarHBondContact O-N 2.8Å; D541-A543 VanDerWaalsContact O-N 3.07Å
544	C	92.9	Very high	93.3	Very high	6 Å²	6	43.9 Å²	43.9	4%	0.041	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.2	-61.7	-178	-70.8	0	0	0	0	111.2	C539 D541 Q542 K546 Y548 H557 H565	C539-C544 HydrophobicContact CB-CB 3.64Å; C539-C544 WeakPolarHBondContact SG-CB 3.38Å; D541-C544 PolarHBondContact O-N 3.27Å; Q542-C544 VanDerWaalsContact C-N 3.3Å; C544-K546 VanDerWaalsContact C-N 3.29Å; C544-K546 WeakPolarHBondContact O-CB 3.42Å; C544-K546 WeakPolarHBondContact O-CD 3.46Å; C544-K546 WeakPolarHBondContact O-CE 3.36Å; C544-K546 WeakPolarHBondContact O-CG 3.38Å; C544-K546 PolarHBondContact O-N 3.13Å; C544-K546 VanDerWaalsContact O-N 3.14Å; C544-Y548 HydrophobicContact CB-CE2 4.36Å; C544-Y548 WeakPolarHBondContact CB-OH 3.47Å; C544-H557 PolarHBondContact SG-NE2 3.26Å; C544-H565 VanDerWaalsContact SG-CE1 3.54Å; C544-H565 PolarHBondContact SG-ND1 3.13Å; C544-H565 VanDerWaalsContact SG-ND1 3.45Å
545	F	93.2	Very high	93.1	Very high	48 Å²	48	48.9 Å²	48.9	21%	0.211	24%	0.244	C	C	.	.			trans	39.8	46.1	175.9	-146.2	-99.2	0	0	0	116.1	Y496 L497 V500 P520 F538 C539 R540 D541	Y496-F545 HydrophobicContact CE1-CE1 4.35Å; Y496-F545 HydrophobicContact CE1-CZ 4.14Å; L497-F545 HydrophobicContact CD2-CE1 4.32Å; L497-F545 HydrophobicContact CD2-CZ 4.09Å; V500-F545 HydrophobicContact CG1-CE2 3.98Å; V500-F545 HydrophobicContact CG1-CZ 4.4Å; P520-F545 HydrophobicContact CG-CE2 4.36Å; P520-F545 HydrophobicContact CG-CZ 4.33Å; F538-F545 HydrophobicContact CE1-CD2 4.17Å; F538-F545 HydrophobicContact CE1-CE2 4.05Å; F538-F545 HydrophobicContact CE1-CZ 4.3Å; F538-F545 AromaticContact CZ-CD1 3.9Å; F538-F545 HydrophobicContact CZ-CD1 3.9Å; F538-F545 HydrophobicContact CZ-CD2 4.06Å; F538-F545 AromaticContact CZ-CE1 3.9Å; F538-F545 HydrophobicContact CZ-CE1 3.9Å; F538-F545 HydrophobicContact CZ-CE2 4.06Å; F538-F545 AromaticContact CZ-CG 3.99Å; F538-F545 HydrophobicContact CZ-CG 3.99Å; F538-F545 AromaticContact CZ-CZ 3.98Å; F538-F545 HydrophobicContact CZ-CZ 3.98Å; C539-F545 VanDerWaalsContact O-CA 3.25Å; C539-F545 WeakPolarHBondContact O-CA 3.29Å; C539-F545 PolarHBondContact O-N 3.19Å; R540-F545 WeakPolarHBondContact O-CD2 3.43Å; D541-F545 PolarHBondContact O-N 3.29Å
546	K	94.5	Very high	92.9	Very high	91 Å²	91	50.8 Å²	50.8	40%	0.396	25%	0.253	S	S	.	.	S	Bend	trans	-145.4	162.6	-168.6	-78.9	160.3	-159.3	155.7	0	112.7	Q528 F538 C539 C544 Y548	Q528-K546 HydrophobicContact CB-CB 4.38Å; Q528-K546 HydrophobicContact CB-CG 4.32Å; F538-K546 WeakPolarHBondContact CA-O 3.44Å; F538-K546 WeakPolarHBondContact CD2-O 3.43Å; C539-K546 PolarHBondContact N-O 3.43Å; C544-K546 VanDerWaalsContact C-N 3.29Å; C544-K546 WeakPolarHBondContact O-CB 3.42Å; C544-K546 WeakPolarHBondContact O-CD 3.46Å; C544-K546 WeakPolarHBondContact O-CE 3.36Å; C544-K546 WeakPolarHBondContact O-CG 3.38Å; C544-K546 PolarHBondContact O-N 3.13Å; C544-K546 VanDerWaalsContact O-N 3.14Å; K546-Y548 HydrophobicContact CB-CD2 4.38Å; K546-Y548 HydrophobicContact CB-CE2 3.66Å; K546-Y548 WeakPolarHBondContact O-CD2 3.24Å; K546-Y548 WeakPolarHBondContact O-CE2 3.46Å
547	Y	95.3	Very high	92.7	Very high	28 Å²	28	49.2 Å²	49.2	11%	0.11	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	135.8	167.6	-64.6	-86.4	0	0	0	112.2	L522 E523 S525 Q528 G535 F537 F538	L522-Y547 WeakPolarHBondContact CA-OH 3.42Å; L522-Y547 HydrophobicContact CB-CE1 4.48Å; L522-Y547 HydrophobicContact CD2-CE1 4.08Å; E523-Y547 PolarHBondContact N-OH 3.42Å; S525-Y547 VanDerWaalsContact OG-CE2 3.27Å; S525-Y547 WeakPolarHBondContact OG-CE2 3.42Å; Q528-Y547 PolarHBondContact N-O 3.43Å; G535-Y547 WeakPolarHBondContact O-CD1 3.14Å; F537-Y547 CarbonylContact O-C 3.36Å; F537-Y547 WeakPolarHBondContact O-CA 3.17Å; F538-Y547 HydrophobicContact CB-CD1 4.01Å; F538-Y547 HydrophobicContact CB-CE1 4.04Å; F538-Y547 AromaticContact CD2-CD1 3.83Å; F538-Y547 HydrophobicContact CD2-CD1 3.83Å; F538-Y547 AromaticContact CD2-CD2 3.77Å; F538-Y547 HydrophobicContact CD2-CD2 3.77Å; F538-Y547 AromaticContact CD2-CE1 3.8Å; F538-Y547 HydrophobicContact CD2-CE1 3.8Å; F538-Y547 AromaticContact CD2-CE2 3.71Å; F538-Y547 HydrophobicContact CD2-CE2 3.71Å; F538-Y547 AromaticContact CD2-CG 3.83Å; F538-Y547 HydrophobicContact CD2-CG 3.83Å; F538-Y547 AromaticContact CD2-CZ 3.74Å; F538-Y547 HydrophobicContact CE2-CD2 4.15Å; F538-Y547 AromaticContact CE2-CE2 3.99Å; F538-Y547 HydrophobicContact CE2-CE2 3.99Å; F538-Y547 HydrophobicContact CG-CD1 4.42Å; F538-Y547 HydrophobicContact CG-CE1 4.33Å
548	Y	95.2	Very high	92.3	Very high	2 Å²	2	53.1 Å²	53.1	1%	0.008	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	142.4	-176	-63.1	-99.4	0	0	0	111	V529 G535 F537 C539 C544 K546 C552 W553 Q556	V529-Y548 HydrophobicContact CG2-CD1 3.71Å; V529-Y548 HydrophobicContact CG2-CE1 3.51Å; G535-Y548 CarbonylContact C-O 3.49Å; G535-Y548 VanDerWaalsContact CA-O 3.26Å; G535-Y548 WeakPolarHBondContact CA-O 3.36Å; F537-Y548 PolarHBondContact N-O 3.1Å; F537-Y548 PolarHBondContact O-N 3.45Å; C539-Y548 HydrophobicContact CB-CD2 4.23Å; C539-Y548 HydrophobicContact CB-CE2 3.71Å; C544-Y548 HydrophobicContact CB-CE2 4.36Å; C544-Y548 WeakPolarHBondContact CB-OH 3.47Å; K546-Y548 HydrophobicContact CB-CD2 4.38Å; K546-Y548 HydrophobicContact CB-CE2 3.66Å; K546-Y548 WeakPolarHBondContact O-CD2 3.24Å; K546-Y548 WeakPolarHBondContact O-CE2 3.46Å; Y548-C552 HydrophobicContact CD1-CB 4.13Å; Y548-W553 HydrophobicContact CD2-CE3 4.09Å; Y548-W553 HydrophobicContact CD2-CZ3 4.37Å; Y548-W553 HydrophobicContact CG-CE3 4.25Å; Y548-Q556 HydrophobicContact CD1-CB 4.44Å; Y548-Q556 HydrophobicContact CE1-CB 3.86Å; Y548-Q556 HydrophobicContact CE1-CG 3.86Å
549	C	94.7	Very high	91.5	Very high	14 Å²	14	57.7 Å²	57.7	10%	0.095	29%	0.292	C	S	.	.			trans	-81.5	163.7	159.9	69.5	0	0	0	0	110.2	C527 Q533 P534 S551 C552 W553	C527-C549 HydrophobicContact CB-CB 3.87Å; C527-C549 PolarHBondContact SG-N 3.14Å; C527-C549 VanDerWaalsContact SG-SG 3.68Å; Q533-C549 HydrophobicContact CB-CB 4.3Å; P534-C549 VanDerWaalsContact O-CB 3.27Å; P534-C549 WeakPolarHBondContact O-CB 3.25Å; C549-S551 VanDerWaalsContact C-N 3.34Å; C549-S551 PolarHBondContact O-N 3.26Å; C549-C552 PolarHBondContact O-N 2.85Å; C549-W553 PolarHBondContact O-N 2.77Å
550	R	92.9	Very high	90.4	Very high	87 Å²	87	64.7 Å²	64.7	33%	0.328	33%	0.329	S	S	.	.	H	α-helix	trans	-46.8	-51.9	-176.6	-172.7	168.6	-178.3	102.2	-0.8	113	D282 I287 E288 F537 C552 W553 H554	D282-R550 IonicContact OD2-NH2 3.73Å; I287-R550 HydrophobicContact CD1-CG 4.07Å; E288-R550 IonicContact OE1-CZ 2.94Å; E288-R550 IonicContact OE1-NH1 3.5Å; E288-R550 PolarHBondContact OE1-NH1 2.94Å; E288-R550 IonicContact OE2-NH1 3.96Å; E288-R550 PolarHBondContact OE2-NH1 3.17Å; F537-R550 HydrophobicContact CE2-CB 4.04Å; R550-C552 PolarHBondContact O-N 3.44Å; R550-W553 PolarHBondContact O-N 2.72Å; R550-H554 PolarHBondContact O-CD2 3.29Å; R550-H554 PolarHBondContact O-N 3.26Å
551	S	93.3	Very high	89.8	Confident	92 Å²	92	69.2 Å²	69.2	64%	0.643	36%	0.356	S	S	*	.	H	α-helix	trans	-62.3	-42.2	-179.6	-43.7	0	0	0	0	113.2	C549 W555	C549-S551 VanDerWaalsContact C-N 3.34Å; C549-S551 PolarHBondContact O-N 3.26Å; S551-W555 WeakPolarHBondContact O-CB 3.39Å; S551-W555 PolarHBondContact O-N 2.93Å
552	C	94.6	Very high	89.5	Confident	18 Å²	18	67.9 Å²	67.9	12%	0.122	35%	0.349	C	S	.	.	H	α-helix	trans	-73.4	-28.9	178.2	-66.4	0	0	0	0	112.5	V529 Y548 C549 R550 Q556	V529-C552 HydrophobicContact CB-CB 4.01Å; V529-C552 HydrophobicContact CG1-CB 4.27Å; V529-C552 HydrophobicContact CG2-CB 4.34Å; Y548-C552 HydrophobicContact CD1-CB 4.13Å; C549-C552 PolarHBondContact O-N 2.85Å; R550-C552 PolarHBondContact O-N 3.44Å; C552-Q556 VanDerWaalsContact O-CB 3.3Å; C552-Q556 WeakPolarHBondContact O-CB 3.21Å; C552-Q556 PolarHBondContact O-N 2.88Å
553	W	93.6	Very high	89.1	Confident	15 Å²	15	64.5 Å²	64.5	6%	0.057	34%	0.339	C	S	.	.	H	α-helix	trans	-64.1	-54.3	171.6	-178.6	-79.8	0	0	0	110.6	I287 F537 C539 Y548 C549 R550 W555 Q556 H557 P567	I287-W553 HydrophobicContact CD1-CB 3.82Å; I287-W553 HydrophobicContact CD1-CG 3.67Å; I287-W553 HydrophobicContact CG1-CG 4.45Å; F537-W553 HydrophobicContact CB-CE3 3.83Å; F537-W553 HydrophobicContact CB-CZ3 4.37Å; C539-W553 HydrophobicContact CB-CH2 3.87Å; C539-W553 HydrophobicContact CB-CZ3 3.58Å; Y548-W553 HydrophobicContact CD2-CE3 4.09Å; Y548-W553 HydrophobicContact CD2-CZ3 4.37Å; Y548-W553 HydrophobicContact CG-CE3 4.25Å; C549-W553 PolarHBondContact O-N 2.77Å; R550-W553 PolarHBondContact O-N 2.72Å; W553-W555 VanDerWaalsContact C-N 3.31Å; W553-W555 PolarHBondContact O-N 2.76Å; W553-Q556 PolarHBondContact O-N 3.28Å; W553-H557 AromaticContact CD1-ND1 3.92Å; W553-H557 AromaticContact CD2-CE1 3.7Å; W553-H557 AromaticContact CD2-ND1 3.32Å; W553-H557 VanDerWaalsContact CD2-ND1 3.32Å; W553-H557 AromaticContact CE2-CE1 3.9Å; W553-H557 AromaticContact CE2-CG 3.84Å; W553-H557 AromaticContact CE2-ND1 3.38Å; W553-H557 AromaticContact CE3-CE1 3.58Å; W553-H557 AromaticContact CE3-ND1 3.72Å; W553-H557 AromaticContact CG-ND1 3.65Å; W553-H557 AromaticContact CH2-CE1 3.81Å; W553-H557 AromaticContact CZ2-CE1 3.95Å; W553-H557 AromaticContact CZ2-CG 3.99Å; W553-H557 AromaticContact CZ2-ND1 3.77Å; W553-H557 AromaticContact CZ3-CE1 3.66Å; W553-H557 AromaticContact NE1-ND1 3.77Å; W553-H557 WeakPolarHBondContact O-CB 3.27Å; W553-H557 PolarHBondContact O-N 3.05Å; W553-H557 PolarHBondContact O-ND1 3.39Å; W553-P567 HydrophobicContact CD2-CB 4.41Å; W553-P567 HydrophobicContact CE3-CB 4.31Å; W553-P567 HydrophobicContact CH2-CB 3.68Å; W553-P567 HydrophobicContact CZ2-CB 3.74Å; W553-P567 HydrophobicContact CZ2-CG 4.18Å; W553-P567 HydrophobicContact CZ3-CB 3.94Å
554	H	91.5	Very high	88.8	Confident	76 Å²	76	66.3 Å²	66.3	35%	0.352	34%	0.338	S	S	.	.	H	α-helix	trans	-60.6	-40	179	-68.3	-69.6	0	0	0	111.8	I287 R550 S558	I287-H554 WeakPolarHBondContact CD1-NE2 3.17Å; R550-H554 PolarHBondContact O-CD2 3.29Å; R550-H554 PolarHBondContact O-N 3.26Å; H554-S558 WeakPolarHBondContact O-CB 3.33Å; H554-S558 PolarHBondContact O-N 3.05Å; H554-S558 PolarHBondContact O-OG 2.66Å
555	W	90.8	Very high	88.6	Confident	181 Å²	181	67.2 Å²	67.2	69%	0.686	34%	0.341	S	S	*	.	H	α-helix	trans	-64.2	-43.5	177.5	-176	82	0	0	0	112.6	S551 W553 S558	S551-W555 WeakPolarHBondContact O-CB 3.39Å; S551-W555 PolarHBondContact O-N 2.93Å; W553-W555 VanDerWaalsContact C-N 3.31Å; W553-W555 PolarHBondContact O-N 2.76Å; W555-S558 PolarHBondContact O-OG 3.03Å
556	Q	89.4	Confident	88.4	Confident	44 Å²	44	70 Å²	70	21%	0.206	35%	0.35	C	S	.	.	H	α-helix	trans	-74.4	-38.6	-179.3	-172	69	69.6	0	0	113.2	Y548 C552 W553 L562	Y548-Q556 HydrophobicContact CD1-CB 4.44Å; Y548-Q556 HydrophobicContact CE1-CB 3.86Å; Y548-Q556 HydrophobicContact CE1-CG 3.86Å; C552-Q556 VanDerWaalsContact O-CB 3.3Å; C552-Q556 WeakPolarHBondContact O-CB 3.21Å; C552-Q556 PolarHBondContact O-N 2.88Å; W553-Q556 PolarHBondContact O-N 3.28Å; Q556-L562 HydrophobicContact CG-CD1 4.38Å; Q556-L562 VanDerWaalsContact O-CD1 3.31Å; Q556-L562 WeakPolarHBondContact O-CD1 3.19Å
557	H	90.6	Very high	88.3	Confident	12 Å²	12	65.7 Å²	65.7	6%	0.056	33%	0.331	C	S	.	.	H	α-helix	trans	-105.5	13.1	-170.9	-52.8	100.8	0	0	0	113.8	C539 C544 W553 M559 L562 S563 H565	C539-H557 PolarHBondContact SG-NE2 2.86Å; C539-H557 VanDerWaalsContact SG-NE2 3.42Å; C544-H557 PolarHBondContact SG-NE2 3.26Å; W553-H557 AromaticContact CD1-ND1 3.92Å; W553-H557 AromaticContact CD2-CE1 3.7Å; W553-H557 AromaticContact CD2-ND1 3.32Å; W553-H557 VanDerWaalsContact CD2-ND1 3.32Å; W553-H557 AromaticContact CE2-CE1 3.9Å; W553-H557 AromaticContact CE2-CG 3.84Å; W553-H557 AromaticContact CE2-ND1 3.38Å; W553-H557 AromaticContact CE3-CE1 3.58Å; W553-H557 AromaticContact CE3-ND1 3.72Å; W553-H557 AromaticContact CG-ND1 3.65Å; W553-H557 AromaticContact CH2-CE1 3.81Å; W553-H557 AromaticContact CZ2-CE1 3.95Å; W553-H557 AromaticContact CZ2-CG 3.99Å; W553-H557 AromaticContact CZ2-ND1 3.77Å; W553-H557 AromaticContact CZ3-CE1 3.66Å; W553-H557 AromaticContact NE1-ND1 3.77Å; W553-H557 WeakPolarHBondContact O-CB 3.27Å; W553-H557 PolarHBondContact O-N 3.05Å; W553-H557 PolarHBondContact O-ND1 3.39Å; H557-M559 VanDerWaalsContact C-N 3.34Å; H557-L562 PolarHBondContact CD2-O 2.73Å; H557-S563 VanDerWaalsContact O-CA 3.24Å; H557-S563 WeakPolarHBondContact O-CA 3.31Å; H557-H565 AromaticContact CD2-CG 3.85Å; H557-H565 AromaticContact CD2-ND1 3.44Å; H557-H565 PolarHBondContact CD2-ND1 2.83Å; H557-H565 AromaticContact NE2-ND1 3.53Å
558	S	84.2	Confident	88.2	Confident	86 Å²	86	64.7 Å²	64.7	60%	0.601	33%	0.328	S	S	*	.	S	Bend	trans	-85.2	-8.5	165.7	47.4	0	0	0	0	113	H554 W555	H554-S558 WeakPolarHBondContact O-CB 3.33Å; H554-S558 PolarHBondContact O-N 3.05Å; H554-S558 PolarHBondContact O-OG 2.66Å; W555-S558 PolarHBondContact O-OG 3.03Å
559	M	77.5	Confident	87.9	Confident	106 Å²	106	66.2 Å²	66.2	52%	0.522	34%	0.336	S	S	.	.	S	Bend	trans	-74.3	133.1	171.7	-57	-179	71.8	0	0	110.1	H557 I561 L562 S563	H557-M559 VanDerWaalsContact C-N 3.34Å; M559-I561 PolarHBondContact O-N 3.12Å; M559-L562 CarbonylContact O-C 3.51Å; M559-L562 PolarHBondContact O-N 3.06Å; M559-L562 HydrophobicContact SD-CD1 4.32Å; M559-S563 PolarHBondContact O-N 3.45Å
560	D	71.6	Confident	87.5	Confident	147 Å²	147	70.3 Å²	70.3	79%	0.786	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-29.1	-173.4	-61.3	-54.7	0	0	0	115.1	L562 S563	D560-L562 VanDerWaalsContact C-N 3.34Å; D560-S563 PolarHBondContact O-OG 3.03Å
561	I	79	Confident	86.4	Confident	147 Å²	147	68.9 Å²	68.9	75%	0.754	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-28.6	178.5	-59.7	170.3	0	0	0	111.5	M559	M559-I561 PolarHBondContact O-N 3.12Å
562	L	84.1	Confident	84.8	Confident	23 Å²	23	70.5 Å²	70.5	12%	0.12	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.8	-6.9	-171.3	-54.4	177.2	0	0	0	112.9	Q556 H557 M559 D560 N564 H565	Q556-L562 HydrophobicContact CG-CD1 4.38Å; Q556-L562 VanDerWaalsContact O-CD1 3.31Å; Q556-L562 WeakPolarHBondContact O-CD1 3.19Å; H557-L562 PolarHBondContact CD2-O 2.73Å; M559-L562 CarbonylContact O-C 3.51Å; M559-L562 PolarHBondContact O-N 3.06Å; M559-L562 HydrophobicContact SD-CD1 4.32Å; D560-L562 VanDerWaalsContact C-N 3.34Å; L562-N564 PolarHBondContact O-N 2.75Å; L562-H565 VanDerWaalsContact CD2-CE1 3.43Å; L562-H565 WeakPolarHBondContact CD2-CE1 3.3Å; L562-H565 VanDerWaalsContact O-CB 3.29Å; L562-H565 WeakPolarHBondContact O-CB 3.26Å; L562-H565 VanDerWaalsContact O-CG 3.3Å; L562-H565 PolarHBondContact O-N 2.73Å; L562-H565 VanDerWaalsContact O-N 3.14Å
563	S	80.9	Confident	82.6	Confident	53 Å²	53	75.2 Å²	75.2	37%	0.371	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-17.2	-178.6	61.6	0	0	0	0	114.7	H557 M559 D560	H557-S563 VanDerWaalsContact O-CA 3.24Å; H557-S563 WeakPolarHBondContact O-CA 3.31Å; M559-S563 PolarHBondContact O-N 3.45Å; D560-S563 PolarHBondContact O-OG 3.03Å
564	N	84.6	Confident	79.8	Confident	117 Å²	117	80.9 Å²	80.9	63%	0.626	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-11.4	175	-67.6	-70.4	0	0	0	113.6	L562	L562-N564 PolarHBondContact O-N 2.75Å
565	H	90	Very high	77.2	Confident	24 Å²	24	88 Å²	88	11%	0.111	42%	0.419	C	S	.	.			trans	-64.5	139.8	178.5	-68.7	-172.2	0	0	0	111.2	C539 D541 C544 H557 L562	C539-H565 PolarHBondContact SG-ND1 2.87Å; C539-H565 VanDerWaalsContact SG-ND1 3.43Å; D541-H565 WeakPolarHBondContact OD2-CA 3.44Å; D541-H565 WeakPolarHBondContact OD2-CB 3.38Å; D541-H565 IonicContact OD2-CD2 3.71Å; D541-H565 IonicContact OD2-CG 2.72Å; C544-H565 VanDerWaalsContact SG-CE1 3.54Å; C544-H565 PolarHBondContact SG-ND1 3.13Å; C544-H565 VanDerWaalsContact SG-ND1 3.45Å; H557-H565 AromaticContact CD2-CG 3.85Å; H557-H565 AromaticContact CD2-ND1 3.44Å; H557-H565 PolarHBondContact CD2-ND1 2.83Å; H557-H565 AromaticContact NE2-ND1 3.53Å; L562-H565 VanDerWaalsContact CD2-CE1 3.43Å; L562-H565 WeakPolarHBondContact CD2-CE1 3.3Å; L562-H565 VanDerWaalsContact O-CB 3.29Å; L562-H565 WeakPolarHBondContact O-CB 3.26Å; L562-H565 VanDerWaalsContact O-CG 3.3Å; L562-H565 PolarHBondContact O-N 2.73Å; L562-H565 VanDerWaalsContact O-N 3.14Å
566	R	89.1	Confident	74.2	Confident	108 Å²	108	86 Å²	86	41%	0.408	42%	0.422	S	S	.	.			trans	-106.7	133.7	-176.4	-61.2	-57.8	177.3	-167.7	-4.6	113.1	E290	E290-R566 IonicContact OE1-NH1 3.23Å; E290-R566 PolarHBondContact OE1-NH1 3.46Å; E290-R566 WeakPolarHBondContact OE2-CD 3.35Å; E290-R566 IonicContact OE2-CZ 2.66Å; E290-R566 IonicContact OE2-NE 3.17Å; E290-R566 IonicContact OE2-NH1 2.76Å; E290-R566 PolarHBondContact OE2-NH1 3.16Å
567	P	91.8	Very high	71.4	Confident	0 Å²	0	89 Å²	89	0%	0	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	127.8	-179.9	30.8	-34.4	0	0	0	111.1	I287 E290 A291 F537 W553	I287-P567 HydrophobicContact CG2-CB 3.5Å; I287-P567 VanDerWaalsContact CG2-CB 3.5Å; I287-P567 HydrophobicContact CG2-CG 3.6Å; I287-P567 WeakPolarHBondContact O-CG 3.29Å; E290-P567 HydrophobicContact CB-CG 3.75Å; E290-P567 WeakPolarHBondContact OE2-CD 3.36Å; A291-P567 VanDerWaalsContact CA-O 3.29Å; A291-P567 WeakPolarHBondContact CA-O 3.11Å; A291-P567 HydrophobicContact CB-CB 4.39Å; A291-P567 HydrophobicContact CB-CG 4.22Å; A291-P567 VanDerWaalsContact CB-O 3.29Å; A291-P567 WeakPolarHBondContact CB-O 3.48Å; F537-P567 HydrophobicContact CB-CB 4.5Å; W553-P567 HydrophobicContact CD2-CB 4.41Å; W553-P567 HydrophobicContact CE3-CB 4.31Å; W553-P567 HydrophobicContact CH2-CB 3.68Å; W553-P567 HydrophobicContact CZ2-CB 3.74Å; W553-P567 HydrophobicContact CZ2-CG 4.18Å; W553-P567 HydrophobicContact CZ3-CB 3.94Å
568	L	92.8	Very high	68.4	Low	6 Å²	6	97.3 Å²	97.3	3%	0.031	51%	0.507	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	143.6	163.7	-53.5	-171.3	0	0	0	109.7	H294 D519 P520 L522 F537 F538 R540	H294-L568 WeakPolarHBondContact CD2-CD2 3.35Å; H294-L568 WeakPolarHBondContact NE2-CD2 3.44Å; D519-L568 HydrophobicContact CB-CD1 4.03Å; P520-L568 HydrophobicContact CG-CD1 4.38Å; L522-L568 HydrophobicContact CD1-CB 3.91Å; F537-L568 CarbonylContact C-O 3.55Å; F537-L568 WeakPolarHBondContact CA-O 3.39Å; F538-L568 HydrophobicContact CB-CB 4.32Å; F538-L568 HydrophobicContact CD1-CD1 4.34Å; F538-L568 PolarHBondContact N-O 3.26Å; F538-L568 WeakPolarHBondContact O-CB 3.27Å; F538-L568 PolarHBondContact O-N 2.81Å; R540-L568 HydrophobicContact CB-CD1 3.86Å; R540-L568 HydrophobicContact CB-CG 4.23Å; R540-L568 HydrophobicContact CG-CD1 4.33Å; R540-L568 HydrophobicContact CG-CD2 4.44Å; R540-L568 HydrophobicContact CG-CG 4.23Å
569	M	89.8	Confident	67.6	Low	35 Å²	35	97.9 Å²	97.9	17%	0.172	50%	0.502	C	S	.	.			trans	-148	130.8	176.1	-177.3	175.8	65.9	0	0	110.1	E288 A291 P536 F537	E288-M569 HydrophobicContact CB-CE 4.28Å; E288-M569 HydrophobicContact CG-CE 4.43Å; A291-M569 HydrophobicContact CB-CB 3.76Å; A291-M569 HydrophobicContact CB-CE 4.44Å; P536-M569 WeakPolarHBondContact O-CG 3.35Å; F537-M569 HydrophobicContact CD1-CB 4.37Å; F537-M569 HydrophobicContact CD1-SD 4.17Å; F537-M569 HydrophobicContact CE1-SD 3.69Å
570	R	85.6	Confident	67.1	Low	99 Å²	99	97.5 Å²	97.5	37%	0.374	50%	0.501	S	S	.	.			trans	-58.5	151.9	177.2	-160.7	176.7	77.5	-166.4	-4	110.9	L522 D524 Q572	L522-R570 HydrophobicContact CB-CB 4.4Å; L522-R570 WeakPolarHBondContact O-CD 3.39Å; D524-R570 VanDerWaalsContact CG-NH1 3.27Å; D524-R570 IonicContact OD1-CZ 3.01Å; D524-R570 IonicContact OD1-NH1 3.66Å; D524-R570 PolarHBondContact OD1-NH1 2.85Å; D524-R570 IonicContact OD1-NH2 2.73Å; D524-R570 PolarHBondContact OD1-NH2 2.83Å; D524-R570 IonicContact OD2-CZ 3.85Å; D524-R570 IonicContact OD2-NH1 2.96Å; D524-R570 PolarHBondContact OD2-NH1 3.34Å; D524-R570 IonicContact OD2-NH2 3.73Å; D524-R570 PolarHBondContact OD2-NH2 3.05Å; R570-Q572 PolarHBondContact O-N 2.88Å
571	N	70.2	Confident	66.9	Low	57 Å²	57	94.7 Å²	94.7	31%	0.305	49%	0.485	S	S	.	.			trans	-63.9	99.7	167.5	-76.8	-9.8	0	0	0	109.6	S197 R295	S197-N571 PolarHBondContact OG-ND2 2.96Å; R295-N571 PolarHBondContact NE-OD1 3.45Å; R295-N571 PolarHBondContact NH1-OD1 3.01Å; R295-N571 PolarHBondContact NH2-OD1 3.22Å
572	Q	59.6	Low	66.2	Low	127 Å²	127	91.6 Å²	91.6	59%	0.593	47%	0.47	S	S	*	.	P	Polyproline II helix	trans	-78.8	118.1	163.6	-60.9	-175.8	15.4	0	0	107.3	R570	R570-Q572 PolarHBondContact O-N 2.88Å
573	K	47.3	Very low	65	Low	116 Å²	116	95.9 Å²	95.9	50%	0.504	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-66.2	129	167	-149.6	178.5	-166.6	-175	0	106.5	E195 R575	E195-K573 IonicContact OE2-NZ 2.77Å; E195-K573 PolarHBondContact OE2-NZ 3.17Å; K573-R575 PolarHBondContact O-N 3.05Å; K573-R575 VanDerWaalsContact O-N 3.09Å
574	N	35.8	Very low	64	Low	134 Å²	134	98.8 Å²	98.8	72%	0.717	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-54.2	122	174.8	-81.8	21.8	0	0	0	108.3	D576	N574-D576 PolarHBondContact O-N 2.88Å
575	R	35.9	Very low	62.5	Low	226 Å²	226	97.5 Å²	97.5	85%	0.853	49%	0.491	S	S	*	.	S	Bend	trans	-82.2	-2.6	-175.4	-96.5	178.3	57.5	-158.8	-6.5	113.1	K573 S577	K573-R575 PolarHBondContact O-N 3.05Å; K573-R575 VanDerWaalsContact O-N 3.09Å; R575-S577 PolarHBondContact O-N 3.08Å
576	D	28.5	Very low	60.4	Low	139 Å²	139	103.2 Å²	103.2	74%	0.743	52%	0.52	S	S	*	.			trans	-87	41.4	-172.4	-38.1	-72.3	0	0	0	111.2	N574	N574-D576 PolarHBondContact O-N 2.88Å
577	S	30.4	Very low	58	Low	107 Å²	107	102.8 Å²	102.8	75%	0.748	53%	0.529	S	S	*	.			trans	-154	69.9	-178.8	-68.1	0	0	0	0	109	R575	R575-S577 PolarHBondContact O-N 3.08Å
578	S	28.9	Very low	55	Low	187 Å²	187	112.1 Å²	112.1	100%	1.308	58%	0.577	S	S	*	*			trans	-153.7	0	175.8	-66.3	0	0	0	0	109

Retrieved 578 of 578 residues in 402.7 ms (Link to these results)

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