A0A087YJ08_POEFO Loading...

Gliomedin

AlphaFold DB , UniProt , Accession A0A087YJ08, 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	34.4	Very low	40.1	Very low	241 Å²	241	158.6 Å²	158.6	100%	1.187	84%	0.842	S	S	*	*				0	120.7	0	-79.4	-167.5	171.7	0	0	108
2	L	32.7	Very low	41.1	Very low	138 Å²	138	152.3 Å²	152.3	72%	0.723	84%	0.842	S	S	*	*			trans	-61.6	134.3	174.9	-93.2	78.5	0	0	0	110
3	K	35.4	Very low	40.9	Very low	210 Å²	210	145.5 Å²	145.5	91%	0.913	83%	0.828	S	S	*	*			trans	-106.1	111.6	155.7	-93	-173	173.5	-176.4	0	107.9
4	Q	44.2	Very low	41.1	Very low	167 Å²	167	148.9 Å²	148.9	78%	0.78	83%	0.834	S	S	*	*			trans	-76.2	121.4	163.1	-80.6	173.5	-31.4	0	0	107.9	V6	Q4-V6 HydrophobicContact CB-CG2 4.42Å
5	A	39.2	Very low	41.3	Very low	106 Å²	106	147.5 Å²	147.5	88%	0.876	83%	0.83	S	S	*	*			trans	-93.3	108.7	158.8	0	0	0	0	0	106.5
6	V	41.1	Very low	41.4	Very low	116 Å²	116	148.3 Å²	148.3	70%	0.703	83%	0.83	S	S	*	*			trans	-95.1	122.7	173.2	175.9	0	0	0	0	107.3	Q4	Q4-V6 HydrophobicContact CB-CG2 4.42Å
7	D	38.3	Very low	42	Very low	145 Å²	145	145.3 Å²	145.3	78%	0.775	82%	0.817	S	S	*	*			trans	-105.1	115.9	161.2	-169.9	0.2	0	0	0	107.8	Q9	D7-Q9 VanDerWaalsContact C-N 3.33Å; D7-Q9 PolarHBondContact O-N 3.12Å
8	P	46.1	Very low	42.4	Very low	110 Å²	110	145.1 Å²	145.1	71%	0.714	81%	0.81	S	S	*	*			trans	-89.6	35	-163.6	35.6	-35.9	0	0	0	114.6
9	Q	43.8	Very low	43.1	Very low	172 Å²	172	147.5 Å²	147.5	80%	0.804	81%	0.805	S	S	*	*	S	Bend	trans	-144.8	75.7	174.6	-72.4	-165.4	-4.6	0	0	114.3	D7	D7-Q9 VanDerWaalsContact C-N 3.33Å; D7-Q9 PolarHBondContact O-N 3.12Å
10	K	41.7	Very low	43.9	Very low	196 Å²	196	146.1 Å²	146.1	85%	0.852	80%	0.796	S	S	*	*			trans	-178.7	124.3	148.2	-106.3	168.7	-176	-179.6	0	110.1	G12	K10-G12 PolarHBondContact O-N 3.33Å
11	P	44.7	Very low	44.7	Very low	144 Å²	144	141.2 Å²	141.2	94%	0.935	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	110.2	172.4	30.9	-26.6	0	0	0	108.8
12	G	52.1	Low	46.2	Very low	82 Å²	82	132.8 Å²	132.8	85%	0.845	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	131	20.7	169.8	0	0	0	0	0	118.1	K10	K10-G12 PolarHBondContact O-N 3.33Å
13	G	38.4	Very low	47.8	Very low	64 Å²	64	132.2 Å²	132.2	66%	0.66	74%	0.738	S	S	*	*			trans	-88.4	122.4	172.4	0	0	0	0	0	112.4	V15	G13-V15 PolarHBondContact O-N 3.47Å
14	E	43.9	Very low	49.3	Very low	194 Å²	194	127.2 Å²	127.2	91%	0.907	73%	0.729	S	S	*	*			trans	-59.3	126.9	166.9	-76.5	-175.2	150	0	0	110.3	L16	E14-L16 PolarHBondContact O-N 2.81Å
15	V	44.1	Very low	50.7	Low	127 Å²	127	121.5 Å²	121.5	77%	0.77	70%	0.704	S	S	*	*			trans	-78.4	100.6	177.8	-178.5	0	0	0	0	108.6	G13 T17	G13-V15 PolarHBondContact O-N 3.47Å; V15-T17 HydrophobicContact CG1-CG2 4.16Å; V15-T17 PolarHBondContact O-N 3.44Å; V15-T17 VanDerWaalsContact O-N 3.17Å
16	L	42.7	Very low	52.6	Low	160 Å²	160	120.2 Å²	120.2	84%	0.838	69%	0.685	S	S	*	*			trans	-78	96.5	171.3	-163.9	74.9	0	0	0	109.7	E14 M18	E14-L16 PolarHBondContact O-N 2.81Å; L16-M18 PolarHBondContact O-N 2.86Å; L16-M18 VanDerWaalsContact O-N 3.11Å
17	T	51	Low	54.3	Low	98 Å²	98	120 Å²	120	60%	0.601	68%	0.683	S	S	*	*			trans	-75.9	92.8	172.8	37.4	0	0	0	0	110.5	V15	V15-T17 HydrophobicContact CG1-CG2 4.16Å; V15-T17 PolarHBondContact O-N 3.44Å; V15-T17 VanDerWaalsContact O-N 3.17Å
18	M	49.8	Very low	56.2	Low	142 Å²	142	117.1 Å²	117.1	70%	0.7	67%	0.673	S	S	*	*			trans	-88.2	119.7	174.6	-170	165.2	53.5	0	0	110.6	L16 I20	L16-M18 PolarHBondContact O-N 2.86Å; L16-M18 VanDerWaalsContact O-N 3.11Å; M18-I20 HydrophobicContact CE-CD1 4.28Å; M18-I20 HydrophobicContact CE-CG1 4.39Å; M18-I20 HydrophobicContact CG-CG1 4.39Å; M18-I20 PolarHBondContact O-N 3.47Å
19	W	55.1	Low	57.4	Low	190 Å²	190	117 Å²	117	72%	0.72	66%	0.662	S	S	*	*			trans	-76.3	89.4	177.7	-66	87.6	0	0	0	110.4	L33	W19-L33 HydrophobicContact CB-CD1 4.22Å
20	I	60.3	Low	59.1	Low	120 Å²	120	113 Å²	113	62%	0.615	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-81.8	127.7	176.1	-55.4	174.3	0	0	0	108.8	M18 T22	M18-I20 HydrophobicContact CE-CD1 4.28Å; M18-I20 HydrophobicContact CE-CG1 4.39Å; M18-I20 HydrophobicContact CG-CG1 4.39Å; M18-I20 PolarHBondContact O-N 3.47Å; I20-T22 PolarHBondContact O-N 2.83Å
21	P	59	Low	60.8	Low	43 Å²	43	110.3 Å²	110.3	28%	0.279	63%	0.632	S	S	.	*	P	Polyproline II helix	trans	-62.3	123.5	178.1	-14.9	25.8	0	0	0	110.6	L33	P21-L33 HydrophobicContact CG-CD2 4.47Å
22	T	66.5	Low	62.5	Low	65 Å²	65	108.1 Å²	108.1	40%	0.399	62%	0.616	S	S	.	*	P	Polyproline II helix	trans	-84.1	151.3	174	56.3	0	0	0	0	110.9	I20 S24 M25 R30	I20-T22 PolarHBondContact O-N 2.83Å; T22-S24 PolarHBondContact O-N 3.48Å; T22-S24 PolarHBondContact OG1-OG 2.91Å; T22-M25 PolarHBondContact O-N 3.37Å; T22-M25 VanDerWaalsContact O-N 3.11Å; T22-R30 PolarHBondContact O-NH2 2.68Å
23	P	65.4	Low	63.9	Low	126 Å²	126	105.6 Å²	105.6	82%	0.818	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.2	-18.4	178.9	2.3	-6.6	0	0	0	113.9	R30	P23-R30 PolarHBondContact O-NH2 3.43Å
24	S	68.7	Low	66	Low	104 Å²	104	108.8 Å²	108.8	73%	0.727	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.4	-6.3	178.2	56.5	0	0	0	0	116.1	T22	T22-S24 PolarHBondContact O-N 3.48Å; T22-S24 PolarHBondContact OG1-OG 2.91Å
25	M	72.6	Confident	67.8	Low	48 Å²	48	101.3 Å²	101.3	24%	0.236	55%	0.551	C	S	.	*			trans	-82	134	-178.6	-66.1	-176	77.7	0	0	112.4	T22 Q29 R30 L33	T22-M25 PolarHBondContact O-N 3.37Å; T22-M25 VanDerWaalsContact O-N 3.11Å; M25-Q29 HydrophobicContact CE-CB 3.92Å; M25-R30 HydrophobicContact CB-CG 3.95Å; M25-R30 PolarHBondContact O-NE 3.12Å; M25-R30 VanDerWaalsContact O-NE 3.16Å; M25-L33 HydrophobicContact CE-CD2 4.33Å; M25-L33 HydrophobicContact SD-CD2 4.49Å
26	T	78.3	Confident	69.5	Low	78 Å²	78	99 Å²	99	48%	0.479	54%	0.538	S	S	.	.			trans	-71.7	156	175.8	61.3	0	0	0	0	111.5	P28 Q29 R30	T26-P28 VanDerWaalsContact C-CD 3.4Å; T26-P28 VanDerWaalsContact C-N 3.35Å; T26-Q29 PolarHBondContact O-N 3.47Å; T26-Q29 VanDerWaalsContact O-N 3.09Å; T26-Q29 WeakPolarHBondContact OG1-CG 3.16Å; T26-Q29 PolarHBondContact OG1-OE1 2.79Å; T26-R30 PolarHBondContact O-N 3.42Å; T26-R30 VanDerWaalsContact O-N 3.12Å
27	V	77.6	Confident	71.2	Confident	111 Å²	111	94.2 Å²	94.2	67%	0.673	52%	0.517	S	S	*	.	H	α-helix	trans	-52.6	-42.1	-178.4	-179	0	0	0	0	113.5	Q29 R30 M31	V27-Q29 PolarHBondContact O-N 3.2Å; V27-R30 PolarHBondContact O-N 2.69Å; V27-M31 PolarHBondContact O-N 3.24Å; V27-M31 VanDerWaalsContact O-N 3.07Å
28	P	78	Confident	72.9	Confident	86 Å²	86	93.8 Å²	93.8	56%	0.558	51%	0.514	S	S	*	.	H	α-helix	trans	-65.4	-38.1	177.6	-18.6	31.1	0	0	0	113	T26 R30 M31 V32	T26-P28 VanDerWaalsContact C-CD 3.4Å; T26-P28 VanDerWaalsContact C-N 3.35Å; P28-R30 VanDerWaalsContact C-N 3.32Å; P28-R30 PolarHBondContact O-N 3.06Å; P28-M31 WeakPolarHBondContact O-CB 3.47Å; P28-M31 PolarHBondContact O-N 3.12Å; P28-V32 WeakPolarHBondContact O-CG2 3.48Å; P28-V32 PolarHBondContact O-N 3.12Å
29	Q	72.1	Confident	74.4	Confident	106 Å²	106	91.1 Å²	91.1	50%	0.495	51%	0.505	S	S	.	.	H	α-helix	trans	-68	-34.7	179.1	-68.6	175	-28.8	0	0	111.7	M25 T26 V27 L33	M25-Q29 HydrophobicContact CE-CB 3.92Å; T26-Q29 PolarHBondContact O-N 3.47Å; T26-Q29 VanDerWaalsContact O-N 3.09Å; T26-Q29 WeakPolarHBondContact OG1-CG 3.16Å; T26-Q29 PolarHBondContact OG1-OE1 2.79Å; V27-Q29 PolarHBondContact O-N 3.2Å; Q29-L33 WeakPolarHBondContact O-CB 3.33Å; Q29-L33 PolarHBondContact O-N 2.78Å
30	R	78.3	Confident	75.6	Confident	88 Å²	88	84.8 Å²	84.8	33%	0.332	49%	0.494	S	S	.	.	H	α-helix	trans	-67.1	-43.2	173.1	-66.6	-177.4	-173.3	-164.3	-0.4	111.4	T22 P23 M25 T26 V27 P28 V32 L33 Y34	T22-R30 PolarHBondContact O-NH2 2.68Å; P23-R30 PolarHBondContact O-NH2 3.43Å; M25-R30 HydrophobicContact CB-CG 3.95Å; M25-R30 PolarHBondContact O-NE 3.12Å; M25-R30 VanDerWaalsContact O-NE 3.16Å; T26-R30 PolarHBondContact O-N 3.42Å; T26-R30 VanDerWaalsContact O-N 3.12Å; V27-R30 PolarHBondContact O-N 2.69Å; P28-R30 VanDerWaalsContact C-N 3.32Å; P28-R30 PolarHBondContact O-N 3.06Å; R30-V32 VanDerWaalsContact C-N 3.34Å; R30-V32 PolarHBondContact O-N 3.38Å; R30-L33 PolarHBondContact O-N 3.03Å; R30-Y34 HydrophobicContact CB-CD2 4.34Å; R30-Y34 HydrophobicContact CB-CE2 4.08Å; R30-Y34 WeakPolarHBondContact O-CD2 3.18Å; R30-Y34 PolarHBondContact O-N 2.73Å
31	M	78.2	Confident	76.8	Confident	140 Å²	140	84.3 Å²	84.3	69%	0.69	49%	0.492	S	S	*	.	H	α-helix	trans	-57.6	-44.9	174.9	-82.7	-110	-174.1	0	0	112.1	V27 P28 Y34 G35	V27-M31 PolarHBondContact O-N 3.24Å; V27-M31 VanDerWaalsContact O-N 3.07Å; P28-M31 WeakPolarHBondContact O-CB 3.47Å; P28-M31 PolarHBondContact O-N 3.12Å; M31-Y34 PolarHBondContact O-N 2.91Å; M31-G35 PolarHBondContact O-N 3.33Å
32	V	81.2	Confident	78.2	Confident	98 Å²	98	86.8 Å²	86.8	59%	0.594	51%	0.506	S	S	*	.	H	α-helix	trans	-64.1	-43.4	176.9	174.4	0	0	0	0	111.3	P28 R30 G35 T36	P28-V32 WeakPolarHBondContact O-CG2 3.48Å; P28-V32 PolarHBondContact O-N 3.12Å; R30-V32 VanDerWaalsContact C-N 3.34Å; R30-V32 PolarHBondContact O-N 3.38Å; V32-G35 PolarHBondContact O-N 3Å; V32-T36 HydrophobicContact CG1-CG2 4.45Å; V32-T36 WeakPolarHBondContact O-CG2 3.25Å; V32-T36 PolarHBondContact O-N 3.45Å; V32-T36 PolarHBondContact O-OG1 3Å
33	L	80.3	Confident	78.8	Confident	30 Å²	30	88.8 Å²	88.8	16%	0.157	51%	0.514	C	S	.	.	H	α-helix	trans	-63.6	-42.4	178.5	-170.4	72.6	0	0	0	112.3	W19 P21 M25 Q29 R30 T36 C37	W19-L33 HydrophobicContact CB-CD1 4.22Å; P21-L33 HydrophobicContact CG-CD2 4.47Å; M25-L33 HydrophobicContact CE-CD2 4.33Å; M25-L33 HydrophobicContact SD-CD2 4.49Å; Q29-L33 WeakPolarHBondContact O-CB 3.33Å; Q29-L33 PolarHBondContact O-N 2.78Å; R30-L33 PolarHBondContact O-N 3.03Å; L33-T36 PolarHBondContact O-OG1 2.63Å; L33-C37 WeakPolarHBondContact O-CB 3.33Å; L33-C37 PolarHBondContact O-N 2.94Å; L33-C37 VanDerWaalsContact O-N 3.08Å; L33-C37 PolarHBondContact O-SG 2.85Å; L33-C37 VanDerWaalsContact O-SG 3.38Å
34	Y	82.4	Confident	79.8	Confident	131 Å²	131	85.7 Å²	85.7	51%	0.514	50%	0.495	S	S	.	.	H	α-helix	trans	-67.3	-39.6	175.2	-69.3	-57.3	0	0	0	111.6	R30 M31 C37 V38	R30-Y34 HydrophobicContact CB-CD2 4.34Å; R30-Y34 HydrophobicContact CB-CE2 4.08Å; R30-Y34 WeakPolarHBondContact O-CD2 3.18Å; R30-Y34 PolarHBondContact O-N 2.73Å; M31-Y34 PolarHBondContact O-N 2.91Å; Y34-C37 PolarHBondContact O-N 2.78Å; Y34-V38 VanDerWaalsContact O-CG2 3.3Å; Y34-V38 WeakPolarHBondContact O-CG2 3.12Å; Y34-V38 PolarHBondContact O-N 3.06Å
35	G	83.1	Confident	80.7	Confident	37 Å²	37	85 Å²	85	38%	0.381	49%	0.486	S	S	.	.	H	α-helix	trans	-60.5	-46	175.7	0	0	0	0	0	112.8	M31 V32 V38 V39	M31-G35 PolarHBondContact O-N 3.33Å; V32-G35 PolarHBondContact O-N 3Å; G35-V38 PolarHBondContact O-N 3.15Å; G35-V39 WeakPolarHBondContact O-CG2 3.37Å; G35-V39 PolarHBondContact O-N 2.95Å
36	T	79.2	Confident	81.4	Confident	79 Å²	79	84.2 Å²	84.2	49%	0.485	49%	0.491	S	S	.	.	H	α-helix	trans	-67.3	-37.9	177.8	54.5	0	0	0	0	112.3	V32 L33 V39 A40	V32-T36 HydrophobicContact CG1-CG2 4.45Å; V32-T36 WeakPolarHBondContact O-CG2 3.25Å; V32-T36 PolarHBondContact O-N 3.45Å; V32-T36 PolarHBondContact O-OG1 3Å; L33-T36 PolarHBondContact O-OG1 2.63Å; T36-V39 PolarHBondContact O-N 3.21Å; T36-A40 WeakPolarHBondContact O-CB 3.27Å; T36-A40 PolarHBondContact O-N 3.5Å
37	C	78.3	Confident	81.7	Confident	59 Å²	59	85.6 Å²	85.6	40%	0.399	50%	0.495	S	S	.	.	H	α-helix	trans	-62.4	-41.5	173.3	-77.6	0	0	0	0	112.5	L33 Y34 A40 L41	L33-C37 WeakPolarHBondContact O-CB 3.33Å; L33-C37 PolarHBondContact O-N 2.94Å; L33-C37 VanDerWaalsContact O-N 3.08Å; L33-C37 PolarHBondContact O-SG 2.85Å; L33-C37 VanDerWaalsContact O-SG 3.38Å; Y34-C37 PolarHBondContact O-N 2.78Å; C37-A40 PolarHBondContact O-N 3.42Å; C37-L41 WeakPolarHBondContact O-CB 3.48Å; C37-L41 VanDerWaalsContact O-CG 3.31Å; C37-L41 WeakPolarHBondContact O-CG 3.37Å; C37-L41 PolarHBondContact O-N 3.32Å
38	V	86	Confident	82.1	Confident	88 Å²	88	86 Å²	86	53%	0.533	49%	0.493	S	S	.	.	H	α-helix	trans	-64.9	-44.6	177.3	171.5	0	0	0	0	110.9	Y34 G35 A40 L41 V42	Y34-V38 VanDerWaalsContact O-CG2 3.3Å; Y34-V38 WeakPolarHBondContact O-CG2 3.12Å; Y34-V38 PolarHBondContact O-N 3.06Å; G35-V38 PolarHBondContact O-N 3.15Å; V38-A40 VanDerWaalsContact C-N 3.34Å; V38-A40 PolarHBondContact O-N 2.85Å; V38-L41 PolarHBondContact O-N 3.19Å; V38-V42 HydrophobicContact CG1-CG2 4.45Å; V38-V42 WeakPolarHBondContact O-CG2 3.2Å; V38-V42 PolarHBondContact O-N 3.21Å
39	V	82.8	Confident	82.6	Confident	86 Å²	86	85.9 Å²	85.9	52%	0.521	49%	0.49	S	S	.	.	H	α-helix	trans	-63.2	-40.8	176.8	173.6	0	0	0	0	111.4	G35 T36 L41 V42 N43	G35-V39 WeakPolarHBondContact O-CG2 3.37Å; G35-V39 PolarHBondContact O-N 2.95Å; T36-V39 PolarHBondContact O-N 3.21Å; V39-L41 VanDerWaalsContact C-N 3.34Å; V39-L41 PolarHBondContact O-N 2.83Å; V39-V42 PolarHBondContact O-N 3.27Å; V39-N43 WeakPolarHBondContact O-CB 3.47Å; V39-N43 PolarHBondContact O-N 3.48Å
40	A	79.8	Confident	83.3	Confident	58 Å²	58	86.1 Å²	86.1	48%	0.479	49%	0.494	S	S	.	.	H	α-helix	trans	-63.2	-39.8	176.1	0	0	0	0	0	112.1	T36 C37 V38 N43 S44	T36-A40 WeakPolarHBondContact O-CB 3.27Å; T36-A40 PolarHBondContact O-N 3.5Å; C37-A40 PolarHBondContact O-N 3.42Å; V38-A40 VanDerWaalsContact C-N 3.34Å; V38-A40 PolarHBondContact O-N 2.85Å; A40-N43 PolarHBondContact O-N 2.73Å; A40-S44 WeakPolarHBondContact O-CB 3Å; A40-S44 PolarHBondContact O-N 2.69Å; A40-S44 PolarHBondContact O-OG 2.78Å
41	L	85.3	Confident	83.5	Confident	110 Å²	110	87.3 Å²	87.3	58%	0.576	51%	0.505	S	S	*	.	H	α-helix	trans	-67.1	-41	175.2	-74.6	170.6	0	0	0	112.3	C37 V38 V39 N43 S44 V45	C37-L41 WeakPolarHBondContact O-CB 3.48Å; C37-L41 VanDerWaalsContact O-CG 3.31Å; C37-L41 WeakPolarHBondContact O-CG 3.37Å; C37-L41 PolarHBondContact O-N 3.32Å; V38-L41 PolarHBondContact O-N 3.19Å; V39-L41 VanDerWaalsContact C-N 3.34Å; V39-L41 PolarHBondContact O-N 2.83Å; L41-N43 VanDerWaalsContact C-N 3.34Å; L41-S44 WeakPolarHBondContact CA-OG 3.4Å; L41-S44 PolarHBondContact O-N 2.91Å; L41-S44 PolarHBondContact O-OG 3.28Å; L41-V45 WeakPolarHBondContact O-CB 3.49Å; L41-V45 VanDerWaalsContact O-CG2 3.25Å; L41-V45 WeakPolarHBondContact O-CG2 3.37Å; L41-V45 PolarHBondContact O-N 2.85Å
42	V	87.9	Confident	83.9	Confident	94 Å²	94	84.4 Å²	84.4	57%	0.57	50%	0.495	S	S	*	.	H	α-helix	trans	-64.8	-41.7	176.6	172.9	0	0	0	0	110.7	V38 V39 G46	V38-V42 HydrophobicContact CG1-CG2 4.45Å; V38-V42 WeakPolarHBondContact O-CG2 3.2Å; V38-V42 PolarHBondContact O-N 3.21Å; V39-V42 PolarHBondContact O-N 3.27Å; V42-G46 PolarHBondContact O-N 3.46Å
43	N	79.8	Confident	84.1	Confident	108 Å²	108	85.1 Å²	85.1	58%	0.578	49%	0.492	S	S	*	.	H	α-helix	trans	-67.2	-38.4	176.9	-76.1	-18.2	0	0	0	112.6	V39 A40 L41 G46 L47	V39-N43 WeakPolarHBondContact O-CB 3.47Å; V39-N43 PolarHBondContact O-N 3.48Å; A40-N43 PolarHBondContact O-N 2.73Å; L41-N43 VanDerWaalsContact C-N 3.34Å; N43-G46 PolarHBondContact O-N 3.18Å; N43-L47 PolarHBondContact O-N 3.38Å
44	S	85.1	Confident	84.2	Confident	60 Å²	60	89.7 Å²	89.7	42%	0.42	51%	0.512	S	S	.	.	H	α-helix	trans	-69.7	-39.3	177.8	64.6	0	0	0	0	112.1	A40 L41 L47 L48	A40-S44 WeakPolarHBondContact O-CB 3Å; A40-S44 PolarHBondContact O-N 2.69Å; A40-S44 PolarHBondContact O-OG 2.78Å; L41-S44 WeakPolarHBondContact CA-OG 3.4Å; L41-S44 PolarHBondContact O-N 2.91Å; L41-S44 PolarHBondContact O-OG 3.28Å; S44-L47 PolarHBondContact O-N 2.92Å; S44-L48 PolarHBondContact O-N 2.82Å
45	V	89.1	Confident	84.2	Confident	89 Å²	89	87.3 Å²	87.3	54%	0.539	52%	0.515	S	S	.	.	H	α-helix	trans	-63.2	-42.3	171.7	173.4	0	0	0	0	110.7	L41 L47 L48 V49	L41-V45 WeakPolarHBondContact O-CB 3.49Å; L41-V45 VanDerWaalsContact O-CG2 3.25Å; L41-V45 WeakPolarHBondContact O-CG2 3.37Å; L41-V45 PolarHBondContact O-N 2.85Å; V45-L47 PolarHBondContact O-N 3.33Å; V45-L48 WeakPolarHBondContact O-CB 3.39Å; V45-L48 PolarHBondContact O-N 2.88Å; V45-V49 WeakPolarHBondContact O-CG2 3.5Å; V45-V49 PolarHBondContact O-N 2.91Å
46	G	86	Confident	84.2	Confident	33 Å²	33	91 Å²	91	34%	0.34	52%	0.522	S	S	.	.	H	α-helix	trans	-59.5	-43.7	174.7	0	0	0	0	0	113	V42 N43 L48 V49 L50	V42-G46 PolarHBondContact O-N 3.46Å; N43-G46 PolarHBondContact O-N 3.18Å; G46-L48 VanDerWaalsContact C-N 3.33Å; G46-L48 PolarHBondContact O-N 3.22Å; G46-V49 PolarHBondContact O-N 2.86Å; G46-L50 WeakPolarHBondContact O-CG 3.38Å; G46-L50 PolarHBondContact O-N 2.83Å
47	L	84.6	Confident	84	Confident	106 Å²	106	92.2 Å²	92.2	56%	0.555	52%	0.522	S	S	*	.	H	α-helix	trans	-64.2	-38.7	175.3	-164	75.4	0	0	0	111.7	N43 S44 V45 L50 M51	N43-L47 PolarHBondContact O-N 3.38Å; S44-L47 PolarHBondContact O-N 2.92Å; V45-L47 PolarHBondContact O-N 3.33Å; L47-L50 PolarHBondContact O-N 3.44Å; L47-M51 WeakPolarHBondContact O-CB 3.34Å; L47-M51 VanDerWaalsContact O-CG 3.25Å; L47-M51 WeakPolarHBondContact O-CG 3.47Å; L47-M51 PolarHBondContact O-N 2.65Å
48	L	85.9	Confident	84.1	Confident	121 Å²	121	94.6 Å²	94.6	63%	0.634	53%	0.527	S	S	*	.	H	α-helix	trans	-64.6	-41.9	176.7	-145.8	102.8	0	0	0	111.4	S44 V45 G46 L50 M51 V52	S44-L48 PolarHBondContact O-N 2.82Å; V45-L48 WeakPolarHBondContact O-CB 3.39Å; V45-L48 PolarHBondContact O-N 2.88Å; G46-L48 VanDerWaalsContact C-N 3.33Å; G46-L48 PolarHBondContact O-N 3.22Å; L48-L50 VanDerWaalsContact C-N 3.35Å; L48-M51 PolarHBondContact O-N 3.21Å; L48-V52 VanDerWaalsContact O-CG2 3.3Å; L48-V52 WeakPolarHBondContact O-CG2 3.49Å; L48-V52 PolarHBondContact O-N 2.78Å
49	V	90.1	Very high	83.9	Confident	82 Å²	82	93 Å²	93	50%	0.497	52%	0.524	S	S	.	.	H	α-helix	trans	-62.5	-42.6	174.8	172.1	0	0	0	0	110.8	V45 G46 V52 Q53	V45-V49 WeakPolarHBondContact O-CG2 3.5Å; V45-V49 PolarHBondContact O-N 2.91Å; G46-V49 PolarHBondContact O-N 2.86Å; V49-V52 PolarHBondContact O-N 3.03Å; V49-Q53 VanDerWaalsContact O-CB 3.31Å; V49-Q53 WeakPolarHBondContact O-CB 3.38Å; V49-Q53 PolarHBondContact O-N 3.18Å
50	L	85.5	Confident	83.8	Confident	111 Å²	111	96.2 Å²	96.2	58%	0.581	53%	0.526	S	S	*	.	H	α-helix	trans	-63.6	-40.9	175.6	-71.4	174	0	0	0	112.3	G46 L47 L48 Q53 Q54	G46-L50 WeakPolarHBondContact O-CG 3.38Å; G46-L50 PolarHBondContact O-N 2.83Å; L47-L50 PolarHBondContact O-N 3.44Å; L48-L50 VanDerWaalsContact C-N 3.35Å; L50-Q53 PolarHBondContact O-N 2.05Å; L50-Q54 WeakPolarHBondContact O-CB 3.45Å; L50-Q54 PolarHBondContact O-N 2.99Å
51	M	82.2	Confident	83.8	Confident	113 Å²	113	97.8 Å²	97.8	56%	0.557	53%	0.526	S	S	*	.	H	α-helix	trans	-64.6	-42.5	175.8	-72.8	-78.4	-176.2	0	0	111.8	L47 L48 Q53 Q54 S55	L47-M51 WeakPolarHBondContact O-CB 3.34Å; L47-M51 VanDerWaalsContact O-CG 3.25Å; L47-M51 WeakPolarHBondContact O-CG 3.47Å; L47-M51 PolarHBondContact O-N 2.65Å; L48-M51 PolarHBondContact O-N 3.21Å; M51-Q53 VanDerWaalsContact C-N 3.33Å; M51-Q54 PolarHBondContact O-N 2.96Å; M51-S55 WeakPolarHBondContact O-CB 3.3Å; M51-S55 PolarHBondContact O-N 3.13Å
52	V	87.8	Confident	83.6	Confident	79 Å²	79	98.3 Å²	98.3	48%	0.479	53%	0.526	S	S	.	.	H	α-helix	trans	-63.5	-41.9	174.4	170.7	0	0	0	0	110.5	L48 V49 S55 Q56	L48-V52 VanDerWaalsContact O-CG2 3.3Å; L48-V52 WeakPolarHBondContact O-CG2 3.49Å; L48-V52 PolarHBondContact O-N 2.78Å; V49-V52 PolarHBondContact O-N 3.03Å; V52-S55 PolarHBondContact O-N 3.48Å; V52-Q56 WeakPolarHBondContact O-CG 3.49Å; V52-Q56 PolarHBondContact O-N 2.97Å
53	Q	84.7	Confident	83.4	Confident	113 Å²	113	99.5 Å²	99.5	53%	0.528	53%	0.525	S	S	.	.	H	α-helix	trans	-66.8	-39.7	178	-166.5	148.3	-27	0	0	111.7	V49 L50 M51 Q56 Q57	V49-Q53 VanDerWaalsContact O-CB 3.31Å; V49-Q53 WeakPolarHBondContact O-CB 3.38Å; V49-Q53 PolarHBondContact O-N 3.18Å; L50-Q53 PolarHBondContact O-N 2.05Å; M51-Q53 VanDerWaalsContact C-N 3.33Å; Q53-Q56 PolarHBondContact O-N 3.3Å; Q53-Q57 VanDerWaalsContact O-CG 3.3Å; Q53-Q57 WeakPolarHBondContact O-CG 3.43Å; Q53-Q57 PolarHBondContact O-N 2.84Å
54	Q	81.8	Confident	83	Confident	127 Å²	127	98.2 Å²	98.2	59%	0.593	52%	0.521	S	S	*	.	H	α-helix	trans	-64.5	-41.4	174.6	-174.7	173.6	-7.1	0	0	111.9	L50 M51 Q57 H58	L50-Q54 WeakPolarHBondContact O-CB 3.45Å; L50-Q54 PolarHBondContact O-N 2.99Å; M51-Q54 PolarHBondContact O-N 2.96Å; Q54-Q57 PolarHBondContact O-N 2.85Å; Q54-H58 PolarHBondContact O-N 3.12Å
55	S	82.9	Confident	82.7	Confident	81 Å²	81	101.1 Å²	101.1	57%	0.566	53%	0.528	S	S	*	.	H	α-helix	trans	-62.5	-42.3	174.3	173.2	0	0	0	0	111.9	M51 V52 Q57 H58 A59	M51-S55 WeakPolarHBondContact O-CB 3.3Å; M51-S55 PolarHBondContact O-N 3.13Å; V52-S55 PolarHBondContact O-N 3.48Å; S55-Q57 VanDerWaalsContact C-N 3.34Å; S55-Q57 PolarHBondContact O-N 3.11Å; S55-H58 PolarHBondContact O-N 2.78Å; S55-A59 PolarHBondContact O-N 3.36Å
56	Q	83.8	Confident	82.1	Confident	115 Å²	115	99.8 Å²	99.8	54%	0.537	53%	0.526	S	S	.	.	H	α-helix	trans	-65	-36.2	175	-73.8	-168.1	-8.4	0	0	112.9	V52 Q53 R60	V52-Q56 WeakPolarHBondContact O-CG 3.49Å; V52-Q56 PolarHBondContact O-N 2.97Å; Q53-Q56 PolarHBondContact O-N 3.3Å; Q56-R60 WeakPolarHBondContact O-CG 3.33Å; Q56-R60 PolarHBondContact O-N 2.95Å; Q56-R60 VanDerWaalsContact O-N 3.08Å
57	Q	75.4	Confident	81.5	Confident	104 Å²	104	105.9 Å²	105.9	49%	0.486	54%	0.539	S	S	.	.	H	α-helix	trans	-67	-40	174.2	-68.6	-62.7	-45.5	0	0	111.5	Q53 Q54 S55 R60 L61	Q53-Q57 VanDerWaalsContact O-CG 3.3Å; Q53-Q57 WeakPolarHBondContact O-CG 3.43Å; Q53-Q57 PolarHBondContact O-N 2.84Å; Q54-Q57 PolarHBondContact O-N 2.85Å; S55-Q57 VanDerWaalsContact C-N 3.34Å; S55-Q57 PolarHBondContact O-N 3.11Å; Q57-R60 PolarHBondContact O-N 2.78Å; Q57-L61 PolarHBondContact O-N 3.4Å
58	H	79.8	Confident	80.4	Confident	109 Å²	109	106.4 Å²	106.4	51%	0.505	54%	0.542	S	S	.	.	H	α-helix	trans	-65.5	-40.9	178.1	-142.7	-54.7	0	0	0	112.1	Q54 S55 R60 L61 E62	Q54-H58 PolarHBondContact O-N 3.12Å; S55-H58 PolarHBondContact O-N 2.78Å; H58-R60 VanDerWaalsContact C-N 3.33Å; H58-R60 PolarHBondContact O-N 3.29Å; H58-L61 WeakPolarHBondContact O-CB 3.31Å; H58-L61 PolarHBondContact O-N 3Å; H58-E62 PolarHBondContact O-N 3.16Å
59	A	82.4	Confident	79.5	Confident	55 Å²	55	102.8 Å²	102.8	46%	0.455	53%	0.529	S	S	.	.	H	α-helix	trans	-64.6	-36.7	174.1	0	0	0	0	0	112.3	S55 Q63	S55-A59 PolarHBondContact O-N 3.36Å; A59-Q63 WeakPolarHBondContact O-CB 3.38Å; A59-Q63 PolarHBondContact O-N 2.86Å
60	R	80.5	Confident	78.2	Confident	152 Å²	152	105.3 Å²	105.3	57%	0.574	54%	0.536	S	S	*	.	H	α-helix	trans	-66.4	-38.2	171.9	-76.5	-177.8	-174.8	-169.1	3.1	111.9	Q56 Q57 H58 Q63 T64	Q56-R60 WeakPolarHBondContact O-CG 3.33Å; Q56-R60 PolarHBondContact O-N 2.95Å; Q56-R60 VanDerWaalsContact O-N 3.08Å; Q57-R60 PolarHBondContact O-N 2.78Å; H58-R60 VanDerWaalsContact C-N 3.33Å; H58-R60 PolarHBondContact O-N 3.29Å; R60-Q63 PolarHBondContact O-N 3.42Å; R60-T64 WeakPolarHBondContact O-CG2 3.44Å; R60-T64 PolarHBondContact O-N 3.07Å; R60-T64 PolarHBondContact O-OG1 2.92Å; R60-T64 VanDerWaalsContact O-OG1 3.08Å
61	L	78.5	Confident	76.7	Confident	92 Å²	92	103.6 Å²	103.6	48%	0.482	53%	0.53	S	S	.	.	H	α-helix	trans	-63.9	-47.4	177.9	-155.6	90.6	0	0	0	111	Q57 H58 Q63 T64 E65	Q57-L61 PolarHBondContact O-N 3.4Å; H58-L61 WeakPolarHBondContact O-CB 3.31Å; H58-L61 PolarHBondContact O-N 3Å; L61-Q63 VanDerWaalsContact C-N 3.32Å; L61-Q63 PolarHBondContact O-N 3.45Å; L61-T64 VanDerWaalsContact CA-OG1 3.28Å; L61-T64 WeakPolarHBondContact CA-OG1 3.3Å; L61-T64 CarbonylContact O-C 3.17Å; L61-T64 PolarHBondContact O-N 3.29Å; L61-T64 VanDerWaalsContact O-N 3.12Å; L61-T64 PolarHBondContact O-OG1 2.82Å; L61-E65 PolarHBondContact O-N 2.83Å
62	E	82.3	Confident	75.3	Confident	121 Å²	121	105.1 Å²	105.1	57%	0.565	54%	0.535	S	S	*	.	H	α-helix	trans	-62.8	-38.5	175.4	-74.1	-175.7	170.2	0	0	111.9	H58 T64 E65 A66	H58-E62 PolarHBondContact O-N 3.16Å; E62-T64 VanDerWaalsContact C-N 3.33Å; E62-T64 PolarHBondContact O-N 2.9Å; E62-E65 PolarHBondContact O-N 3.19Å; E62-A66 WeakPolarHBondContact O-CB 3.32Å; E62-A66 PolarHBondContact O-N 3.47Å
63	Q	82.4	Confident	73.6	Confident	119 Å²	119	108.7 Å²	108.7	56%	0.556	55%	0.547	S	S	*	.	H	α-helix	trans	-66.4	-34.8	174.4	-166.4	179.2	10.1	0	0	112	A59 R60 L61 R67	A59-Q63 WeakPolarHBondContact O-CB 3.38Å; A59-Q63 PolarHBondContact O-N 2.86Å; R60-Q63 PolarHBondContact O-N 3.42Å; L61-Q63 VanDerWaalsContact C-N 3.32Å; L61-Q63 PolarHBondContact O-N 3.45Å; Q63-R67 WeakPolarHBondContact O-CB 3.48Å; Q63-R67 WeakPolarHBondContact O-CG 3.5Å; Q63-R67 PolarHBondContact O-N 2.82Å
64	T	71.8	Confident	72.3	Confident	80 Å²	80	107.6 Å²	107.6	49%	0.491	55%	0.551	S	S	.	*	H	α-helix	trans	-73.4	-35.4	173.7	48.6	0	0	0	0	112.8	R60 L61 E62 R67 L68	R60-T64 WeakPolarHBondContact O-CG2 3.44Å; R60-T64 PolarHBondContact O-N 3.07Å; R60-T64 PolarHBondContact O-OG1 2.92Å; R60-T64 VanDerWaalsContact O-OG1 3.08Å; L61-T64 VanDerWaalsContact CA-OG1 3.28Å; L61-T64 WeakPolarHBondContact CA-OG1 3.3Å; L61-T64 CarbonylContact O-C 3.17Å; L61-T64 PolarHBondContact O-N 3.29Å; L61-T64 VanDerWaalsContact O-N 3.12Å; L61-T64 PolarHBondContact O-OG1 2.82Å; E62-T64 VanDerWaalsContact C-N 3.33Å; E62-T64 PolarHBondContact O-N 2.9Å; T64-R67 PolarHBondContact O-N 2.75Å; T64-L68 WeakPolarHBondContact O-CB 3.42Å; T64-L68 PolarHBondContact O-N 2.87Å
65	E	79.4	Confident	70.8	Confident	121 Å²	121	104.5 Å²	104.5	57%	0.565	54%	0.544	S	S	*	.	H	α-helix	trans	-67.3	-41.1	173.1	-78.1	-175.4	161.9	0	0	111.3	L61 E62 R67 L68 A69	L61-E65 PolarHBondContact O-N 2.83Å; E62-E65 PolarHBondContact O-N 3.19Å; E65-R67 VanDerWaalsContact C-N 3.33Å; E65-R67 PolarHBondContact O-N 3.21Å; E65-L68 WeakPolarHBondContact O-CB 2.99Å; E65-L68 PolarHBondContact O-N 3.11Å; E65-L68 VanDerWaalsContact O-N 3.16Å; E65-A69 PolarHBondContact O-N 3.29Å
66	A	75.8	Confident	69.2	Low	61 Å²	61	107.3 Å²	107.3	50%	0.504	56%	0.557	S	S	.	*	H	α-helix	trans	-62.3	-39.9	173.4	0	0	0	0	0	112	E62 A69 E70	E62-A66 WeakPolarHBondContact O-CB 3.32Å; E62-A66 PolarHBondContact O-N 3.47Å; A66-A69 PolarHBondContact O-N 2.9Å; A66-E70 PolarHBondContact O-N 2.84Å
67	R	73.4	Confident	67.3	Low	162 Å²	162	107.5 Å²	107.5	61%	0.611	57%	0.566	S	S	*	*	H	α-helix	trans	-67.7	-35.3	172.5	-79.1	-177	163.1	-160.8	-5	112.8	Q63 T64 E65 A69 E70 V71	Q63-R67 WeakPolarHBondContact O-CB 3.48Å; Q63-R67 WeakPolarHBondContact O-CG 3.5Å; Q63-R67 PolarHBondContact O-N 2.82Å; T64-R67 PolarHBondContact O-N 2.75Å; E65-R67 VanDerWaalsContact C-N 3.33Å; E65-R67 PolarHBondContact O-N 3.21Å; R67-A69 VanDerWaalsContact C-N 3.35Å; R67-E70 PolarHBondContact O-N 2.84Å; R67-V71 WeakPolarHBondContact O-CB 3.46Å; R67-V71 VanDerWaalsContact O-CG2 3.26Å; R67-V71 WeakPolarHBondContact O-CG2 3.41Å; R67-V71 PolarHBondContact O-N 2.88Å
68	L	62.6	Low	65.5	Low	117 Å²	117	110.2 Å²	110.2	61%	0.613	58%	0.579	S	S	*	*	H	α-helix	trans	-67.3	-39.2	175.8	-165	69.2	0	0	0	110.5	T64 E65 V71 E72	T64-L68 WeakPolarHBondContact O-CB 3.42Å; T64-L68 PolarHBondContact O-N 2.87Å; E65-L68 WeakPolarHBondContact O-CB 2.99Å; E65-L68 PolarHBondContact O-N 3.11Å; E65-L68 VanDerWaalsContact O-N 3.16Å; L68-V71 CarbonylContact O-C 3.59Å; L68-V71 PolarHBondContact O-N 3.11Å; L68-E72 WeakPolarHBondContact O-CB 3.41Å; L68-E72 PolarHBondContact O-N 3.41Å
69	A	65.4	Low	63.5	Low	44 Å²	44	114.6 Å²	114.6	36%	0.364	60%	0.597	S	S	.	*	H	α-helix	trans	-67	-35.3	173.8	0	0	0	0	0	112.9	E65 A66 R67 E72 Q73	E65-A69 PolarHBondContact O-N 3.29Å; A66-A69 PolarHBondContact O-N 2.9Å; R67-A69 VanDerWaalsContact C-N 3.35Å; A69-E72 PolarHBondContact O-N 2.94Å; A69-Q73 WeakPolarHBondContact O-CG 3.4Å; A69-Q73 PolarHBondContact O-N 2.82Å
70	E	62.8	Low	61.2	Low	136 Å²	136	121.8 Å²	121.8	64%	0.636	62%	0.618	S	S	*	*	H	α-helix	trans	-70.1	-32.6	173.3	-164.8	176.5	-168.5	0	0	112	A66 R67 S74	A66-E70 PolarHBondContact O-N 2.84Å; R67-E70 PolarHBondContact O-N 2.84Å; E70-S74 WeakPolarHBondContact O-CB 3.15Å; E70-S74 PolarHBondContact O-N 2.8Å; E70-S74 PolarHBondContact O-OG 2.97Å
71	V	55.8	Low	59.2	Low	75 Å²	75	122.3 Å²	122.3	46%	0.455	63%	0.627	S	S	.	*	H	α-helix	trans	-73.6	-35.5	170.4	171.9	0	0	0	0	111.4	R67 L68 Q73 S74 S75	R67-V71 WeakPolarHBondContact O-CB 3.46Å; R67-V71 VanDerWaalsContact O-CG2 3.26Å; R67-V71 WeakPolarHBondContact O-CG2 3.41Å; R67-V71 PolarHBondContact O-N 2.88Å; L68-V71 CarbonylContact O-C 3.59Å; L68-V71 PolarHBondContact O-N 3.11Å; V71-Q73 VanDerWaalsContact C-N 3.29Å; V71-Q73 PolarHBondContact O-N 3.44Å; V71-S74 PolarHBondContact O-N 2.8Å; V71-S75 WeakPolarHBondContact O-CA 3.48Å; V71-S75 WeakPolarHBondContact O-CB 3.46Å; V71-S75 PolarHBondContact O-N 3.15Å; V71-S75 PolarHBondContact O-OG 2.94Å
72	E	51.8	Low	57.1	Low	144 Å²	144	127 Å²	127	67%	0.673	65%	0.647	S	S	*	*	H	α-helix	trans	-68.4	-29	176.1	-150.9	175.6	-171.3	0	0	111.8	L68 A69	L68-E72 WeakPolarHBondContact O-CB 3.41Å; L68-E72 PolarHBondContact O-N 3.41Å; A69-E72 PolarHBondContact O-N 2.94Å
73	Q	53.1	Low	54.5	Low	155 Å²	155	127.8 Å²	127.8	72%	0.724	66%	0.659	S	S	*	*	H	α-helix	trans	-83.7	-30	172	-72	-177.5	-5.4	0	0	113.5	A69 V71	A69-Q73 WeakPolarHBondContact O-CG 3.4Å; A69-Q73 PolarHBondContact O-N 2.82Å; V71-Q73 VanDerWaalsContact C-N 3.29Å; V71-Q73 PolarHBondContact O-N 3.44Å
74	S	55.6	Low	52.5	Low	89 Å²	89	127.5 Å²	127.5	62%	0.622	67%	0.668	S	S	*	*	H	α-helix	trans	-94.5	-9.4	178.6	66.7	0	0	0	0	115.1	E70 V71	E70-S74 WeakPolarHBondContact O-CB 3.15Å; E70-S74 PolarHBondContact O-N 2.8Å; E70-S74 PolarHBondContact O-OG 2.97Å; V71-S74 PolarHBondContact O-N 2.8Å
75	S	51.1	Low	50.6	Low	63 Å²	63	135.9 Å²	135.9	44%	0.441	69%	0.69	S	S	.	*	S	Bend	trans	-121.2	106.8	173.8	65.7	0	0	0	0	111.5	V71	V71-S75 WeakPolarHBondContact O-CA 3.48Å; V71-S75 WeakPolarHBondContact O-CB 3.46Å; V71-S75 PolarHBondContact O-N 3.15Å; V71-S75 PolarHBondContact O-OG 2.94Å
76	V	50.1	Low	48.1	Very low	140 Å²	140	133.5 Å²	133.5	85%	0.848	70%	0.699	S	S	*	*	S	Bend	trans	82.4	41.1	167.9	-156.3	0	0	0	0	116.9
77	V	42.7	Very low	45.8	Very low	118 Å²	118	135.2 Å²	135.2	72%	0.715	71%	0.713	S	S	*	*	S	Bend	trans	-132	-16.9	150.1	-175.4	0	0	0	0	113.4
78	E	38.7	Very low	43.6	Very low	161 Å²	161	132.8 Å²	132.8	75%	0.752	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.6	23.8	-175.3	-102.4	-174.7	176.2	0	0	116.5
79	F	36.5	Very low	41.9	Very low	202 Å²	202	130.7 Å²	130.7	89%	0.886	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.7	7.5	169.8	-145.4	-94.9	0	0	0	114.1
80	F	34.6	Very low	40.1	Very low	205 Å²	205	136.5 Å²	136.5	90%	0.899	76%	0.758	S	S	*	*	S	Bend	trans	-118.1	12.5	174.8	-89.4	-70.5	0	0	0	115
81	Q	39.5	Very low	38.4	Very low	164 Å²	164	141.3 Å²	141.3	77%	0.766	77%	0.77	S	S	*	*	S	Bend	trans	-129.3	132.9	166.9	-95.8	173.2	-32.6	0	0	109.9
82	E	32.7	Very low	37	Very low	191 Å²	191	142.6 Å²	142.6	89%	0.893	79%	0.788	S	S	*	*			trans	85.1	103.3	-173.3	-52.8	-172.7	162.3	0	0	113
83	V	28.7	Very low	35.9	Very low	136 Å²	136	139.3 Å²	139.3	82%	0.824	79%	0.794	S	S	*	*	S	Bend		-165.1	152.2	65.7	171	0	0	0	0	109.6
84	P	40.2	Very low	35.5	Very low	114 Å²	114	138.5 Å²	138.5	74%	0.74	80%	0.802	S	S	*	*			cis	-125.7	155	-42.1	33.3	-13.3	0	0	0	113.4
85	R	32.6	Very low	34.1	Very low	255 Å²	255	137.9 Å²	137.9	96%	0.962	81%	0.81	S	S	*	*			trans	-86.2	123.7	154.1	-86.5	-178.6	176.2	153.7	-0.8	108.9
86	G	26.4	Very low	32.9	Very low	72 Å²	72	141.4 Å²	141.4	74%	0.742	82%	0.824	S	S	*	*			trans	-87.8	139	163.8	0	0	0	0	0	111.8
87	A	27	Very low	31.8	Very low	97 Å²	97	144.5 Å²	144.5	80%	0.802	82%	0.82	S	S	*	*			trans	71.2	98.8	168.3	0	0	0	0	0	116.7
88	A	27.3	Very low	30.9	Very low	111 Å²	111	143.5 Å²	143.5	92%	0.917	82%	0.818	S	S	*	*				70.9	124.9	86.9	0	0	0	0	0	112.8
89	G	26.6	Very low	30.2	Very low	72 Å²	72	144.1 Å²	144.1	74%	0.742	82%	0.821	S	S	*	*			cis	179.7	-177.6	1.6	0	0	0	0	0	109.4
90	L	28.3	Very low	29.6	Very low	166 Å²	166	144.9 Å²	144.9	87%	0.869	82%	0.819	S	S	*	*			trans	95.3	97.5	166.7	-61.9	163.5	0	0	0	119.8
91	R	27.3	Very low	29.1	Very low	237 Å²	237	142.9 Å²	142.9	89%	0.894	81%	0.813	S	S	*	*				39.1	121.3	126.3	-75	-176	176.4	-168.7	-0.7	120.2
92	A	26.8	Very low	28.4	Very low	102 Å²	102	142 Å²	142	84%	0.843	81%	0.809	S	S	*	*				152.2	125.8	94	0	0	0	0	0	113.9
93	G	27.7	Very low	28	Very low	76 Å²	76	143.4 Å²	143.4	78%	0.784	81%	0.807	S	S	*	*			trans	71	150.3	134.9	0	0	0	0	0	121.8
94	P	44.3	Very low	28	Very low	137 Å²	137	141.7 Å²	141.7	89%	0.89	80%	0.802	S	S	*	*			trans	-114.5	161	-145.4	38.1	-24.6	0	0	0	115.2
95	G	27.7	Very low	27.5	Very low	77 Å²	77	146.5 Å²	146.5	79%	0.794	81%	0.805	S	S	*	*			trans	179.3	91.7	172.5	0	0	0	0	0	115.5
96	D	25.3	Very low	27.2	Very low	137 Å²	137	141.1 Å²	141.1	73%	0.733	80%	0.796	S	S	*	*			trans	23	140.6	142.4	-144.9	11.9	0	0	0	123.4
97	R	26.4	Very low	27.3	Very low	205 Å²	205	146.4 Å²	146.4	77%	0.774	80%	0.798	S	S	*	*			trans	75.5	111.6	142.5	-103.1	172.1	178.6	174.4	-1	123.4
98	S	24.2	Very low	27.5	Very low	96 Å²	96	152.3 Å²	152.3	67%	0.671	80%	0.8	S	S	*	*				70	133.7	118.9	68.3	0	0	0	0	122.7
99	Q	23.8	Very low	28	Very low	175 Å²	175	152 Å²	152	82%	0.818	79%	0.791	S	S	*	*			trans	87.8	105.3	148.4	-78.4	179.9	0.8	0	0	119.8
100	Y	23.7	Very low	28.4	Very low	217 Å²	217	156.5 Å²	156.5	85%	0.851	79%	0.792	S	S	*	*				36.5	133.3	122.2	-83.8	-90	0	0	0	120.7
101	Q	25.3	Very low	28.9	Very low	163 Å²	163	155.5 Å²	155.5	76%	0.762	78%	0.783	S	S	*	*			trans	104.9	122.6	145.7	-88.9	164.8	-34.5	0	0	120.3
102	Q	24.9	Very low	29.3	Very low	147 Å²	147	151.6 Å²	151.6	69%	0.687	78%	0.779	S	S	*	*			trans	90.4	104.1	133.8	-96.8	156.5	-55.5	0	0	121.4
103	Y	24	Very low	29.9	Very low	219 Å²	219	154.4 Å²	154.4	86%	0.859	78%	0.775	S	S	*	*				57.8	110.9	119.9	-85.3	-90.2	0	0	0	119.9
104	S	27.8	Very low	30.3	Very low	100 Å²	100	158.9 Å²	158.9	70%	0.699	77%	0.773	S	S	*	*				124.7	132.3	110.5	-159.9	0	0	0	0	116.7
105	R	29.7	Very low	29.9	Very low	215 Å²	215	159 Å²	159	81%	0.811	77%	0.766	S	S	*	*			trans	89.1	105.6	150.8	-86.8	177.6	178.8	171.5	0.9	121.4
106	N	27.4	Very low	30.5	Very low	143 Å²	143	163 Å²	163	77%	0.765	77%	0.769	S	S	*	*				100.4	143	109.7	-87.1	11.4	0	0	0	121.3
107	K	28.3	Very low	31	Very low	183 Å²	183	165.2 Å²	165.2	80%	0.796	77%	0.774	S	S	*	*			trans	82.5	79.3	158.9	-78.5	-178.2	169.4	-177.1	0	117.6
108	R	30.9	Very low	31.3	Very low	221 Å²	221	165.9 Å²	165.9	83%	0.834	78%	0.777	S	S	*	*	S	Bend		-167.4	57.1	124.1	-150.2	170.2	-163.5	179	4.5	111.9
109	S	37.4	Very low	31.8	Very low	104 Å²	104	170.3 Å²	170.3	73%	0.727	79%	0.787	S	S	*	*			trans	-124.6	30.5	172	65.4	0	0	0	0	111.8
110	E	35.6	Very low	32.1	Very low	167 Å²	167	173.1 Å²	173.1	78%	0.78	79%	0.79	S	S	*	*	S	Bend	trans	-109.5	13.1	174.8	-87.4	-173.8	149	0	0	113.3
111	E	38	Very low	32.3	Very low	144 Å²	144	171.5 Å²	171.5	67%	0.673	79%	0.79	S	S	*	*	S	Bend	trans	-128.4	8	-179.4	-77	-178.8	149.7	0	0	115.1
112	L	36.7	Very low	32.4	Very low	155 Å²	155	172.3 Å²	172.3	81%	0.812	79%	0.793	S	S	*	*	S	Bend	trans	-118.3	8	173.2	-147.6	77.5	0	0	0	113.9
113	E	39.1	Very low	32.5	Very low	161 Å²	161	172.4 Å²	172.4	75%	0.752	80%	0.799	S	S	*	*	S	Bend	trans	-106.3	7.7	173.8	-104.6	-179.7	165.9	0	0	113.1
114	K	36.1	Very low	32.6	Very low	170 Å²	170	169.2 Å²	169.2	74%	0.739	80%	0.796	S	S	*	*	S	Bend	trans	-99.5	-5.5	175.3	-90.8	-178.2	177.2	173	0	116
115	D	36.5	Very low	32.6	Very low	139 Å²	139	173 Å²	173	74%	0.743	80%	0.803	S	S	*	*	S	Bend	trans	-114.8	6.2	-177.4	-72.7	-21	0	0	0	115
116	L	38.5	Very low	32.4	Very low	163 Å²	163	166.2 Å²	166.2	85%	0.853	80%	0.799	S	S	*	*	S	Bend	trans	-119	10	175.3	-85.6	156.6	0	0	0	114.3
117	Q	36.1	Very low	32.4	Very low	182 Å²	182	169.8 Å²	169.8	85%	0.85	81%	0.808	S	S	*	*	S	Bend	trans	-116.5	26.1	170.2	-73.8	-173.4	-12.9	0	0	113
118	R	33.9	Very low	32.2	Very low	220 Å²	220	164.2 Å²	164.2	83%	0.83	80%	0.803	S	S	*	*	S	Bend	trans	-123.3	18.2	178.3	-102.6	-175	-176.3	178.6	1	116.7
119	E	34.4	Very low	31.9	Very low	189 Å²	189	161.3 Å²	161.3	88%	0.883	80%	0.803	S	S	*	*	S	Bend	trans	-141.4	62.9	168	-73	-165.6	160.4	0	0	112.5
120	R	29.7	Very low	31.4	Very low	233 Å²	233	166.3 Å²	166.3	88%	0.879	81%	0.806	S	S	*	*	S	Bend	trans	-167.4	87	151.4	-109.3	-173.6	-65.4	-164.5	2.6	109.2
121	H	27.7	Very low	30.9	Very low	184 Å²	184	165.4 Å²	165.4	85%	0.852	81%	0.806	S	S	*	*			trans	160.2	97	142.5	-87.7	-64.7	0	0	0	110.5
122	H	27.6	Very low	30.3	Very low	180 Å²	180	165.8 Å²	165.8	83%	0.833	81%	0.805	S	S	*	*			trans	159.5	111.7	159.6	-94.5	-62.1	0	0	0	103.3
123	D	26.6	Very low	29.8	Very low	149 Å²	149	166 Å²	166	80%	0.797	80%	0.802	S	S	*	*			cis	-152.9	147	47.7	-74.1	-43.4	0	0	0	112.5
124	D	26.7	Very low	29.1	Very low	152 Å²	152	162.3 Å²	162.3	81%	0.813	80%	0.799	S	S	*	*			trans	-110.3	152.8	153.1	-164.3	7.2	0	0	0	107.9
125	E	27	Very low	28.5	Very low	180 Å²	180	159 Å²	159	84%	0.841	80%	0.797	S	S	*	*			trans	77.8	111.7	171.5	-59.1	-158.6	137	0	0	121.1
126	G	26.2	Very low	28	Very low	71 Å²	71	159.8 Å²	159.8	73%	0.732	80%	0.796	S	S	*	*				132.2	96.3	113.6	0	0	0	0	0	119.7
127	K	26.3	Very low	27.4	Very low	218 Å²	218	159 Å²	159	95%	0.948	79%	0.788	S	S	*	*			trans	76.3	118.3	141.3	-62.8	176.5	179.2	171.5	0	120.4
128	G	24.3	Very low	26.8	Very low	66 Å²	66	157.1 Å²	157.1	68%	0.68	79%	0.789	S	S	*	*				125.4	121.3	107.8	0	0	0	0	0	118.2
129	L	26.2	Very low	26.4	Very low	161 Å²	161	149.3 Å²	149.3	84%	0.843	78%	0.777	S	S	*	*			trans	78.3	102	149.7	-64.6	144.2	0	0	0	117
130	R	25.3	Very low	25.9	Very low	209 Å²	209	149.4 Å²	149.4	79%	0.789	78%	0.777	S	S	*	*				83	114	73.8	-166	-171.7	-151	177.7	6.8	112.7
131	L	25.9	Very low	25.7	Very low	148 Å²	148	144.6 Å²	144.6	78%	0.775	77%	0.765	S	S	*	*			trans	161.3	106	135.4	-85.6	150.5	0	0	0	107
132	K	25.2	Very low	25.5	Very low	152 Å²	152	143.2 Å²	143.2	66%	0.661	76%	0.756	S	S	*	*				61	111.8	88.3	-86.3	179.4	152.9	-120.8	0	111.6
133	E	26	Very low	25.4	Very low	159 Å²	159	141.1 Å²	141.1	74%	0.743	75%	0.751	S	S	*	*				132.5	151.8	94.6	-97.1	162.4	-163	0	0	103.9
134	A	24.5	Very low	25.3	Very low	84 Å²	84	142.3 Å²	142.3	69%	0.694	75%	0.752	S	S	*	*			cis	-161.2	138.7	3.7	0	0	0	0	0	104.4
135	S	24.7	Very low	25.2	Very low	99 Å²	99	143 Å²	143	69%	0.692	75%	0.753	S	S	*	*				48.4	127.3	96.4	-50.3	0	0	0	0	117.4
136	Q	25.9	Very low	25.1	Very low	156 Å²	156	143.9 Å²	143.9	73%	0.729	75%	0.754	S	S	*	*			trans	79.6	147	131	-89.8	177.5	-45.6	0	0	118.1
137	E	26.2	Very low	25.1	Very low	147 Å²	147	149.2 Å²	149.2	69%	0.687	76%	0.759	S	S	*	*			cis	-179.1	-176.8	-2	-144.3	166.3	-138.2	0	0	106.7
138	V	23.4	Very low	25.1	Very low	142 Å²	142	146.6 Å²	146.6	86%	0.861	75%	0.75	S	S	*	*			trans	82.2	133.7	159	-160.2	0	0	0	0	116.3
139	G	24.8	Very low	25.3	Very low	57 Å²	57	150.3 Å²	150.3	59%	0.588	75%	0.754	S	S	*	*			cis	170.3	138	5.5	0	0	0	0	0	106.7
140	E	24.1	Very low	25.3	Very low	190 Å²	190	151.7 Å²	151.7	89%	0.888	75%	0.753	S	S	*	*				49.9	132.1	109.3	-76.8	-177.5	159.5	0	0	114.6
141	E	25.6	Very low	25.5	Very low	132 Å²	132	151.2 Å²	151.2	62%	0.617	76%	0.759	S	S	*	*			cis	-175.9	154.9	34.6	-130.6	-173.1	158.8	0	0	110.1
142	K	23.5	Very low	25.7	Very low	155 Å²	155	153.2 Å²	153.2	67%	0.674	76%	0.762	S	S	*	*			trans	59.8	149.1	144.8	-74.8	168.4	179.5	162.3	0	120.5
143	D	24.6	Very low	25.9	Very low	136 Å²	136	154.2 Å²	154.2	73%	0.727	77%	0.768	S	S	*	*			cis	-160	166.6	19.7	-133.5	-26.8	0	0	0	111.6
144	E	25.3	Very low	26	Very low	175 Å²	175	157.4 Å²	157.4	82%	0.818	77%	0.774	S	S	*	*			trans	-66.2	158.2	-173	-63.5	176.8	130.1	0	0	116.8
145	M	24.1	Very low	26.2	Very low	167 Å²	167	162.9 Å²	162.9	82%	0.823	78%	0.784	S	S	*	*				145.2	107.6	119.9	-164.2	-166.9	-33.8	0	0	113.1
146	K	25.2	Very low	26.3	Very low	198 Å²	198	161.1 Å²	161.1	86%	0.861	78%	0.782	S	S	*	*				178.4	125.2	119.7	-98.5	176.4	-178.7	-179.1	0	112
147	H	26.6	Very low	26.5	Very low	183 Å²	183	160.3 Å²	160.3	85%	0.847	78%	0.778	S	S	*	*			trans	-77	163.2	173.6	-134.9	-102	0	0	0	110.8
148	E	25.6	Very low	26.7	Very low	162 Å²	162	162.8 Å²	162.8	76%	0.757	79%	0.789	S	S	*	*			trans	87	100.8	166.6	-51	-159.4	140.3	0	0	118.7
149	L	28.5	Very low	27.3	Very low	145 Å²	145	163.8 Å²	163.8	76%	0.759	78%	0.779	S	S	*	*	S	Bend		-177.2	134	95.3	-112.7	99.6	0	0	0	110.6
150	K	26.3	Very low	27.9	Very low	190 Å²	190	167.6 Å²	167.6	83%	0.826	79%	0.786	S	S	*	*			trans	74.5	80.3	161	-64	175	175.4	175.2	0	118.3	K152	K150-K152 PolarHBondContact O-N 3.48Å
151	H	29	Very low	29	Very low	198 Å²	198	161 Å²	161	92%	0.917	76%	0.758	S	S	*	*			trans	-76.4	103.1	151.3	-94.9	-70.2	0	0	0	110.6
152	K	30.9	Very low	29.9	Very low	190 Å²	190	161.5 Å²	161.5	83%	0.826	76%	0.761	S	S	*	*			trans	-145.8	77.4	157.7	-147.3	-177	-164.6	-177.1	0	108.9	K150	K150-K152 PolarHBondContact O-N 3.48Å
153	H	30.1	Very low	31.3	Very low	173 Å²	173	160.6 Å²	160.6	80%	0.801	76%	0.763	S	S	*	*			trans	-176.2	128.3	150.2	-103.1	15.9	0	0	0	113.7
154	R	27.6	Very low	33.2	Very low	226 Å²	226	157.9 Å²	157.9	85%	0.853	75%	0.749	S	S	*	*			trans	79.7	86	130.9	-145.7	173.4	-168.6	-177.9	2.1	118.1	G156	R154-G156 PolarHBondContact O-N 2.83Å
155	H	28.4	Very low	35.2	Very low	199 Å²	199	153.5 Å²	153.5	92%	0.921	73%	0.729	S	S	*	*			trans	-71.7	97.9	144.1	-98.8	-40.2	0	0	0	108.5	Q157	H155-Q157 PolarHBondContact O-N 2.85Å
156	G	27.1	Very low	36.7	Very low	62 Å²	62	149.3 Å²	149.3	64%	0.639	71%	0.709	S	S	*	*			trans	-82	99.8	159	0	0	0	0	0	108.4	R154 H158	R154-G156 PolarHBondContact O-N 2.83Å; G156-H158 PolarHBondContact O-N 3.18Å
157	Q	29.1	Very low	38.5	Very low	140 Å²	140	143.4 Å²	143.4	65%	0.654	69%	0.685	S	S	*	*			trans	-68.7	121.9	160.3	-89.7	172	-26.7	0	0	107.6	H155 Y159	H155-Q157 PolarHBondContact O-N 2.85Å; Q157-Y159 VanDerWaalsContact C-N 3.3Å; Q157-Y159 HydrophobicContact CB-CD2 3.98Å; Q157-Y159 HydrophobicContact CB-CE2 3.69Å; Q157-Y159 WeakPolarHBondContact O-CD2 3.49Å; Q157-Y159 PolarHBondContact O-N 2.82Å; Q157-Y159 PolarHBondContact OE1-OH 2.8Å
158	H	30.6	Very low	39.5	Very low	199 Å²	199	139.3 Å²	139.3	92%	0.921	67%	0.668	S	S	*	*			trans	-68.1	90.5	169.6	-123.7	-81.3	0	0	0	107.8	G156	G156-H158 PolarHBondContact O-N 3.18Å
159	Y	36.4	Very low	40.8	Very low	163 Å²	163	138.1 Å²	138.1	64%	0.639	66%	0.663	S	S	*	*			trans	-76.2	120	167.8	-77.7	-86.6	0	0	0	108.2	Q157 T161	Q157-Y159 VanDerWaalsContact C-N 3.3Å; Q157-Y159 HydrophobicContact CB-CD2 3.98Å; Q157-Y159 HydrophobicContact CB-CE2 3.69Å; Q157-Y159 WeakPolarHBondContact O-CD2 3.49Å; Q157-Y159 PolarHBondContact O-N 2.82Å; Q157-Y159 PolarHBondContact OE1-OH 2.8Å; Y159-T161 VanDerWaalsContact C-N 3.35Å; Y159-T161 PolarHBondContact O-N 3.45Å
160	N	36.7	Very low	41.4	Very low	136 Å²	136	134.9 Å²	134.9	73%	0.727	65%	0.65	S	S	*	*			trans	-79.8	85.2	175.8	-161.8	7.8	0	0	0	108.8	Q162	N160-Q162 PolarHBondContact O-N 3.14Å; N160-Q162 VanDerWaalsContact O-N 3.15Å
161	T	47.6	Very low	42.4	Very low	52 Å²	52	132.8 Å²	132.8	32%	0.319	64%	0.638	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.2	26.6	-171.7	49.8	0	0	0	0	114.1	Y159	Y159-T161 VanDerWaalsContact C-N 3.35Å; Y159-T161 PolarHBondContact O-N 3.45Å
162	Q	45.5	Very low	43.4	Very low	142 Å²	142	126.1 Å²	126.1	66%	0.664	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	-18.2	-170.1	-144.4	142.5	-35.1	0	0	113.5	N160	N160-Q162 PolarHBondContact O-N 3.14Å; N160-Q162 VanDerWaalsContact O-N 3.15Å
163	D	51.6	Low	44.5	Very low	136 Å²	136	120.9 Å²	120.9	73%	0.727	59%	0.593	S	S	*	*	S	Bend	trans	-126.2	7.7	-176.2	-65.7	-34.3	0	0	0	115.1	M165	D163-M165 PolarHBondContact O-N 3.43Å
164	D	64.3	Low	46.2	Very low	80 Å²	80	114.5 Å²	114.5	43%	0.428	57%	0.566	S	S	.	*			trans	-85.3	120.9	-178.5	-69.3	-28	0	0	0	110.9	I176	D164-I176 HydrophobicContact CB-CB 4.36Å; D164-I176 HydrophobicContact CB-CD1 3.56Å; D164-I176 HydrophobicContact CB-CG1 4.16Å; D164-I176 WeakPolarHBondContact O-CB 3.46Å; D164-I176 VanDerWaalsContact O-CG1 3.31Å; D164-I176 WeakPolarHBondContact O-CG1 3.46Å; D164-I176 PolarHBondContact O-N 3.19Å
165	M	68.4	Low	48.5	Very low	83 Å²	83	106.2 Å²	106.2	41%	0.409	54%	0.542	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	135.2	177.5	-59	-68.8	-71.9	0	0	109.1	D163 M173 P175	D163-M165 PolarHBondContact O-N 3.43Å; M165-M173 HydrophobicContact CB-CE 3.55Å; M165-M173 HydrophobicContact CE-CB 3.91Å; M165-M173 HydrophobicContact CG-CE 4.4Å; M165-P175 HydrophobicContact CE-CG 3.89Å; M165-P175 WeakPolarHBondContact SD-CA 3.48Å; M165-P175 HydrophobicContact SD-CB 3.79Å; M165-P175 HydrophobicContact SD-CG 3.65Å
166	M	55	Low	50.5	Low	79 Å²	79	99 Å²	99	39%	0.389	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	131.5	177.5	-166.5	168.8	95.7	0	0	110.5	M168 V174 I176 L179	M166-M168 HydrophobicContact CE-CE 3.8Å; M166-M168 HydrophobicContact CE-SD 3.82Å; M166-M168 PolarHBondContact O-N 2.97Å; M166-V174 PolarHBondContact N-O 3.18Å; M166-V174 PolarHBondContact O-N 3.12Å; M166-I176 HydrophobicContact CB-CD1 4.16Å; M166-I176 HydrophobicContact CB-CG1 3.66Å; M166-L179 HydrophobicContact CB-CD1 4.19Å; M166-L179 HydrophobicContact CE-CD1 3.68Å
167	M	63.8	Low	52.7	Low	73 Å²	73	100.9 Å²	100.9	36%	0.36	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	120.5	172.6	-71.7	-93.4	-79	0	0	108.5	S172 M173	M167-S172 WeakPolarHBondContact CA-O 3.19Å; M167-M173 HydrophobicContact CB-SD 4.48Å; M167-M173 HydrophobicContact CG-SD 3.42Å; M167-M173 WeakPolarHBondContact CG-SD 3.26Å; M167-M173 HydrophobicContact SD-CG 4.17Å; M167-M173 HydrophobicContact SD-SD 3.4Å
168	M	47.8	Very low	54.7	Low	98 Å²	98	98.7 Å²	98.7	48%	0.483	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	-23.1	170.3	-74.3	-83.1	56.9	0	0	113.2	M166 S172 L179	M166-M168 HydrophobicContact CE-CE 3.8Å; M166-M168 HydrophobicContact CE-SD 3.82Å; M166-M168 PolarHBondContact O-N 2.97Å; M168-S172 PolarHBondContact N-O 2.92Å; M168-S172 VanDerWaalsContact N-O 3.14Å; M168-L179 HydrophobicContact CG-CD1 4.4Å; M168-L179 HydrophobicContact SD-CD2 4.4Å
169	M	52.1	Low	56.6	Low	136 Å²	136	91.4 Å²	91.4	67%	0.67	46%	0.46	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-151.9	178.7	174	-66.4	-59.3	-79.4	0	0	110.1	Y171 S172	M169-Y171 PolarHBondContact O-N 2.74Å; M169-S172 PolarHBondContact O-N 3.05Å
170	T	41.7	Very low	58.3	Low	78 Å²	78	87 Å²	87	48%	0.479	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-9.6	-177.7	44.8	0	0	0	0	115.7
171	Y	46.2	Very low	59.9	Low	146 Å²	146	84.3 Å²	84.3	57%	0.573	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.3	7.9	-175.4	-58.7	-72.8	0	0	0	115.1	M169 F372 K453	M169-Y171 PolarHBondContact O-N 2.74Å; Y171-F372 HydrophobicContact CD1-CE2 4.14Å; Y171-F372 HydrophobicContact CD1-CZ 4.03Å; Y171-F372 HydrophobicContact CE1-CE1 4.1Å; Y171-F372 AromaticContact CE1-CE2 3.69Å; Y171-F372 HydrophobicContact CE1-CE2 3.69Å; Y171-F372 AromaticContact CE1-CZ 3.21Å; Y171-F372 HydrophobicContact CE1-CZ 3.21Å; Y171-F372 AromaticContact CZ-CZ 3.66Å; Y171-K453 PolarHBondContact OH-NZ 2.94Å
172	S	51.6	Low	61.2	Low	57 Å²	57	86.3 Å²	86.3	40%	0.399	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	115.7	-170.8	-45	0	0	0	0	111.6	M167 M168 M169	M167-S172 WeakPolarHBondContact CA-O 3.19Å; M168-S172 PolarHBondContact N-O 2.92Å; M168-S172 VanDerWaalsContact N-O 3.14Å; M169-S172 PolarHBondContact O-N 3.05Å
173	M	52.1	Low	62.2	Low	80 Å²	80	81.5 Å²	81.5	39%	0.394	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	121.1	176.2	-67.7	-71.9	-86	0	0	109.4	M165 M167	M165-M173 HydrophobicContact CB-CE 3.55Å; M165-M173 HydrophobicContact CE-CB 3.91Å; M165-M173 HydrophobicContact CG-CE 4.4Å; M167-M173 HydrophobicContact CB-SD 4.48Å; M167-M173 HydrophobicContact CG-SD 3.42Å; M167-M173 WeakPolarHBondContact CG-SD 3.26Å; M167-M173 HydrophobicContact SD-CG 4.17Å; M167-M173 HydrophobicContact SD-SD 3.4Å
174	V	65.8	Low	62.9	Low	39 Å²	39	80.7 Å²	80.7	24%	0.236	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	133.6	177.5	-176.3	0	0	0	0	109.1	M166 I176 L178 L179	M166-V174 PolarHBondContact N-O 3.18Å; M166-V174 PolarHBondContact O-N 3.12Å; V174-I176 PolarHBondContact O-N 3.39Å; V174-L178 HydrophobicContact CG1-CB 4.18Å; V174-L178 HydrophobicContact CG1-CD2 3.96Å; V174-L179 HydrophobicContact CB-CD1 4.22Å; V174-L179 HydrophobicContact CG1-CD1 4.15Å; V174-L179 HydrophobicContact CG1-CG 3.95Å
175	P	76.1	Confident	63.2	Low	53 Å²	53	81.7 Å²	81.7	34%	0.344	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.4	131	174.1	-18.8	29.1	0	0	0	110.6	M165 K177 L178 L179	M165-P175 HydrophobicContact CE-CG 3.89Å; M165-P175 WeakPolarHBondContact SD-CA 3.48Å; M165-P175 HydrophobicContact SD-CB 3.79Å; M165-P175 HydrophobicContact SD-CG 3.65Å; P175-K177 PolarHBondContact O-N 2.86Å; P175-L178 HydrophobicContact CB-CB 4.19Å; P175-L178 HydrophobicContact CG-CB 4.44Å; P175-L178 WeakPolarHBondContact O-CA 3.36Å; P175-L178 VanDerWaalsContact O-CB 3.27Å; P175-L178 WeakPolarHBondContact O-CB 3.49Å; P175-L178 PolarHBondContact O-N 3.48Å; P175-L179 PolarHBondContact O-N 3.43Å
176	I	72	Confident	63.2	Low	46 Å²	46	81 Å²	81	24%	0.236	43%	0.431	C	S	.	.	H	α-helix	trans	-57.8	-35.9	178.6	-69.8	-177.2	0	0	0	110.4	D164 M166 V174 L178 L179 I180	D164-I176 HydrophobicContact CB-CB 4.36Å; D164-I176 HydrophobicContact CB-CD1 3.56Å; D164-I176 HydrophobicContact CB-CG1 4.16Å; D164-I176 WeakPolarHBondContact O-CB 3.46Å; D164-I176 VanDerWaalsContact O-CG1 3.31Å; D164-I176 WeakPolarHBondContact O-CG1 3.46Å; D164-I176 PolarHBondContact O-N 3.19Å; M166-I176 HydrophobicContact CB-CD1 4.16Å; M166-I176 HydrophobicContact CB-CG1 3.66Å; V174-I176 PolarHBondContact O-N 3.39Å; I176-L178 VanDerWaalsContact C-N 3.3Å; I176-L178 PolarHBondContact O-N 3.12Å; I176-L179 PolarHBondContact O-N 3.37Å; I176-I180 HydrophobicContact CG2-CD1 3.58Å; I176-I180 HydrophobicContact CG2-CG1 4.07Å; I176-I180 VanDerWaalsContact O-CG1 3.32Å; I176-I180 WeakPolarHBondContact O-CG1 3.19Å; I176-I180 PolarHBondContact O-N 2.9Å
177	K	71.4	Confident	63.4	Low	102 Å²	102	87.1 Å²	87.1	44%	0.443	46%	0.456	S	S	.	.	H	α-helix	trans	-57.5	-41.7	173.7	-173.8	167.3	-177.6	165.5	0	112.5	P175 L179 I180 D181	P175-K177 PolarHBondContact O-N 2.86Å; K177-L179 PolarHBondContact O-N 3.36Å; K177-I180 PolarHBondContact O-N 2.81Å; K177-D181 WeakPolarHBondContact CG-OD2 3.49Å; K177-D181 VanDerWaalsContact O-CB 3.25Å; K177-D181 WeakPolarHBondContact O-CB 3.38Å; K177-D181 PolarHBondContact O-N 3.26Å
178	L	71.1	Confident	63	Low	94 Å²	94	86.5 Å²	86.5	49%	0.492	47%	0.468	S	S	.	.	H	α-helix	trans	-64.1	-41.8	177.3	-152.2	91.8	0	0	0	111.2	V174 P175 I176 D181 I182	V174-L178 HydrophobicContact CG1-CB 4.18Å; V174-L178 HydrophobicContact CG1-CD2 3.96Å; P175-L178 HydrophobicContact CB-CB 4.19Å; P175-L178 HydrophobicContact CG-CB 4.44Å; P175-L178 WeakPolarHBondContact O-CA 3.36Å; P175-L178 VanDerWaalsContact O-CB 3.27Å; P175-L178 WeakPolarHBondContact O-CB 3.49Å; P175-L178 PolarHBondContact O-N 3.48Å; I176-L178 VanDerWaalsContact C-N 3.3Å; I176-L178 PolarHBondContact O-N 3.12Å; L178-D181 PolarHBondContact O-N 2.8Å; L178-I182 HydrophobicContact CD2-CD1 4.23Å; L178-I182 HydrophobicContact CG-CD1 4.27Å; L178-I182 WeakPolarHBondContact O-CB 3.49Å; L178-I182 WeakPolarHBondContact O-CD1 3.32Å; L178-I182 WeakPolarHBondContact O-CG1 3.44Å; L178-I182 PolarHBondContact O-N 2.89Å
179	L	71	Confident	63.3	Low	46 Å²	46	87.6 Å²	87.6	24%	0.241	48%	0.48	C	S	.	.	H	α-helix	trans	-66	-43.4	176.1	-80.3	159.5	0	0	0	112.3	M166 M168 V174 P175 I176 K177 I182 C183	M166-L179 HydrophobicContact CB-CD1 4.19Å; M166-L179 HydrophobicContact CE-CD1 3.68Å; M168-L179 HydrophobicContact CG-CD1 4.4Å; M168-L179 HydrophobicContact SD-CD2 4.4Å; V174-L179 HydrophobicContact CB-CD1 4.22Å; V174-L179 HydrophobicContact CG1-CD1 4.15Å; V174-L179 HydrophobicContact CG1-CG 3.95Å; P175-L179 PolarHBondContact O-N 3.43Å; I176-L179 PolarHBondContact O-N 3.37Å; K177-L179 PolarHBondContact O-N 3.36Å; L179-I182 PolarHBondContact O-N 3.03Å; L179-C183 VanDerWaalsContact O-CB 3.3Å; L179-C183 WeakPolarHBondContact O-CB 3.4Å; L179-C183 PolarHBondContact O-N 2.7Å
180	I	72.1	Confident	63.2	Low	70 Å²	70	84.1 Å²	84.1	36%	0.359	47%	0.468	S	S	.	.	H	α-helix	trans	-63.8	-43	176.3	-69.7	172.7	0	0	0	110.4	I176 K177 C183 N184	I176-I180 HydrophobicContact CG2-CD1 3.58Å; I176-I180 HydrophobicContact CG2-CG1 4.07Å; I176-I180 VanDerWaalsContact O-CG1 3.32Å; I176-I180 WeakPolarHBondContact O-CG1 3.19Å; I176-I180 PolarHBondContact O-N 2.9Å; K177-I180 PolarHBondContact O-N 2.81Å; I180-C183 PolarHBondContact O-N 3.44Å; I180-N184 WeakPolarHBondContact CG2-ND2 3.46Å; I180-N184 WeakPolarHBondContact O-CB 3.46Å; I180-N184 VanDerWaalsContact O-CG 3.27Å; I180-N184 PolarHBondContact O-N 3.38Å; I180-N184 PolarHBondContact O-ND2 3.05Å
181	D	71.3	Confident	63.6	Low	80 Å²	80	88.5 Å²	88.5	43%	0.428	49%	0.488	S	S	.	.	H	α-helix	trans	-67.5	-39.8	179.6	-69.6	-18	0	0	0	111.2	K177 L178 N184 S185	K177-D181 WeakPolarHBondContact CG-OD2 3.49Å; K177-D181 VanDerWaalsContact O-CB 3.25Å; K177-D181 WeakPolarHBondContact O-CB 3.38Å; K177-D181 PolarHBondContact O-N 3.26Å; L178-D181 PolarHBondContact O-N 2.8Å; D181-N184 PolarHBondContact O-N 2.83Å; D181-S185 WeakPolarHBondContact O-CB 3.49Å; D181-S185 PolarHBondContact O-N 2.86Å
182	I	74.8	Confident	63.6	Low	94 Å²	94	86 Å²	86	48%	0.482	50%	0.497	S	S	.	.	H	α-helix	trans	-62.7	-44	171.4	-70	163.6	0	0	0	111	L178 L179 S185 T186	L178-I182 HydrophobicContact CD2-CD1 4.23Å; L178-I182 HydrophobicContact CG-CD1 4.27Å; L178-I182 WeakPolarHBondContact O-CB 3.49Å; L178-I182 WeakPolarHBondContact O-CD1 3.32Å; L178-I182 WeakPolarHBondContact O-CG1 3.44Å; L178-I182 PolarHBondContact O-N 2.89Å; L179-I182 PolarHBondContact O-N 3.03Å; I182-S185 PolarHBondContact O-N 2.77Å; I182-T186 WeakPolarHBondContact O-CB 3.31Å; I182-T186 WeakPolarHBondContact O-CG2 3.42Å; I182-T186 PolarHBondContact O-N 2.95Å; I182-T186 VanDerWaalsContact O-N 3.12Å; I182-T186 PolarHBondContact O-OG1 2.94Å
183	C	65.5	Low	63.7	Low	42 Å²	42	85.9 Å²	85.9	28%	0.284	51%	0.505	S	S	.	.	H	α-helix	trans	-64.8	-39.5	178	-106.6	0	0	0	0	112.5	L179 I180 T186 C190	L179-C183 VanDerWaalsContact O-CB 3.3Å; L179-C183 WeakPolarHBondContact O-CB 3.4Å; L179-C183 PolarHBondContact O-N 2.7Å; I180-C183 PolarHBondContact O-N 3.44Å; C183-T186 PolarHBondContact O-OG1 2.73Å; C183-C190 WeakPolarHBondContact CB-SG 3.39Å; C183-C190 WeakPolarHBondContact SG-CB 3.31Å; C183-C190 CovalentContact SG-SG 2.05Å; C183-C190 PolarHBondContact SG-SG 2.77Å
184	N	65.9	Low	63.3	Low	119 Å²	119	87.7 Å²	87.7	64%	0.636	52%	0.523	S	S	*	.	H	α-helix	trans	-72.5	-36.2	176.7	-74.8	-26.2	0	0	0	111.9	I180 D181 T186	I180-N184 WeakPolarHBondContact CG2-ND2 3.46Å; I180-N184 WeakPolarHBondContact O-CB 3.46Å; I180-N184 VanDerWaalsContact O-CG 3.27Å; I180-N184 PolarHBondContact O-N 3.38Å; I180-N184 PolarHBondContact O-ND2 3.05Å; D181-N184 PolarHBondContact O-N 2.83Å; N184-T186 VanDerWaalsContact C-N 3.32Å; N184-T186 PolarHBondContact O-N 3.27Å
185	S	72.2	Confident	62.6	Low	101 Å²	101	91.8 Å²	91.8	71%	0.706	55%	0.55	S	S	*	*	H	α-helix	trans	-72.2	-22.5	179.1	-172.7	0	0	0	0	113.4	D181 I182	D181-S185 WeakPolarHBondContact O-CB 3.49Å; D181-S185 PolarHBondContact O-N 2.86Å; I182-S185 PolarHBondContact O-N 2.77Å
186	T	67.9	Low	61.3	Low	69 Å²	69	92.1 Å²	92.1	42%	0.423	56%	0.563	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94.9	9.7	-176.5	48.1	0	0	0	0	114.7	I182 C183 N184 G188	I182-T186 WeakPolarHBondContact O-CB 3.31Å; I182-T186 WeakPolarHBondContact O-CG2 3.42Å; I182-T186 PolarHBondContact O-N 2.95Å; I182-T186 VanDerWaalsContact O-N 3.12Å; I182-T186 PolarHBondContact O-OG1 2.94Å; C183-T186 PolarHBondContact O-OG1 2.73Å; N184-T186 VanDerWaalsContact C-N 3.32Å; N184-T186 PolarHBondContact O-N 3.27Å; T186-G188 PolarHBondContact O-N 3.3Å; T186-G188 VanDerWaalsContact O-N 3.12Å
187	K	59	Low	60.4	Low	207 Å²	207	95.5 Å²	95.5	90%	0.9	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	45.4	43.8	179.3	-70.6	-173.5	178.6	177.9	0	113.5
188	G	55	Low	59.9	Low	60 Å²	60	96.7 Å²	96.7	62%	0.619	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	103	14.7	163.4	0	0	0	0	0	117.8	T186 C190	T186-G188 PolarHBondContact O-N 3.3Å; T186-G188 VanDerWaalsContact O-N 3.12Å; G188-C190 PolarHBondContact O-N 2.8Å
189	V	53.9	Low	58.9	Low	121 Å²	121	95.6 Å²	95.6	73%	0.733	62%	0.618	S	S	*	*			trans	-88.3	59.8	163.1	-165.6	0	0	0	0	109.7
190	C	51	Low	57.8	Low	62 Å²	62	101.1 Å²	101.1	42%	0.419	65%	0.647	S	S	.	*			trans	-89.8	121	156.9	-52.9	0	0	0	0	105.2	C183 G188 A192	C183-C190 WeakPolarHBondContact CB-SG 3.39Å; C183-C190 WeakPolarHBondContact SG-CB 3.31Å; C183-C190 CovalentContact SG-SG 2.05Å; C183-C190 PolarHBondContact SG-SG 2.77Å; G188-C190 PolarHBondContact O-N 2.8Å; C190-A192 VanDerWaalsContact C-N 3.25Å; C190-A192 PolarHBondContact O-N 3.4Å
191	L	48.7	Very low	57.6	Low	170 Å²	170	103.4 Å²	103.4	89%	0.89	67%	0.666	S	S	*	*			trans	-59.6	99.6	163.9	-71.3	167.8	0	0	0	105.8	G193	L191-G193 PolarHBondContact O-N 3.24Å
192	A	48.1	Very low	56.8	Low	94 Å²	94	103 Å²	103	78%	0.777	68%	0.68	S	S	*	*			trans	-54.9	112.6	164.6	0	0	0	0	0	104.9	C190	C190-A192 VanDerWaalsContact C-N 3.25Å; C190-A192 PolarHBondContact O-N 3.4Å
193	G	53.4	Low	55.6	Low	55 Å²	55	102.9 Å²	102.9	57%	0.567	69%	0.694	S	S	*	*			trans	-50.3	148.3	170.5	0	0	0	0	0	108.3	L191	L191-G193 PolarHBondContact O-N 3.24Å
194	P	42.8	Very low	55.6	Low	118 Å²	118	108.3 Å²	108.3	77%	0.766	72%	0.72	S	S	*	*			trans	-47.7	140.4	177.4	21.4	-32.4	0	0	0	109	G196	P194-G196 PolarHBondContact O-N 2.86Å; P194-G196 VanDerWaalsContact O-N 3.16Å
195	P	50.4	Low	54.8	Low	124 Å²	124	106 Å²	106	81%	0.805	72%	0.724	S	S	*	*			trans	-44.6	129.5	177	-27.4	33.2	0	0	0	109.2
196	G	50.3	Low	53.6	Low	60 Å²	60	110.2 Å²	110.2	62%	0.619	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-50.2	144.1	175.5	0	0	0	0	0	109.1	P194	P194-G196 PolarHBondContact O-N 2.86Å; P194-G196 VanDerWaalsContact O-N 3.16Å
197	P	51.9	Low	53.5	Low	118 Å²	118	112.4 Å²	112.4	77%	0.766	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-51.3	144.7	177.3	22.3	-32.4	0	0	0	109.2	G199	P197-G199 PolarHBondContact O-N 2.96Å
198	P	61.8	Low	53.2	Low	126 Å²	126	105.9 Å²	105.9	82%	0.818	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-46.4	133.1	175.2	-26.4	33.4	0	0	0	109.4	L200	P198-L200 PolarHBondContact O-N 3.35Å
199	G	50.1	Low	52.7	Low	71 Å²	71	111.8 Å²	111.8	73%	0.732	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-50.1	136.2	175.2	0	0	0	0	0	109	P197	P197-G199 PolarHBondContact O-N 2.96Å
200	L	48.4	Very low	52.7	Low	162 Å²	162	113.6 Å²	113.6	85%	0.848	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-49.9	138.8	174.2	-69.7	168	0	0	0	108.4	P198 G202	P198-L200 PolarHBondContact O-N 3.35Å; L200-G202 PolarHBondContact O-N 3.22Å
201	P	66.9	Low	52.5	Low	119 Å²	119	114 Å²	114	77%	0.773	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-46.8	134.1	171.3	-25.9	33.7	0	0	0	109	A203	P201-A203 PolarHBondContact O-N 2.85Å
202	G	55	Low	52.2	Low	70 Å²	70	112.4 Å²	112.4	72%	0.722	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-51	130.6	175.8	0	0	0	0	0	108.6	L200 D204	L200-G202 PolarHBondContact O-N 3.22Å; G202-D204 PolarHBondContact O-N 2.7Å
203	A	49.8	Very low	52.6	Low	93 Å²	93	115.5 Å²	115.5	77%	0.769	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-52.7	136.9	176.6	0	0	0	0	0	108.9	P201 G205	P201-A203 PolarHBondContact O-N 2.85Å; A203-G205 PolarHBondContact O-N 2.98Å
204	D	65.4	Low	52.4	Low	155 Å²	155	116.2 Å²	116.2	83%	0.829	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-49.4	135.2	173.8	-68.6	-35.1	0	0	0	108.9	G202 F206	G202-D204 PolarHBondContact O-N 2.7Å; D204-F206 PolarHBondContact O-N 3.39Å
205	G	48	Very low	52.5	Low	71 Å²	71	118.4 Å²	118.4	73%	0.732	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-53.4	128.7	177.1	0	0	0	0	0	109.4	A203	A203-G205 PolarHBondContact O-N 2.98Å
206	F	47.3	Very low	52.9	Low	190 Å²	190	118.2 Å²	118.2	83%	0.833	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-50.9	134.6	175.7	-71.3	-79.5	0	0	0	109.4	D204 G208	D204-F206 PolarHBondContact O-N 3.39Å; F206-G208 PolarHBondContact O-N 2.75Å
207	P	67	Low	52.9	Low	115 Å²	115	118.6 Å²	118.6	75%	0.747	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-50.3	132.8	168.5	-24	32.7	0	0	0	109	H209	P207-H209 PolarHBondContact O-N 2.91Å
208	G	51.6	Low	52.6	Low	69 Å²	69	121.7 Å²	121.7	71%	0.711	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-50.1	133.2	178.2	0	0	0	0	0	110.2	F206 N210	F206-G208 PolarHBondContact O-N 2.75Å; G208-N210 PolarHBondContact O-N 3.46Å; G208-N210 VanDerWaalsContact O-N 3.09Å
209	H	43.8	Very low	51.8	Low	185 Å²	185	123.6 Å²	123.6	86%	0.856	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-55.9	119	178	-62	-66.7	0	0	0	109.2	P207 G211	P207-H209 PolarHBondContact O-N 2.91Å; H209-G211 PolarHBondContact O-N 2.8Å
210	N	54.8	Low	51.6	Low	159 Å²	159	123.8 Å²	123.8	85%	0.85	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-57.2	130.7	163.3	-81.3	-17.5	0	0	0	107.5	G208 T212	G208-N210 PolarHBondContact O-N 3.46Å; G208-N210 VanDerWaalsContact O-N 3.09Å; N210-T212 PolarHBondContact O-N 2.83Å
211	G	47.8	Very low	51.4	Low	69 Å²	69	124.5 Å²	124.5	71%	0.711	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-51.6	130.6	176.2	0	0	0	0	0	109.8	H209 D213	H209-G211 PolarHBondContact O-N 2.8Å; G211-D213 PolarHBondContact O-N 2.85Å
212	T	42	Very low	50.6	Low	138 Å²	138	125 Å²	125	85%	0.847	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-62.5	121.2	173.7	47.6	0	0	0	0	109	N210 G214	N210-T212 PolarHBondContact O-N 2.83Å; T212-G214 PolarHBondContact O-N 2.85Å
213	D	56.7	Low	50	Low	158 Å²	158	125.4 Å²	125.4	85%	0.845	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-56.7	136.8	165.8	-69.4	-37.2	0	0	0	109.4	G211	G211-D213 PolarHBondContact O-N 2.85Å
214	G	48.5	Very low	49.9	Very low	70 Å²	70	125.9 Å²	125.9	72%	0.722	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-61.6	139.5	179.4	0	0	0	0	0	111.9	T212 P216	T212-G214 PolarHBondContact O-N 2.85Å; G214-P216 WeakPolarHBondContact O-CD 3.48Å
215	I	45.2	Very low	49.1	Very low	165 Å²	165	126.4 Å²	126.4	85%	0.846	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-57.6	123.1	177.4	-53.6	166.8	0	0	0	109.2	G217	I215-G217 PolarHBondContact O-N 2.94Å
216	P	57.9	Low	48.9	Very low	119 Å²	119	126.5 Å²	126.5	77%	0.773	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-63.2	133.3	172.8	-21.1	32.7	0	0	0	111.1	G214	G214-P216 WeakPolarHBondContact O-CD 3.48Å
217	G	51.7	Low	49.3	Very low	68 Å²	68	127.9 Å²	127.9	70%	0.701	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-65.2	145.7	177.5	0	0	0	0	0	113	I215	I215-G217 PolarHBondContact O-N 2.94Å
218	L	44.1	Very low	48.5	Very low	184 Å²	184	134.1 Å²	134.1	96%	0.963	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-62.2	134.3	175.2	-79.3	146.7	0	0	0	111.8
219	N	46.1	Very low	48.7	Very low	166 Å²	166	134.3 Å²	134.3	89%	0.888	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-66.6	135	179	-72.7	-16.6	0	0	0	112.4
220	G	46.3	Very low	49.1	Very low	75 Å²	75	135.9 Å²	135.9	77%	0.773	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-86.1	154.4	167.4	0	0	0	0	0	113.1
221	L	42.8	Very low	49.1	Very low	176 Å²	176	138.4 Å²	138.4	92%	0.921	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-65.2	153.6	-177.8	-72.3	161.1	0	0	0	113.6
222	P	50.1	Low	49.5	Very low	131 Å²	131	137.6 Å²	137.6	85%	0.851	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-81.7	141.7	-166.7	-6.1	24.4	0	0	0	114
223	G	44.3	Very low	50	Low	78 Å²	78	137 Å²	137	80%	0.804	83%	0.83	S	S	*	*			trans	-121.5	141	160.8	0	0	0	0	0	110.7
224	A	46.5	Very low	50.2	Low	103 Å²	103	135.7 Å²	135.7	85%	0.851	83%	0.83	S	S	*	*			trans	-83.2	134.5	-166.4	0	0	0	0	0	115.6
225	D	49	Very low	50.6	Low	165 Å²	165	136 Å²	136	88%	0.882	83%	0.834	S	S	*	*			trans	37.9	123.9	154.2	-67.8	-11.6	0	0	0	124.8
226	G	42.7	Very low	50.7	Low	74 Å²	74	137.6 Å²	137.6	76%	0.763	84%	0.838	S	S	*	*			trans	-159.1	111.3	141.6	0	0	0	0	0	110.7	R228	G226-R228 PolarHBondContact O-N 2.94Å
227	K	56.4	Low	50.6	Low	219 Å²	219	141.6 Å²	141.6	95%	0.952	84%	0.843	S	S	*	*			trans	-63.1	124.2	-177.7	-71	-179.3	179	175.7	0	111.7
228	R	51.4	Low	50.8	Low	246 Å²	246	141.5 Å²	141.5	93%	0.928	84%	0.842	S	S	*	*			trans	-138.9	120.6	167.7	-154.1	173.9	-155	-179.4	5.7	112.3	G226	G226-R228 PolarHBondContact O-N 2.94Å
229	G	55.8	Low	51	Low	73 Å²	73	141.4 Å²	141.4	75%	0.753	84%	0.837	S	S	*	*			trans	49.2	126.1	154.5	0	0	0	0	0	120.5	K231	G229-K231 PolarHBondContact O-N 2.91Å
230	K	51.2	Low	51.7	Low	218 Å²	218	139.5 Å²	139.5	95%	0.948	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-57.2	126.6	165	-68.5	-178.7	178.2	-179.7	0	109.9
231	K	55.3	Low	52.1	Low	212 Å²	212	139.5 Å²	139.5	92%	0.922	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-68.8	134.4	173.6	-168.6	176.8	-179.7	-179.2	0	109.4	G229	G229-K231 PolarHBondContact O-N 2.91Å
232	G	56.3	Low	52.5	Low	52 Å²	52	140.5 Å²	140.5	54%	0.536	83%	0.833	S	S	.	*	P	Polyproline II helix	trans	-65.2	162.1	175	0	0	0	0	0	112.5
233	P	52.7	Low	52.8	Low	126 Å²	126	143.3 Å²	143.3	82%	0.818	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-62.8	153.6	-179.8	26.8	-33	0	0	0	111.8
234	P	60.5	Low	53.3	Low	130 Å²	130	142.8 Å²	142.8	84%	0.844	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-58.8	141.5	175.2	-20	31.9	0	0	0	111.6
235	G	55.8	Low	53.5	Low	77 Å²	77	147.3 Å²	147.3	79%	0.794	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-66.9	152.1	174.8	0	0	0	0	0	112.4
236	E	48	Very low	53.9	Low	198 Å²	198	148.3 Å²	148.3	93%	0.925	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-63.7	145.9	179.9	-67.1	-177	148	0	0	112.1	G238	E236-G238 PolarHBondContact O-N 3.23Å
237	K	56.9	Low	54.5	Low	202 Å²	202	147.9 Å²	147.9	88%	0.878	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-62.6	126.2	176.6	-175.3	-179.9	-178.3	-177.4	0	108.8
238	G	53.9	Low	54.5	Low	66 Å²	66	146.3 Å²	146.3	68%	0.68	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-60	140.8	175.1	0	0	0	0	0	111.9	E236	E236-G238 PolarHBondContact O-N 3.23Å
239	E	49.2	Very low	55	Low	183 Å²	183	140.6 Å²	140.6	86%	0.855	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-66	147.6	178.8	-65.2	-176	146.3	0	0	111.5
240	P	60.5	Low	55	Low	125 Å²	125	140.1 Å²	140.1	81%	0.812	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-58.3	137.8	170.5	-19.4	31.9	0	0	0	110.7
241	G	55.8	Low	55.3	Low	76 Å²	76	135.6 Å²	135.6	78%	0.784	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-59.8	143.7	178.3	0	0	0	0	0	112.5
242	E	51.2	Low	55.1	Low	197 Å²	197	131.6 Å²	131.6	92%	0.921	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-59.7	137.5	-178	-66.2	-175.9	150.5	0	0	112	G244	E242-G244 PolarHBondContact O-N 3.23Å
243	Q	55.7	Low	54.5	Low	190 Å²	190	132.9 Å²	132.9	89%	0.888	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-63.2	126.8	173.3	179.8	176.1	-15.3	0	0	109.1
244	G	55	Low	54.1	Low	66 Å²	66	135.2 Å²	135.2	68%	0.68	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-56.9	138.8	179.6	0	0	0	0	0	112.3	E242	E242-G244 PolarHBondContact O-N 3.23Å
245	E	50.7	Low	53.2	Low	198 Å²	198	133 Å²	133	93%	0.925	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-58.2	134.5	-177.9	-65.8	-175.8	138.7	0	0	111.7	G247	E245-G247 PolarHBondContact O-N 3.08Å
246	Q	56.9	Low	52.2	Low	187 Å²	187	139.8 Å²	139.8	87%	0.874	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-66.2	126	174	-179.2	175.8	-2.4	0	0	109.2
247	G	54.8	Low	51.8	Low	65 Å²	65	139.5 Å²	139.5	67%	0.67	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-57.2	139	178.1	0	0	0	0	0	112.4	E245	E245-G247 PolarHBondContact O-N 3.08Å
248	E	56.6	Low	51.7	Low	186 Å²	186	135.4 Å²	135.4	87%	0.869	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-57.7	136.8	-177.6	-64.7	-173.3	143.5	0	0	112	G250	E248-G250 PolarHBondContact O-N 3.12Å
249	P	62.8	Low	50.9	Low	125 Å²	125	137.5 Å²	137.5	81%	0.812	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-60.6	133.7	170.8	-21.3	32.5	0	0	0	111.2
250	G	55.9	Low	50.7	Low	63 Å²	63	135.7 Å²	135.7	65%	0.649	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-60.5	150.3	175.3	0	0	0	0	0	112.5	E248	E248-G250 PolarHBondContact O-N 3.12Å
251	P	56.3	Low	49.7	Very low	124 Å²	124	136.6 Å²	136.6	81%	0.805	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-64	148.8	-174.9	24.9	-33.1	0	0	0	112.5
252	P	50.9	Low	49.5	Very low	127 Å²	127	139.2 Å²	139.2	83%	0.825	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-62.1	134.1	178.4	-19.9	31.6	0	0	0	112.2
253	G	44.9	Very low	48.9	Very low	79 Å²	79	137.7 Å²	137.7	81%	0.814	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-71.5	129.7	174.9	0	0	0	0	0	112.3
254	E	44.3	Very low	48.7	Very low	175 Å²	175	134.3 Å²	134.3	82%	0.818	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-73.3	136.4	171.5	-69	-177.4	163.9	0	0	110.8
255	A	41.2	Very low	48.6	Very low	85 Å²	85	140.2 Å²	140.2	70%	0.702	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-90.5	122.8	-177.5	0	0	0	0	0	111.4
256	Y	33.9	Very low	48.9	Very low	219 Å²	219	133.8 Å²	133.8	86%	0.859	79%	0.788	S	S	*	*			trans	-146.3	156.8	154.7	-61.1	-72.3	0	0	0	111.8
257	E	39.7	Very low	48.8	Very low	192 Å²	192	130.7 Å²	130.7	90%	0.897	79%	0.785	S	S	*	*			trans	-66.6	173.5	-158.3	-94.6	-163.6	162.8	0	0	119.2
258	P	55.6	Low	49.5	Very low	115 Å²	115	133.7 Å²	133.7	75%	0.747	79%	0.792	S	S	*	*			trans	-98.3	138.2	-150.1	37.1	-31.5	0	0	0	114.1
259	S	37.1	Very low	49.7	Very low	111 Å²	111	128 Å²	128	78%	0.776	78%	0.783	S	S	*	*			trans	-167.1	129.4	148.6	58.5	0	0	0	0	112.2
260	N	44	Very low	49.3	Very low	145 Å²	145	128 Å²	128	78%	0.775	78%	0.783	S	S	*	*			trans	21.9	108.6	148.5	-60.5	-15.4	0	0	0	118.1
261	D	41.2	Very low	50.1	Low	143 Å²	143	131 Å²	131	77%	0.765	79%	0.791	S	S	*	*				159.4	133.9	110.5	-81.4	-30.2	0	0	0	110.7
262	V	50.6	Low	50.3	Low	131 Å²	131	128 Å²	128	79%	0.794	78%	0.783	S	S	*	*			trans	22.7	111	154.4	-172.2	0	0	0	0	117.3
263	I	38.6	Very low	50.6	Low	166 Å²	166	127.9 Å²	127.9	85%	0.851	78%	0.782	S	S	*	*			trans	-134.3	125.3	159.2	-57.9	-178.9	0	0	0	111.1
264	V	51.4	Low	51.9	Low	119 Å²	119	130.1 Å²	130.1	72%	0.721	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-70.9	134.3	178.6	170.8	0	0	0	0	110.3	G266	V264-G266 PolarHBondContact O-N 3.14Å
265	E	52.7	Low	52.7	Low	190 Å²	190	124.8 Å²	124.8	89%	0.888	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-59.2	124.9	166.8	-81.4	-175.3	151	0	0	109.9
266	G	57.8	Low	53.5	Low	62 Å²	62	126.6 Å²	126.6	64%	0.639	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-66.5	145.3	174	0	0	0	0	0	111.3	V264	V264-G266 PolarHBondContact O-N 3.14Å
267	P	53.8	Low	55.3	Low	123 Å²	123	122.2 Å²	122.2	80%	0.799	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-63.2	145.5	-176.9	25.2	-33.1	0	0	0	111.6
268	P	69.5	Low	56.2	Low	127 Å²	127	116.1 Å²	116.1	83%	0.825	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-53.1	141.4	173.5	-24.6	32.9	0	0	0	112
269	G	61.3	Low	56.4	Low	66 Å²	66	117 Å²	117	68%	0.68	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-58.1	148	179	0	0	0	0	0	112.4
270	P	54.9	Low	57.6	Low	125 Å²	125	120.4 Å²	120.4	81%	0.812	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-61.7	143.3	-176.7	24.6	-32.9	0	0	0	111.4
271	P	72.4	Confident	58.1	Low	127 Å²	127	116.1 Å²	116.1	83%	0.825	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-54.4	140.7	172.9	-24.1	33.2	0	0	0	111.5
272	G	61	Low	58.9	Low	62 Å²	62	115.2 Å²	115.2	64%	0.639	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-58.1	149.7	177.8	0	0	0	0	0	112.2
273	P	57.1	Low	59.6	Low	123 Å²	123	115 Å²	115	80%	0.799	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-60.5	143.7	-177.3	24.3	-32.9	0	0	0	111.4	G275	P273-G275 PolarHBondContact O-N 3.49Å
274	P	72.9	Confident	60.3	Low	127 Å²	127	110.3 Å²	110.3	83%	0.825	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-55.4	139.5	174.4	-23.9	33.1	0	0	0	111.5
275	G	59.1	Low	60.2	Low	63 Å²	63	111 Å²	111	65%	0.649	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-58.7	150.9	176.2	0	0	0	0	0	112	P273	P273-G275 PolarHBondContact O-N 3.49Å
276	P	59.8	Low	60.3	Low	122 Å²	122	111.3 Å²	111.3	79%	0.792	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-60.6	144.3	-177.2	24.3	-32.9	0	0	0	111.5	G278	P276-G278 PolarHBondContact O-N 3.37Å
277	P	70.9	Confident	59.5	Low	128 Å²	128	111.5 Å²	111.5	83%	0.831	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-56.8	137.9	175.4	-23.1	32.8	0	0	0	111.5
278	G	58.8	Low	59.5	Low	64 Å²	64	111.6 Å²	111.6	66%	0.66	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-59.8	151.4	176.1	0	0	0	0	0	112.1	P276	P276-G278 PolarHBondContact O-N 3.37Å
279	P	60.7	Low	58.2	Low	133 Å²	133	111.6 Å²	111.6	86%	0.864	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-61.5	141.7	-178.6	24.8	-32.9	0	0	0	111.7	G281	P279-G281 PolarHBondContact O-N 3.4Å
280	M	61.1	Low	57	Low	182 Å²	182	120.3 Å²	120.3	90%	0.897	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-61	132	178.6	-170.6	170	68.3	0	0	110.5
281	G	55.6	Low	56.3	Low	55 Å²	55	121.2 Å²	121.2	57%	0.567	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-60.3	151.4	178.4	0	0	0	0	0	112.4	P279	P279-G281 PolarHBondContact O-N 3.4Å
282	P	57.4	Low	54.5	Low	124 Å²	124	125.9 Å²	125.9	81%	0.805	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-63.1	147.6	-179.1	25.1	-32.8	0	0	0	111.7
283	P	65.1	Low	53.3	Low	128 Å²	128	130.5 Å²	130.5	83%	0.831	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-58.4	138.7	177.9	-23.1	33	0	0	0	112.4
284	G	52.4	Low	52.1	Low	67 Å²	67	132.5 Å²	132.5	69%	0.691	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-62.6	150.7	176.8	0	0	0	0	0	112.7
285	P	50.8	Low	50.1	Low	133 Å²	133	138.2 Å²	138.2	86%	0.864	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-65.1	142.8	-178	25.4	-32.7	0	0	0	112.4
286	Q	53.8	Low	48.7	Very low	197 Å²	197	139.1 Å²	139.1	92%	0.921	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-68.9	130.1	-178.3	-138.4	170	43.1	0	0	110.9
287	G	41.5	Very low	47.3	Very low	66 Å²	66	141.5 Å²	141.5	68%	0.68	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-70.6	147.2	179.5	0	0	0	0	0	113
288	P	54.4	Low	45.5	Very low	124 Å²	124	141.6 Å²	141.6	81%	0.805	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-72.6	155.7	-179.5	26.4	-31.6	0	0	0	113.6
289	P	41.8	Very low	44.1	Very low	128 Å²	128	146.3 Å²	146.3	83%	0.831	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-74.5	148.6	-168.6	-11.7	27.9	0	0	0	114.3
290	R	35.3	Very low	42.6	Very low	249 Å²	249	147.1 Å²	147.1	94%	0.94	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-74.6	135.4	171.3	-80.6	-177.4	178.2	-179.9	-0.1	112.2
291	T	41.1	Very low	41.1	Very low	143 Å²	143	142.1 Å²	142.1	88%	0.877	79%	0.789	S	S	*	*			trans	-129.9	141.6	149.4	50.4	0	0	0	0	111
292	R	34.8	Very low	39.8	Very low	225 Å²	225	148 Å²	148	85%	0.849	80%	0.801	S	S	*	*			trans	-79.9	149.9	-168.8	-66.1	169.5	169.4	173.2	-3.8	112.1
293	H	35.3	Very low	38.3	Very low	160 Å²	160	146.8 Å²	146.8	74%	0.741	79%	0.792	S	S	*	*				175.5	121.7	111.1	-92.7	-77.4	0	0	0	113.5
294	H	32.6	Very low	36.5	Very low	165 Å²	165	149 Å²	149	76%	0.764	80%	0.796	S	S	*	*			trans	63.9	118.1	142.6	-70.5	42.9	0	0	0	119.3
295	R	29.1	Very low	35.3	Very low	246 Å²	246	148.9 Å²	148.9	93%	0.928	80%	0.795	S	S	*	*				54.7	122.8	53.6	-157.5	177.6	-173.5	150.1	2	111.3
296	A	29.9	Very low	34.1	Very low	82 Å²	82	150.1 Å²	150.1	68%	0.678	79%	0.793	S	S	*	*			cis	-143.7	179.4	20.5	0	0	0	0	0	108.1
297	H	31.7	Very low	32.8	Very low	172 Å²	172	146.8 Å²	146.8	80%	0.796	78%	0.781	S	S	*	*			cis	-173.7	146.9	47	-150.7	-76	0	0	0	109.7
298	L	31.6	Very low	32.1	Very low	131 Å²	131	151.9 Å²	151.9	69%	0.686	79%	0.787	S	S	*	*			trans	-103.3	143	169.8	-144.3	90.4	0	0	0	108.6
299	Q	31	Very low	30.8	Very low	163 Å²	163	150.9 Å²	150.9	76%	0.762	79%	0.789	S	S	*	*			trans	55.2	125.8	153.4	-72.3	168.4	-8.4	0	0	121.6
300	T	27.3	Very low	30.4	Very low	149 Å²	149	150.8 Å²	150.8	91%	0.914	79%	0.786	S	S	*	*			trans	-159.5	149.1	130.6	12.6	0	0	0	0	111.5
301	A	30.2	Very low	30.6	Very low	77 Å²	77	144.4 Å²	144.4	64%	0.636	78%	0.777	S	S	*	*			trans	-99.4	178.3	-172.7	0	0	0	0	0	113.7
302	H	28.6	Very low	30	Very low	178 Å²	178	144 Å²	144	82%	0.824	77%	0.769	S	S	*	*			trans	77.3	149	164.7	-63.4	-78.1	0	0	0	116.9
303	T	25.6	Very low	29.7	Very low	99 Å²	99	140.8 Å²	140.8	61%	0.607	77%	0.769	S	S	*	*			cis	176.1	148.9	-8.7	-87.2	0	0	0	0	105.8
304	L	28	Very low	29.4	Very low	175 Å²	175	140 Å²	140	92%	0.916	77%	0.766	S	S	*	*			trans	63.6	146.1	167.9	-98.8	77.3	0	0	0	116.9
305	G	26.1	Very low	29.4	Very low	65 Å²	65	139.1 Å²	139.1	67%	0.67	77%	0.772	S	S	*	*			cis	159.7	132.8	5.8	0	0	0	0	0	108.6
306	L	26.9	Very low	29.5	Very low	159 Å²	159	133.8 Å²	133.8	83%	0.832	76%	0.761	S	S	*	*			trans	53	118.6	146.8	-123.1	83.2	0	0	0	121.7
307	L	27.1	Very low	29.6	Very low	127 Å²	127	137.1 Å²	137.1	67%	0.665	77%	0.773	S	S	*	*				154.7	125.2	110.1	-82.5	164.9	0	0	0	114
308	H	26.5	Very low	29.6	Very low	173 Å²	173	133.6 Å²	133.6	80%	0.801	76%	0.763	S	S	*	*			trans	60	122.1	134.1	-68.9	-167.5	0	0	0	122.4
309	A	27.3	Very low	29.5	Very low	103 Å²	103	136 Å²	136	85%	0.851	77%	0.768	S	S	*	*				126.6	117	115.2	0	0	0	0	0	115.5
310	V	31.7	Very low	29.4	Very low	125 Å²	125	136.7 Å²	136.7	76%	0.758	77%	0.772	S	S	*	*			trans	-86.7	151	165.5	-172.6	0	0	0	0	106.9
311	P	40.7	Very low	29.6	Very low	116 Å²	116	134.7 Å²	134.7	75%	0.753	77%	0.77	S	S	*	*				-150.6	174.6	80.4	36.9	-15.3	0	0	0	113.1
312	N	28.7	Very low	29.6	Very low	134 Å²	134	136.6 Å²	136.6	72%	0.717	77%	0.773	S	S	*	*			cis	-171.4	146.1	-15.7	-107.3	-1.3	0	0	0	102.4
313	D	27.3	Very low	29.8	Very low	157 Å²	157	136.8 Å²	136.8	84%	0.84	77%	0.772	S	S	*	*			trans	-159.7	148	131.2	-148	-7	0	0	0	111
314	E	29.4	Very low	29.9	Very low	145 Å²	145	140 Å²	140	68%	0.678	79%	0.785	S	S	*	*			trans	-83.9	147.9	-156.7	-61.3	174.4	152.5	0	0	112.4
315	T	32.9	Very low	30.2	Very low	145 Å²	145	137.9 Å²	137.9	89%	0.89	77%	0.769	S	S	*	*				-163.9	137.5	106.7	20.5	0	0	0	0	111.7
316	L	30.8	Very low	30.8	Very low	135 Å²	135	144 Å²	144	71%	0.707	78%	0.781	S	S	*	*			trans	-72.9	142.7	-169.9	-70	89.3	0	0	0	114	V318	L316-V318 HydrophobicContact CD2-CG2 4.15Å
317	T	32.8	Very low	30.9	Very low	151 Å²	151	144.2 Å²	144.2	93%	0.926	78%	0.775	S	S	*	*				-140.3	149.2	117.4	31.4	0	0	0	0	110.6
318	V	31	Very low	31.3	Very low	98 Å²	98	142 Å²	142	59%	0.594	77%	0.768	S	S	*	*			trans	-93.1	129.2	-149.9	159	0	0	0	0	112.6	L316	L316-V318 HydrophobicContact CD2-CG2 4.15Å
319	K	30.2	Very low	32.2	Very low	183 Å²	183	139.4 Å²	139.4	80%	0.796	76%	0.764	S	S	*	*			trans	50.2	126.2	137.8	-50.1	173.4	-166.3	174.2	0	117.4
320	Q	28.9	Very low	33.1	Very low	177 Å²	177	141 Å²	141	83%	0.827	75%	0.752	S	S	*	*				-152.6	123.4	56.5	-80.9	167.7	-52.8	0	0	111.9	V322	Q320-V322 PolarHBondContact O-N 2.91Å
321	A	30.2	Very low	33.7	Very low	106 Å²	106	140.5 Å²	140.5	88%	0.876	75%	0.745	S	S	*	*			trans	-80.1	104.7	153.2	0	0	0	0	0	107.9
322	V	31.1	Very low	34.7	Very low	117 Å²	117	140.9 Å²	140.9	71%	0.709	74%	0.737	S	S	*	*			trans	-93.3	106.1	150.8	178.8	0	0	0	0	105.6	Q320 L324	Q320-V322 PolarHBondContact O-N 2.91Å; V322-L324 VanDerWaalsContact C-N 3.32Å; V322-L324 PolarHBondContact O-N 3.05Å
323	K	31.6	Very low	37.2	Very low	183 Å²	183	136.3 Å²	136.3	80%	0.796	72%	0.715	S	S	*	*			trans	-21.7	87.6	153.3	-161.2	178	-165.9	177.4	0	111.6	H325	K323-H325 VanDerWaalsContact C-N 3.32Å; K323-H325 PolarHBondContact O-N 3.07Å; K323-H325 VanDerWaalsContact O-N 3.07Å
324	L	29.6	Very low	40.2	Very low	167 Å²	167	130.4 Å²	130.4	87%	0.874	68%	0.683	S	S	*	*			trans	-74.6	102.1	160.7	-149.4	81.4	0	0	0	103.9	V322 E326	V322-L324 VanDerWaalsContact C-N 3.32Å; V322-L324 PolarHBondContact O-N 3.05Å; L324-E326 PolarHBondContact O-N 2.77Å
325	H	32.9	Very low	43.3	Very low	129 Å²	129	123.5 Å²	123.5	60%	0.597	65%	0.651	S	S	*	*			trans	-33	126.3	150.4	-99	29.9	0	0	0	107.7	K323 K327	K323-H325 VanDerWaalsContact C-N 3.32Å; K323-H325 PolarHBondContact O-N 3.07Å; K323-H325 VanDerWaalsContact O-N 3.07Å; H325-K327 HydrophobicContact CB-CG 3.76Å; H325-K327 PolarHBondContact O-N 2.85Å
326	E	40	Very low	46	Very low	195 Å²	195	120.9 Å²	120.9	91%	0.911	63%	0.627	S	S	*	*			trans	-56.9	82.9	141.8	-78.7	-178.3	154.3	0	0	105.5	L324	L324-E326 PolarHBondContact O-N 2.77Å
327	K	28.4	Very low	48.9	Very low	162 Å²	162	116.4 Å²	116.4	70%	0.704	61%	0.607	S	S	*	*			trans	-64.7	127.5	163.2	-76	-174.3	179.1	176.7	0	103.3	H325 V329	H325-K327 HydrophobicContact CB-CG 3.76Å; H325-K327 PolarHBondContact O-N 2.85Å; K327-V329 PolarHBondContact O-N 3.34Å
328	P	35.4	Very low	51.7	Low	82 Å²	82	110.4 Å²	110.4	53%	0.532	57%	0.569	S	S	.	*			trans	-59	123.1	169.1	23.8	-24.3	0	0	0	105.4	K330	P328-K330 HydrophobicContact CB-CD 4.16Å; P328-K330 HydrophobicContact CB-CG 4.03Å; P328-K330 HydrophobicContact CG-CD 3.77Å; P328-K330 HydrophobicContact CG-CG 4.13Å; P328-K330 WeakPolarHBondContact O-CB 3.45Å; P328-K330 PolarHBondContact O-N 3.05Å
329	V	44.9	Very low	54.5	Low	118 Å²	118	108.6 Å²	108.6	72%	0.715	56%	0.555	S	S	*	*			trans	-58.1	91.3	176.5	-179.7	0	0	0	0	106.5	K327 E332	K327-V329 PolarHBondContact O-N 3.34Å; V329-E332 HydrophobicContact CG1-CB 4.2Å; V329-E332 HydrophobicContact CG1-CG 4.43Å
330	K	46.2	Very low	57	Low	137 Å²	137	105.5 Å²	105.5	60%	0.596	55%	0.548	S	S	*	.			trans	-120.9	103.6	-170.3	-87.6	-177.3	-177	172.2	0	105.8	P328	P328-K330 HydrophobicContact CB-CD 4.16Å; P328-K330 HydrophobicContact CB-CG 4.03Å; P328-K330 HydrophobicContact CG-CD 3.77Å; P328-K330 HydrophobicContact CG-CG 4.13Å; P328-K330 WeakPolarHBondContact O-CB 3.45Å; P328-K330 PolarHBondContact O-N 3.05Å
331	N	45.9	Very low	59.9	Low	114 Å²	114	100.9 Å²	100.9	61%	0.61	53%	0.533	S	S	*	.	S	Bend	trans	108.7	4.3	168.4	-53.3	-13	0	0	0	117.1	C333	N331-C333 PolarHBondContact O-N 3.23Å
332	E	60.7	Low	62.9	Low	123 Å²	123	102.2 Å²	102.2	58%	0.575	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	8.5	-174.7	-69.3	178.1	-169.7	0	0	115.6	V329 S576	V329-E332 HydrophobicContact CG1-CB 4.2Å; V329-E332 HydrophobicContact CG1-CG 4.43Å; E332-S576 WeakPolarHBondContact O-CB 3.32Å; E332-S576 PolarHBondContact O-OG 2.92Å
333	C	80.6	Confident	65.8	Low	38 Å²	38	100.9 Å²	100.9	26%	0.257	50%	0.504	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.9	33.9	179.4	-158.7	0	0	0	0	114.1	N331 C509 Y574	N331-C333 PolarHBondContact O-N 3.23Å; C333-C509 HydrophobicContact CB-CB 3.36Å; C333-C509 WeakPolarHBondContact CB-SG 3.29Å; C333-C509 WeakPolarHBondContact SG-CB 3.42Å; C333-C509 CovalentContact SG-SG 2Å; C333-C509 PolarHBondContact SG-SG 2.71Å; C333-Y574 HydrophobicContact CB-CD1 4.35Å; C333-Y574 HydrophobicContact CB-CE1 4.46Å; C333-Y574 VanDerWaalsContact SG-CD1 3.53Å; C333-Y574 WeakPolarHBondContact SG-CE1 3.4Å
334	L	91.4	Very high	68.8	Low	33 Å²	33	92.8 Å²	92.8	17%	0.173	47%	0.469	C	S	.	.			trans	-85.3	131.6	168.1	-67	178.4	0	0	0	110.1	K336 V511 V534 M536 Y574 I575	L334-K336 PolarHBondContact O-N 3.18Å; L334-V511 HydrophobicContact CD2-CG1 4.44Å; L334-V511 HydrophobicContact CD2-CG2 3.91Å; L334-V534 HydrophobicContact CD1-CG1 4.07Å; L334-V534 HydrophobicContact CD2-CG1 4.18Å; L334-M536 HydrophobicContact CB-CE 4.46Å; L334-M536 HydrophobicContact CD2-SD 4.05Å; L334-Y574 CarbonylContact O-C 3.55Å; L334-Y574 WeakPolarHBondContact O-CA 3.25Å; L334-I575 HydrophobicContact CB-CD1 3.84Å; L334-I575 HydrophobicContact CB-CG1 4.39Å; L334-I575 WeakPolarHBondContact O-CG1 3.4Å; L334-I575 PolarHBondContact O-N 2.93Å
335	I	93.2	Very high	71.9	Confident	1 Å²	1	85.9 Å²	85.9	1%	0.005	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	126.6	177.8	-59	178.3	0	0	0	110.2	L338 F506 A508 Y513 M536 F538 V572 Y574	I335-L338 HydrophobicContact CG2-CD2 4.37Å; I335-F506 HydrophobicContact CD1-CE2 3.62Å; I335-F506 HydrophobicContact CD1-CZ 4.04Å; I335-A508 HydrophobicContact CD1-CB 4.04Å; I335-Y513 HydrophobicContact CB-CE1 4.32Å; I335-Y513 HydrophobicContact CD1-CD2 4.27Å; I335-Y513 HydrophobicContact CD1-CE1 4.46Å; I335-Y513 HydrophobicContact CD1-CE2 3.84Å; I335-Y513 HydrophobicContact CG1-CE1 4.48Å; I335-Y513 HydrophobicContact CG1-CE2 4.23Å; I335-Y513 PolarHBondContact N-OH 2.98Å; I335-M536 WeakPolarHBondContact O-CE 3.37Å; I335-F538 HydrophobicContact CB-CE1 4Å; I335-F538 HydrophobicContact CB-CZ 4.15Å; I335-F538 HydrophobicContact CG2-CD1 4.39Å; I335-F538 HydrophobicContact CG2-CE1 3.84Å; I335-F538 HydrophobicContact CG2-CE2 4.15Å; I335-F538 HydrophobicContact CG2-CZ 3.69Å; I335-V572 HydrophobicContact CB-CG1 4.2Å; I335-V572 HydrophobicContact CD1-CG1 3.58Å; I335-V572 HydrophobicContact CG1-CG1 3.49Å; I335-V572 VanDerWaalsContact CG1-CG1 3.49Å; I335-V572 HydrophobicContact CG2-CG1 3.83Å; I335-Y574 HydrophobicContact CG1-CD1 4.14Å; I335-Y574 HydrophobicContact CG1-CE1 3.74Å
336	K	90.8	Very high	74.8	Confident	90 Å²	90	86.6 Å²	86.6	39%	0.391	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	-48.8	174.4	-173.2	175.3	-179.1	174.4	0	111.4	L334 F538 H573 I575 E578	L334-K336 PolarHBondContact O-N 3.18Å; K336-F538 VanDerWaalsContact O-CB 3.32Å; K336-F538 WeakPolarHBondContact O-CB 3.37Å; K336-H573 PolarHBondContact N-O 2.75Å; K336-I575 HydrophobicContact CB-CG1 3.83Å; K336-I575 HydrophobicContact CG-CG1 4.38Å; K336-E578 IonicContact NZ-OE1 2.89Å; K336-E578 PolarHBondContact NZ-OE1 3.31Å; K336-E578 IonicContact NZ-OE2 2.92Å; K336-E578 PolarHBondContact NZ-OE2 3.38Å
337	S	91.9	Very high	77.4	Confident	40 Å²	40	78.2 Å²	78.2	28%	0.28	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.3	168.1	-175.3	59.7	0	0	0	0	111.2	H573	S337-H573 PolarHBondContact N-O 3.11Å; S337-H573 PolarHBondContact O-N 3.16Å
338	L	91.9	Very high	80.4	Confident	25 Å²	25	79.5 Å²	79.5	13%	0.131	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	131.5	171.9	-59.4	177.9	0	0	0	108.6	I335 F538 L540 L559 Y570 V571 V572	I335-L338 HydrophobicContact CG2-CD2 4.37Å; L338-F538 HydrophobicContact CD1-CE2 4.04Å; L338-F538 HydrophobicContact CD2-CE2 4.46Å; L338-F538 HydrophobicContact CG-CD2 4.3Å; L338-F538 HydrophobicContact CG-CE2 3.94Å; L338-L540 HydrophobicContact CD1-CD1 3.22Å; L338-L540 HydrophobicContact CD1-CG 4.44Å; L338-L559 HydrophobicContact CD1-CD2 3.67Å; L338-L559 HydrophobicContact CD2-CD2 4.27Å; L338-Y570 HydrophobicContact CB-CD1 4.01Å; L338-Y570 HydrophobicContact CB-CG 4.49Å; L338-Y570 HydrophobicContact CD1-CD1 4.45Å; L338-V571 WeakPolarHBondContact CA-O 3.42Å; L338-V572 HydrophobicContact CD2-CB 4.44Å; L338-V572 HydrophobicContact CD2-CG2 3.92Å
339	I	88.2	Confident	83.2	Confident	60 Å²	60	76.6 Å²	76.6	31%	0.308	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	163.9	-176.2	66.4	-179.6	0	0	0	111.1	V571 H573	I339-V571 HydrophobicContact CD1-CG1 4.32Å; I339-V571 HydrophobicContact CG1-CB 3.78Å; I339-V571 HydrophobicContact CG1-CG1 4.06Å; I339-V571 PolarHBondContact N-O 3.39Å; I339-V571 PolarHBondContact O-N 3.49Å; I339-H573 HydrophobicContact CD1-CB 4.39Å
340	N	84	Confident	85.6	Confident	118 Å²	118	74.1 Å²	74.1	63%	0.631	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	51.6	58.9	173.1	-62	-21.5	0	0	0	114.9	R342 V571	N340-R342 PolarHBondContact O-N 2.87Å; N340-R342 VanDerWaalsContact O-N 3.09Å; N340-V571 HydrophobicContact CB-CG2 4.21Å
341	P	88.6	Confident	88.1	Confident	81 Å²	81	69 Å²	69	53%	0.526	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	115.2	176.1	26.4	-33.6	0	0	0	110.9	L569 Y570	P341-L569 CarbonylContact C-O 3.51Å; P341-L569 WeakPolarHBondContact CA-O 3.46Å; P341-Y570 HydrophobicContact CB-CD1 3.94Å; P341-Y570 HydrophobicContact CB-CE1 3.61Å
342	R	93	Very high	90.5	Very high	134 Å²	134	63.6 Å²	63.6	51%	0.506	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	123.7	178.1	-166.6	179.6	91.1	-173.6	5.3	110.6	N340 R568 L569	N340-R342 PolarHBondContact O-N 2.87Å; N340-R342 VanDerWaalsContact O-N 3.09Å; R342-R568 CarbonylContact O-C 3.51Å; R342-R568 VanDerWaalsContact O-CA 3.24Å; R342-R568 WeakPolarHBondContact O-CA 3.43Å; R342-L569 PolarHBondContact N-O 3.47Å; R342-L569 PolarHBondContact O-N 3.07Å
343	I	93.1	Very high	92.2	Very high	89 Å²	89	57.7 Å²	57.7	46%	0.456	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	125.1	168.3	-59.5	174.4	0	0	0	107.7	Y566 R568	I343-Y566 HydrophobicContact CG2-CD1 3.9Å; I343-R568 HydrophobicContact CG1-CG 4.26Å
344	V	94.3	Very high	93	Very high	12 Å²	12	55.9 Å²	55.9	7%	0.073	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	-47.5	-178.9	178.9	0	0	0	0	111	W354 M383 F386 V567 L569	V344-W354 HydrophobicContact CB-CH2 4.38Å; V344-W354 HydrophobicContact CG1-CZ3 4.36Å; V344-W354 HydrophobicContact CG2-CH2 3.85Å; V344-W354 HydrophobicContact CG2-CZ2 4.44Å; V344-W354 HydrophobicContact CG2-CZ3 4.48Å; V344-M383 HydrophobicContact CG1-CE 4.41Å; V344-M383 HydrophobicContact CG1-SD 3.44Å; V344-M383 WeakPolarHBondContact CG1-SD 3.28Å; V344-F386 HydrophobicContact CG1-CD1 4.09Å; V344-F386 HydrophobicContact CG1-CE1 3.91Å; V344-V567 HydrophobicContact CB-CG2 4.11Å; V344-V567 PolarHBondContact N-O 3.03Å; V344-L569 HydrophobicContact CG2-CD1 3.82Å; V344-L569 HydrophobicContact CG2-CG 3.96Å
345	A	93.9	Very high	93.2	Very high	22 Å²	22	54.7 Å²	54.7	18%	0.182	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	163.4	-179.7	0	0	0	0	0	111.2	M347 F386 V567	A345-M347 HydrophobicContact CB-SD 4.38Å; A345-F386 HydrophobicContact CB-CE1 3.78Å; A345-F386 HydrophobicContact CB-CZ 4.1Å; A345-V567 HydrophobicContact CB-CG2 3.69Å; A345-V567 WeakPolarHBondContact O-CG2 3.3Å; A345-V567 PolarHBondContact O-N 3.44Å
346	K	94.6	Very high	93.3	Very high	144 Å²	144	56.2 Å²	56.2	63%	0.626	28%	0.284	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.7	129.9	167.3	-173.2	-177.1	178.7	-176.2	0	108.6	S565 Y566	K346-S565 CarbonylContact C-O 3.6Å; K346-S565 WeakPolarHBondContact CA-O 3.42Å; K346-Y566 HydrophobicContact CB-CD1 4.13Å; K346-Y566 HydrophobicContact CB-CE1 3.97Å; K346-Y566 HydrophobicContact CD-CE1 4.06Å; K346-Y566 HydrophobicContact CG-CD1 4.24Å; K346-Y566 HydrophobicContact CG-CE1 3.89Å
347	M	94.5	Very high	93.5	Very high	19 Å²	19	52.1 Å²	52.1	9%	0.094	27%	0.266	C	S	.	.			trans	-101.3	158.9	-179.1	-51.8	-55	-63.5	0	0	110	A345 V368 F386 W562 S565 V567	A345-M347 HydrophobicContact CB-SD 4.38Å; M347-V368 HydrophobicContact CE-CG1 4.11Å; M347-F386 HydrophobicContact CE-CE2 4.17Å; M347-F386 HydrophobicContact CE-CZ 4.32Å; M347-F386 HydrophobicContact SD-CE2 4.18Å; M347-F386 HydrophobicContact SD-CZ 3.78Å; M347-W562 HydrophobicContact CB-CH2 3.67Å; M347-W562 HydrophobicContact CB-CZ2 3.38Å; M347-W562 HydrophobicContact CE-CH2 3.78Å; M347-W562 HydrophobicContact CE-CZ3 4.28Å; M347-W562 HydrophobicContact CG-CH2 3.43Å; M347-W562 VanDerWaalsContact CG-CH2 3.43Å; M347-W562 HydrophobicContact CG-CZ2 3.52Å; M347-W562 HydrophobicContact CG-CZ3 3.97Å; M347-W562 HydrophobicContact SD-CH2 4.35Å; M347-S565 PolarHBondContact N-O 3.33Å; M347-S565 WeakPolarHBondContact O-CB 3.36Å; M347-V567 HydrophobicContact CG-CG1 3.82Å; M347-V567 HydrophobicContact CG-CG2 4.38Å; M347-V567 HydrophobicContact SD-CG1 4.34Å; M347-V567 HydrophobicContact SD-CG2 4.24Å
348	E	92.1	Very high	93.6	Very high	189 Å²	189	50.5 Å²	50.5	88%	0.883	25%	0.254	S	S	*	.	S	Bend	trans	-76	-36.7	176.1	-64	-176	169.9	0	0	111.6
349	S	94.3	Very high	93.6	Very high	22 Å²	22	50.3 Å²	50.3	15%	0.154	26%	0.256	C	S	.	.			trans	-84.5	142.1	-179.5	-178.5	0	0	0	0	112.8	F351 W562	S349-F351 VanDerWaalsContact C-N 3.28Å; S349-F351 VanDerWaalsContact CB-O 3.26Å; S349-F351 WeakPolarHBondContact CB-O 3.5Å; S349-F351 PolarHBondContact OG-N 2.89Å; S349-F351 VanDerWaalsContact OG-N 3.11Å; S349-F351 PolarHBondContact OG-O 2.99Å; S349-W562 WeakPolarHBondContact O-CZ2 3.47Å; S349-W562 PolarHBondContact O-NE1 3.44Å
350	T	95.5	Very high	93.4	Very high	66 Å²	66	51.8 Å²	51.8	41%	0.405	26%	0.262	S	S	.	.	S	Bend	trans	-74.6	-19.8	170	-44.4	0	0	0	0	112.9	V546 Q564	T350-V546 HydrophobicContact CG2-CB 4.3Å; T350-Q564 CarbonylContact C-O 3.58Å; T350-Q564 VanDerWaalsContact CA-O 3.23Å; T350-Q564 WeakPolarHBondContact CA-O 3.19Å
351	F	96.7	Very high	93	Very high	29 Å²	29	51.2 Å²	51.2	13%	0.127	26%	0.258	C	S	.	.	S	Bend	trans	-119.5	144.3	177.7	-69.2	-95.3	0	0	0	109.7	S349 H371 F372 N451 V546 A548	S349-F351 VanDerWaalsContact C-N 3.28Å; S349-F351 VanDerWaalsContact CB-O 3.26Å; S349-F351 WeakPolarHBondContact CB-O 3.5Å; S349-F351 PolarHBondContact OG-N 2.89Å; S349-F351 VanDerWaalsContact OG-N 3.11Å; S349-F351 PolarHBondContact OG-O 2.99Å; F351-H371 VanDerWaalsContact O-CA 3.22Å; F351-H371 WeakPolarHBondContact O-CA 3.45Å; F351-H371 PolarHBondContact O-N 3.07Å; F351-F372 HydrophobicContact CB-CB 4.27Å; F351-F372 HydrophobicContact CB-CD1 4.19Å; F351-F372 HydrophobicContact CD1-CB 4.35Å; F351-F372 HydrophobicContact CD1-CD1 4.36Å; F351-F372 HydrophobicContact CD2-CD1 4.07Å; F351-F372 HydrophobicContact CG-CB 4.43Å; F351-F372 AromaticContact CG-CD1 3.95Å; F351-F372 HydrophobicContact CG-CD1 3.95Å; F351-N451 WeakPolarHBondContact CE1-O 3.47Å; F351-V546 HydrophobicContact CD1-CG1 4.26Å; F351-V546 HydrophobicContact CE1-CG1 3.59Å; F351-V546 HydrophobicContact CE2-CG1 4.3Å; F351-V546 HydrophobicContact CZ-CG1 3.6Å; F351-V546 HydrophobicContact CZ-CG2 4.44Å; F351-A548 HydrophobicContact CB-CB 4.42Å; F351-A548 HydrophobicContact CD1-CB 4.03Å; F351-A548 HydrophobicContact CG-CB 4.49Å
352	G	97.1	Very high	92.8	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	167.9	177	173.8	0	0	0	0	0	111.1	A369 W562	G352-A369 CarbonylContact C-O 3.52Å; G352-A369 WeakPolarHBondContact CA-O 3.38Å; G352-W562 VanDerWaalsContact C-CE3 3.46Å
353	T	97.6	Very high	92.6	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	143.7	173.5	57.3	0	0	0	0	109	V368 A369 C403 H405 M549	T353-V368 VanDerWaalsContact O-CA 3.29Å; T353-V368 WeakPolarHBondContact O-CA 3.35Å; T353-A369 PolarHBondContact N-O 3.19Å; T353-A369 PolarHBondContact O-N 3.14Å; T353-A369 WeakPolarHBondContact OG1-CB 3.35Å; T353-C403 VanDerWaalsContact CG2-CA 3.43Å; T353-C403 HydrophobicContact CG2-CB 3.67Å; T353-C403 WeakPolarHBondContact CG2-O 3.35Å; T353-H405 PolarHBondContact OG1-CD2 3.25Å; T353-M549 WeakPolarHBondContact CA-SD 3.17Å; T353-M549 VanDerWaalsContact CB-SD 3.55Å; T353-M549 HydrophobicContact CG2-CB 4.25Å; T353-M549 HydrophobicContact CG2-CG 3.9Å; T353-M549 HydrophobicContact CG2-SD 3.87Å
354	W	97.3	Very high	92.5	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	129.2	173	77.9	-65.6	0	0	0	107.8	V344 I366 W367 V368 M383 F386 M549 Y560 V561 W562 V567 R568 L569	V344-W354 HydrophobicContact CB-CH2 4.38Å; V344-W354 HydrophobicContact CG1-CZ3 4.36Å; V344-W354 HydrophobicContact CG2-CH2 3.85Å; V344-W354 HydrophobicContact CG2-CZ2 4.44Å; V344-W354 HydrophobicContact CG2-CZ3 4.48Å; W354-I366 HydrophobicContact CE3-CG2 4.19Å; W354-W367 CarbonylContact C-O 3.58Å; W354-W367 VanDerWaalsContact CA-O 3.31Å; W354-W367 WeakPolarHBondContact CA-O 3.47Å; W354-V368 HydrophobicContact CB-CG2 4.08Å; W354-M383 HydrophobicContact CZ3-CE 4.36Å; W354-F386 HydrophobicContact CE3-CE1 4.44Å; W354-M549 VanDerWaalsContact CD1-CE 3.42Å; W354-M549 HydrophobicContact CG-CE 4.38Å; W354-M549 PolarHBondContact N-SD 3.34Å; W354-M549 VanDerWaalsContact N-SD 3.35Å; W354-M549 VanDerWaalsContact O-CE 3.27Å; W354-M549 WeakPolarHBondContact O-CE 3.48Å; W354-Y560 HydrophobicContact CD2-CD1 4.02Å; W354-Y560 AromaticContact CE2-CD1 3.65Å; W354-Y560 HydrophobicContact CE3-CD1 4.16Å; W354-Y560 HydrophobicContact CE3-CE1 4.42Å; W354-Y560 AromaticContact CH2-CD1 3.6Å; W354-Y560 HydrophobicContact CH2-CD1 3.6Å; W354-Y560 AromaticContact CH2-CE1 3.73Å; W354-Y560 HydrophobicContact CH2-CE1 3.73Å; W354-Y560 AromaticContact CZ2-CD1 3.44Å; W354-Y560 HydrophobicContact CZ2-CD1 3.44Å; W354-Y560 VanDerWaalsContact CZ2-CD1 3.44Å; W354-Y560 HydrophobicContact CZ2-CE1 4.07Å; W354-Y560 HydrophobicContact CZ2-CG 4.15Å; W354-Y560 AromaticContact CZ3-CD1 3.98Å; W354-Y560 HydrophobicContact CZ3-CD1 3.98Å; W354-Y560 AromaticContact CZ3-CE1 3.94Å; W354-Y560 HydrophobicContact CZ3-CE1 3.94Å; W354-V561 PolarHBondContact NE1-O 2.89Å; W354-W562 HydrophobicContact CB-CE3 4.22Å; W354-W562 HydrophobicContact CB-CZ3 4.26Å; W354-V567 HydrophobicContact CB-CG1 4.09Å; W354-V567 VanDerWaalsContact CD1-CG1 3.48Å; W354-V567 HydrophobicContact CD2-CB 3.91Å; W354-V567 HydrophobicContact CD2-CG1 4.07Å; W354-V567 HydrophobicContact CG-CB 4Å; W354-V567 HydrophobicContact CG-CG1 3.61Å; W354-V567 HydrophobicContact CZ2-CB 4.37Å; W354-R568 WeakPolarHBondContact CZ2-O 3.44Å; W354-L569 HydrophobicContact CH2-CD1 3.97Å; W354-L569 HydrophobicContact CH2-CD2 3.52Å; W354-L569 HydrophobicContact CH2-CG 3.55Å; W354-L569 HydrophobicContact CZ2-CD2 3.61Å; W354-L569 HydrophobicContact CZ2-CG 3.78Å
355	M	95.8	Very high	92.5	Very high	8 Å²	8	52.7 Å²	52.7	4%	0.039	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	140.5	-161.5	-61.3	163.7	-73.7	0	0	109.5	I366 W367 H405 V407 L412	M355-I366 WeakPolarHBondContact O-CA 3.44Å; M355-W367 HydrophobicContact CE-CB 4.23Å; M355-W367 PolarHBondContact N-O 3.11Å; M355-W367 PolarHBondContact O-N 3.45Å; M355-H405 HydrophobicContact CE-CB 4.29Å; M355-H405 VanDerWaalsContact SD-C 3.56Å; M355-H405 HydrophobicContact SD-CB 3.73Å; M355-V407 HydrophobicContact CB-CB 4.41Å; M355-V407 HydrophobicContact CB-CG2 4.02Å; M355-V407 HydrophobicContact CE-CG2 4.33Å; M355-V407 HydrophobicContact SD-CG2 4.11Å; M355-L412 HydrophobicContact CE-CD1 3.9Å; M355-L412 HydrophobicContact SD-CD1 4.07Å
356	K	95	Very high	92.6	Very high	33 Å²	33	51.7 Å²	51.7	14%	0.143	26%	0.256	C	S	.	.			trans	-104.3	164.9	157.9	-69.5	-164.3	74.1	178.3	0	109	T358 D363 E364 I366 Y560	K356-T358 PolarHBondContact O-N 2.96Å; K356-D363 WeakPolarHBondContact CE-O 3.35Å; K356-D363 PolarHBondContact NZ-O 3.08Å; K356-E364 IonicContact NZ-OE1 3.89Å; K356-E364 IonicContact NZ-OE2 3.74Å; K356-E364 PolarHBondContact NZ-OE2 3.06Å; K356-I366 HydrophobicContact CG-CG1 4.15Å; K356-Y560 HydrophobicContact CB-CE1 4.38Å; K356-Y560 HydrophobicContact CD-CE1 4.4Å; K356-Y560 WeakPolarHBondContact CD-OH 3.34Å; K356-Y560 HydrophobicContact CG-CE1 3.97Å
357	D	95	Very high	92.8	Very high	3 Å²	3	44.8 Å²	44.8	2%	0.016	23%	0.226	C	C	.	.	B	Isolated β-bridge	trans	-68.6	121.4	174.1	-164.6	-40.3	0	0	0	110.1	A359 H360 W367 V407 N409 G410	D357-A359 PolarHBondContact O-N 2.87Å; D357-A359 WeakPolarHBondContact OD1-CB 3.32Å; D357-A359 PolarHBondContact OD1-N 3.18Å; D357-H360 IonicContact OD1-CD2 3.68Å; D357-H360 IonicContact OD2-CD2 3.19Å; D357-W367 HydrophobicContact CB-CH2 4.36Å; D357-W367 HydrophobicContact CB-CZ3 4.08Å; D357-V407 HydrophobicContact CB-CG1 4.16Å; D357-N409 PolarHBondContact OD1-N 2.96Å; D357-N409 WeakPolarHBondContact OD2-CA 3.43Å; D357-N409 PolarHBondContact OD2-N 3.08Å; D357-G410 PolarHBondContact OD2-N 3.37Å
358	T	93.9	Very high	93	Very high	7 Å²	7	44 Å²	44	4%	0.043	22%	0.222	C	C	.	.	S	Bend	trans	-77.5	-5.1	-179.7	51.2	0	0	0	0	113.7	K356 T406 V407 H408 A460 K555	K356-T358 PolarHBondContact O-N 2.96Å; T358-T406 HydrophobicContact CG2-CG2 4.12Å; T358-V407 PolarHBondContact N-O 2.95Å; T358-V407 PolarHBondContact OG1-O 3.47Å; T358-H408 VanDerWaalsContact OG1-CB 3.31Å; T358-H408 WeakPolarHBondContact OG1-CB 3.3Å; T358-H408 PolarHBondContact OG1-ND1 3.28Å; T358-A460 HydrophobicContact CG2-CB 4.37Å; T358-A460 WeakPolarHBondContact OG1-CB 3.42Å; T358-K555 VanDerWaalsContact O-CE 3.24Å; T358-K555 WeakPolarHBondContact O-CE 3.45Å; T358-K555 WeakPolarHBondContact O-CG 3.46Å
359	A	90.8	Very high	93.2	Very high	21 Å²	21	35 Å²	35	17%	0.174	18%	0.18	C	C	.	.	S	Bend	trans	-102.7	-36	178.8	0	0	0	0	0	113.6	D357 N409 K555	D357-A359 PolarHBondContact O-N 2.87Å; D357-A359 WeakPolarHBondContact OD1-CB 3.32Å; D357-A359 PolarHBondContact OD1-N 3.18Å; A359-N409 HydrophobicContact CB-CB 3.84Å; A359-K555 WeakPolarHBondContact O-CE 3.34Å; A359-K555 PolarHBondContact O-NZ 3.3Å
360	H	85.2	Confident	93.3	Very high	90 Å²	90	36.1 Å²	36.1	42%	0.417	18%	0.183	S	C	.	.			trans	-111.2	119.5	-170.9	-63.6	-67.5	0	0	0	111.6	D357 D363 N409	D357-H360 IonicContact OD1-CD2 3.68Å; D357-H360 IonicContact OD2-CD2 3.19Å; H360-D363 HydrophobicContact CB-CB 3.99Å; H360-N409 PolarHBondContact NE2-OD1 2.91Å
361	L	75.6	Confident	93.3	Very high	106 Å²	106	36.1 Å²	36.1	56%	0.555	18%	0.178	S	C	*	.	S	Bend	trans	-74.7	-36.3	179.2	-87.6	150.7	0	0	0	112.8	D363 K555	L361-D363 PolarHBondContact O-N 3.48Å; L361-K555 HydrophobicContact CD1-CD 4.03Å; L361-K555 HydrophobicContact CD2-CB 3.91Å; L361-K555 HydrophobicContact CG-CB 4.04Å; L361-K555 HydrophobicContact CG-CD 3.76Å; L361-K555 HydrophobicContact CG-CG 4.39Å
362	D	83.6	Confident	93.2	Very high	164 Å²	164	35.2 Å²	35.2	88%	0.877	17%	0.174	S	C	*	.	S	Bend	trans	-80.2	-2.9	-175.8	-55	-38.9	0	0	0	112.8	E364	D362-E364 PolarHBondContact O-N 2.76Å
363	D	88	Confident	93.2	Very high	24 Å²	24	36.4 Å²	36.4	13%	0.128	18%	0.183	C	C	.	.			trans	-85	103	176.9	-160.1	-16.6	0	0	0	110.1	K356 H360 L361 R365	K356-D363 WeakPolarHBondContact CE-O 3.35Å; K356-D363 PolarHBondContact NZ-O 3.08Å; H360-D363 HydrophobicContact CB-CB 3.99Å; L361-D363 PolarHBondContact O-N 3.48Å; D363-R365 PolarHBondContact O-N 3.13Å; D363-R365 WeakPolarHBondContact OD1-CB 3.43Å; D363-R365 WeakPolarHBondContact OD1-CG 3.45Å; D363-R365 IonicContact OD1-CZ 3.52Å; D363-R365 PolarHBondContact OD1-N 3.01Å; D363-R365 IonicContact OD1-NE 3.52Å; D363-R365 PolarHBondContact OD1-NE 3.49Å; D363-R365 IonicContact OD1-NH2 3.53Å; D363-R365 IonicContact OD2-CZ 2.72Å; D363-R365 IonicContact OD2-NE 3.98Å; D363-R365 PolarHBondContact OD2-NE 2.87Å; D363-R365 IonicContact OD2-NH2 2.92Å; D363-R365 PolarHBondContact OD2-NH2 2.91Å
364	E	91.5	Very high	93.1	Very high	96 Å²	96	37 Å²	37	45%	0.449	19%	0.189	S	C	.	.			trans	-80.7	-0.4	177.4	-71.9	-56.6	149.1	0	0	113.8	K356 D362 S382	K356-E364 IonicContact NZ-OE1 3.89Å; K356-E364 IonicContact NZ-OE2 3.74Å; K356-E364 PolarHBondContact NZ-OE2 3.06Å; D362-E364 PolarHBondContact O-N 2.76Å; E364-S382 WeakPolarHBondContact O-CA 3.21Å
365	R	95.3	Very high	93.1	Very high	63 Å²	63	41.6 Å²	41.6	24%	0.238	21%	0.206	C	C	.	.			trans	-68.3	147.6	-178.9	-65.1	179.2	-68	167.9	0.2	112.1	D363 W367 E379 Y380	D363-R365 PolarHBondContact O-N 3.13Å; D363-R365 WeakPolarHBondContact OD1-CB 3.43Å; D363-R365 WeakPolarHBondContact OD1-CG 3.45Å; D363-R365 IonicContact OD1-CZ 3.52Å; D363-R365 PolarHBondContact OD1-N 3.01Å; D363-R365 IonicContact OD1-NE 3.52Å; D363-R365 PolarHBondContact OD1-NE 3.49Å; D363-R365 IonicContact OD1-NH2 3.53Å; D363-R365 IonicContact OD2-CZ 2.72Å; D363-R365 IonicContact OD2-NE 3.98Å; D363-R365 PolarHBondContact OD2-NE 2.87Å; D363-R365 IonicContact OD2-NH2 2.92Å; D363-R365 PolarHBondContact OD2-NH2 2.91Å; R365-W367 HydrophobicContact CB-CE3 4.49Å; R365-W367 HydrophobicContact CB-CH2 3.55Å; R365-W367 HydrophobicContact CB-CZ2 3.8Å; R365-W367 HydrophobicContact CB-CZ3 3.91Å; R365-E379 VanDerWaalsContact CD-OE1 3.26Å; R365-E379 WeakPolarHBondContact CD-OE1 3.45Å; R365-E379 IonicContact NH1-OE1 2.69Å; R365-E379 PolarHBondContact NH1-OE1 2.77Å; R365-E379 VanDerWaalsContact NH1-OE1 3.16Å; R365-Y380 CarbonylContact C-O 3.45Å; R365-Y380 WeakPolarHBondContact CA-O 3.42Å
366	I	96.3	Very high	93.2	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.005	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	130	177.1	-59.3	165.5	0	0	0	107.3	W354 M355 K356 V368 Y380 M383 F386	W354-I366 HydrophobicContact CE3-CG2 4.19Å; M355-I366 WeakPolarHBondContact O-CA 3.44Å; K356-I366 HydrophobicContact CG-CG1 4.15Å; I366-V368 HydrophobicContact CG2-CG2 4.17Å; I366-Y380 PolarHBondContact N-O 2.7Å; I366-Y380 PolarHBondContact O-N 3.06Å; I366-M383 HydrophobicContact CD1-CB 4.35Å; I366-M383 HydrophobicContact CD1-CE 3.73Å; I366-M383 HydrophobicContact CD1-SD 3.79Å; I366-F386 HydrophobicContact CD1-CB 3.82Å; I366-F386 HydrophobicContact CD1-CD1 4.21Å; I366-F386 HydrophobicContact CD1-CG 4.11Å
367	W	97.7	Very high	93.3	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	135.6	174.3	-65.3	-88.2	0	0	0	110.2	W354 M355 D357 R365 V377 K378 E379 V407 F427	W354-W367 CarbonylContact C-O 3.58Å; W354-W367 VanDerWaalsContact CA-O 3.31Å; W354-W367 WeakPolarHBondContact CA-O 3.47Å; M355-W367 HydrophobicContact CE-CB 4.23Å; M355-W367 PolarHBondContact N-O 3.11Å; M355-W367 PolarHBondContact O-N 3.45Å; D357-W367 HydrophobicContact CB-CH2 4.36Å; D357-W367 HydrophobicContact CB-CZ3 4.08Å; R365-W367 HydrophobicContact CB-CE3 4.49Å; R365-W367 HydrophobicContact CB-CH2 3.55Å; R365-W367 HydrophobicContact CB-CZ2 3.8Å; R365-W367 HydrophobicContact CB-CZ3 3.91Å; W367-V377 HydrophobicContact CB-CG1 3.97Å; W367-V377 HydrophobicContact CG-CG1 4.47Å; W367-K378 CarbonylContact C-O 3.46Å; W367-K378 VanDerWaalsContact CA-O 3.29Å; W367-K378 WeakPolarHBondContact CA-O 3.42Å; W367-E379 PolarHBondContact NE1-OE2 2.9Å; W367-V407 HydrophobicContact CB-CG2 4.08Å; W367-V407 HydrophobicContact CD2-CG1 4.3Å; W367-V407 HydrophobicContact CD2-CG2 4.04Å; W367-V407 HydrophobicContact CE3-CB 4.14Å; W367-V407 HydrophobicContact CE3-CG1 3.88Å; W367-V407 HydrophobicContact CE3-CG2 3.96Å; W367-V407 HydrophobicContact CG-CG2 4.12Å; W367-V407 HydrophobicContact CH2-CG1 4.21Å; W367-V407 HydrophobicContact CZ3-CB 4.49Å; W367-V407 HydrophobicContact CZ3-CG1 3.85Å; W367-F427 AromaticContact CD1-CE1 3.65Å; W367-F427 AromaticContact CD1-CE2 3.9Å; W367-F427 AromaticContact CD1-CZ 3.36Å; W367-F427 HydrophobicContact CD2-CE2 4.24Å; W367-F427 HydrophobicContact CD2-CZ 4.38Å; W367-F427 AromaticContact CE2-CE2 3.86Å; W367-F427 HydrophobicContact CG-CE2 4.23Å; W367-F427 AromaticContact CG-CZ 3.9Å; W367-F427 HydrophobicContact CG-CZ 3.9Å; W367-F427 HydrophobicContact CZ2-CD2 4.32Å; W367-F427 HydrophobicContact CZ2-CE2 4.41Å; W367-F427 AromaticContact NE1-CD1 3.97Å; W367-F427 AromaticContact NE1-CD2 3.95Å; W367-F427 AromaticContact NE1-CE1 3.69Å; W367-F427 AromaticContact NE1-CE2 3.66Å; W367-F427 AromaticContact NE1-CZ 3.51Å
368	V	98.1	Very high	93.4	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.006	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	121.5	-179.7	179.9	0	0	0	0	109.7	M347 T353 W354 I366 E370 V377 K378 Y380 F386 W562	M347-V368 HydrophobicContact CE-CG1 4.11Å; T353-V368 VanDerWaalsContact O-CA 3.29Å; T353-V368 WeakPolarHBondContact O-CA 3.35Å; W354-V368 HydrophobicContact CB-CG2 4.08Å; I366-V368 HydrophobicContact CG2-CG2 4.17Å; V368-E370 HydrophobicContact CG1-CG 3.77Å; V368-V377 CarbonylContact O-C 3.56Å; V368-V377 WeakPolarHBondContact O-CA 3.36Å; V368-K378 HydrophobicContact CB-CB 4.35Å; V368-K378 PolarHBondContact N-O 2.84Å; V368-K378 PolarHBondContact O-N 3.17Å; V368-Y380 HydrophobicContact CB-CE2 4.01Å; V368-Y380 HydrophobicContact CG2-CD2 4.06Å; V368-Y380 HydrophobicContact CG2-CE2 3.64Å; V368-F386 HydrophobicContact CG2-CD2 4.32Å; V368-F386 HydrophobicContact CG2-CE2 3.75Å; V368-F386 HydrophobicContact CG2-CZ 4.46Å; V368-W562 HydrophobicContact CG1-CH2 4.21Å; V368-W562 HydrophobicContact CG1-CZ3 3.96Å
369	A	97.8	Very high	93.6	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.008	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	109	167.6	0	0	0	0	0	107.5	G352 T353 V377 Y400	G352-A369 CarbonylContact C-O 3.52Å; G352-A369 WeakPolarHBondContact CA-O 3.38Å; T353-A369 PolarHBondContact N-O 3.19Å; T353-A369 PolarHBondContact O-N 3.14Å; T353-A369 WeakPolarHBondContact OG1-CB 3.35Å; A369-V377 HydrophobicContact CB-CG2 4.11Å; A369-Y400 HydrophobicContact CB-CE1 4.01Å; A369-Y400 HydrophobicContact CB-CE2 4.1Å
370	E	95.2	Very high	93.9	Very high	46 Å²	46	46.9 Å²	46.9	22%	0.215	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	151.3	-179.4	-63.6	-174.3	126.2	0	0	110.4	V368 K378 Y400 W562	V368-E370 HydrophobicContact CG1-CG 3.77Å; E370-K378 IonicContact OE1-NZ 3.11Å; E370-K378 WeakPolarHBondContact OE2-CE 3.36Å; E370-K378 IonicContact OE2-NZ 3.86Å; E370-K378 PolarHBondContact OE2-NZ 3.36Å; E370-Y400 PolarHBondContact O-OH 2.97Å; E370-W562 HydrophobicContact CG-CH2 4.39Å
371	H	96	Very high	94.4	Very high	66 Å²	66	47.4 Å²	47.4	31%	0.306	23%	0.23	S	C	.	.	S	Bend	trans	67.1	174.4	-177.3	-156.1	-104.1	0	0	0	113.6	F351 S373	F351-H371 VanDerWaalsContact O-CA 3.22Å; F351-H371 WeakPolarHBondContact O-CA 3.45Å; F351-H371 PolarHBondContact O-N 3.07Å; H371-S373 VanDerWaalsContact C-N 3.3Å
372	F	94.5	Very high	95.3	Very high	10 Å²	10	44.2 Å²	44.2	4%	0.044	22%	0.216	C	C	.	.	S	Bend	trans	-89.3	4	176.2	59.7	-97.3	0	0	0	112.6	Y171 F351 Q401 G402 K453	Y171-F372 HydrophobicContact CD1-CE2 4.14Å; Y171-F372 HydrophobicContact CD1-CZ 4.03Å; Y171-F372 HydrophobicContact CE1-CE1 4.1Å; Y171-F372 AromaticContact CE1-CE2 3.69Å; Y171-F372 HydrophobicContact CE1-CE2 3.69Å; Y171-F372 AromaticContact CE1-CZ 3.21Å; Y171-F372 HydrophobicContact CE1-CZ 3.21Å; Y171-F372 AromaticContact CZ-CZ 3.66Å; F351-F372 HydrophobicContact CB-CB 4.27Å; F351-F372 HydrophobicContact CB-CD1 4.19Å; F351-F372 HydrophobicContact CD1-CB 4.35Å; F351-F372 HydrophobicContact CD1-CD1 4.36Å; F351-F372 HydrophobicContact CD2-CD1 4.07Å; F351-F372 HydrophobicContact CG-CB 4.43Å; F351-F372 AromaticContact CG-CD1 3.95Å; F351-F372 HydrophobicContact CG-CD1 3.95Å; F372-Q401 CarbonylContact O-C 3.53Å; F372-Q401 WeakPolarHBondContact O-CA 3.42Å; F372-G402 PolarHBondContact O-N 2.74Å; F372-K453 HydrophobicContact CB-CB 4.35Å; F372-K453 HydrophobicContact CB-CD 4.25Å; F372-K453 HydrophobicContact CD1-CD 3.68Å; F372-K453 HydrophobicContact CD2-CD 3.83Å; F372-K453 HydrophobicContact CE1-CD 3.97Å; F372-K453 HydrophobicContact CE2-CD 4.12Å; F372-K453 HydrophobicContact CG-CB 4.49Å; F372-K453 HydrophobicContact CG-CD 3.62Å; F372-K453 HydrophobicContact CZ-CD 4.19Å
373	S	96.3	Very high	95.7	Very high	25 Å²	25	38.3 Å²	38.3	18%	0.175	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	141.3	171.4	-174	0	0	0	0	109.9	H371 Y400	H371-S373 VanDerWaalsContact C-N 3.3Å; S373-Y400 VanDerWaalsContact CA-O 3.25Å; S373-Y400 WeakPolarHBondContact CA-O 3.31Å; S373-Y400 PolarHBondContact OG-O 3.28Å
374	G	96.2	Very high	96	Very high	13 Å²	13	39.7 Å²	39.7	13%	0.134	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	178.4	-177.3	-179.6	0	0	0	0	0	111.2	F399 Y400	G374-F399 CarbonylContact O-C 3.52Å; G374-F399 VanDerWaalsContact O-CA 3.22Å; G374-F399 WeakPolarHBondContact O-CA 3.36Å; G374-Y400 VanDerWaalsContact C-CD1 3.47Å; G374-Y400 VanDerWaalsContact CA-CZ 3.42Å; G374-Y400 VanDerWaalsContact N-CE2 3.25Å; G374-Y400 PolarHBondContact N-O 2.94Å; G374-Y400 WeakPolarHBondContact O-CD1 3.44Å; G374-Y400 WeakPolarHBondContact O-CE1 3.13Å; G374-Y400 PolarHBondContact O-N 2.8Å
375	R	96.7	Very high	96.1	Very high	95 Å²	95	35.8 Å²	35.8	36%	0.358	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	-10.3	177.8	176.8	171.7	172.1	-176.7	-5.5	112.5	D395 V396 R397 F399	R375-D395 WeakPolarHBondContact CG-OD1 3.39Å; R375-D395 IonicContact CZ-OD1 2.69Å; R375-D395 IonicContact CZ-OD2 3.35Å; R375-D395 VanDerWaalsContact CZ-OD2 3.31Å; R375-D395 VanDerWaalsContact NE-CG 3.35Å; R375-D395 IonicContact NE-OD1 2.85Å; R375-D395 PolarHBondContact NE-OD1 3.23Å; R375-D395 IonicContact NE-OD2 3.84Å; R375-D395 PolarHBondContact NE-OD2 3.45Å; R375-D395 IonicContact NH2-OD1 2.7Å; R375-D395 PolarHBondContact NH2-OD1 2.93Å; R375-D395 IonicContact NH2-OD2 2.85Å; R375-D395 PolarHBondContact NH2-OD2 2.99Å; R375-V396 VanDerWaalsContact O-CG2 3.25Å; R375-V396 WeakPolarHBondContact O-CG2 3.24Å; R375-V396 PolarHBondContact O-N 2.97Å; R375-R397 PolarHBondContact NE-O 2.65Å; R375-F399 HydrophobicContact CB-CD1 4.12Å; R375-F399 HydrophobicContact CB-CD2 4.4Å; R375-F399 HydrophobicContact CB-CE1 4.1Å; R375-F399 HydrophobicContact CB-CE2 4.38Å; R375-F399 HydrophobicContact CB-CG 4.28Å; R375-F399 HydrophobicContact CB-CZ 4.23Å
376	M	97.7	Very high	96.1	Very high	94 Å²	94	33.2 Å²	33.2	46%	0.463	17%	0.173	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	132.6	-175.8	-55.8	-52.4	-79.3	0	0	109	T393 V394 D395 Y400	M376-T393 HydrophobicContact CB-CG2 3.64Å; M376-T393 HydrophobicContact CE-CG2 3.44Å; M376-T393 VanDerWaalsContact CE-CG2 3.44Å; M376-T393 HydrophobicContact CG-CG2 4.22Å; M376-V394 WeakPolarHBondContact CA-O 3.45Å; M376-D395 HydrophobicContact CE-CB 4.08Å; M376-D395 HydrophobicContact SD-CB 3.84Å; M376-Y400 PolarHBondContact O-OH 2.8Å
377	V	98.1	Very high	95.8	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	130.6	174.4	175.5	0	0	0	0	107.9	W367 V368 A369 V394 V396 Y400 L412	W367-V377 HydrophobicContact CB-CG1 3.97Å; W367-V377 HydrophobicContact CG-CG1 4.47Å; V368-V377 CarbonylContact O-C 3.56Å; V368-V377 WeakPolarHBondContact O-CA 3.36Å; A369-V377 HydrophobicContact CB-CG2 4.11Å; V377-V394 PolarHBondContact N-O 2.74Å; V377-V394 PolarHBondContact O-N 3.35Å; V377-V396 HydrophobicContact CB-CG1 4.28Å; V377-V396 HydrophobicContact CG2-CG1 3.74Å; V377-Y400 HydrophobicContact CG2-CE1 4.27Å; V377-L412 HydrophobicContact CG2-CD2 3.93Å
378	K	97.7	Very high	95.6	Very high	60 Å²	60	45.3 Å²	45.3	26%	0.261	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	128	175.3	-66.8	175.4	177.4	168.2	0	109.3	W367 V368 E370 Y380 E392	W367-K378 CarbonylContact C-O 3.46Å; W367-K378 VanDerWaalsContact CA-O 3.29Å; W367-K378 WeakPolarHBondContact CA-O 3.42Å; V368-K378 HydrophobicContact CB-CB 4.35Å; V368-K378 PolarHBondContact N-O 2.84Å; V368-K378 PolarHBondContact O-N 3.17Å; E370-K378 IonicContact OE1-NZ 3.11Å; E370-K378 WeakPolarHBondContact OE2-CE 3.36Å; E370-K378 IonicContact OE2-NZ 3.86Å; E370-K378 PolarHBondContact OE2-NZ 3.36Å; K378-Y380 HydrophobicContact CB-CD2 4.36Å; K378-Y380 HydrophobicContact CB-CE2 3.61Å; K378-Y380 HydrophobicContact CD-CE2 4.47Å; K378-Y380 WeakPolarHBondContact CD-OH 3.26Å; K378-E392 CarbonylContact C-O 3.6Å; K378-E392 WeakPolarHBondContact CA-O 3.48Å
379	E	97.8	Very high	95.2	Very high	17 Å²	17	47.7 Å²	47.7	8%	0.079	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	125.2	172.5	-179.5	169.7	142.9	0	0	108.9	R365 W367 S391 E392 V394	R365-E379 VanDerWaalsContact CD-OE1 3.26Å; R365-E379 WeakPolarHBondContact CD-OE1 3.45Å; R365-E379 IonicContact NH1-OE1 2.69Å; R365-E379 PolarHBondContact NH1-OE1 2.77Å; R365-E379 VanDerWaalsContact NH1-OE1 3.16Å; W367-E379 PolarHBondContact NE1-OE2 2.9Å; E379-S391 CarbonylContact O-C 3.46Å; E379-S391 VanDerWaalsContact O-CA 3.28Å; E379-S391 WeakPolarHBondContact O-CA 3.28Å; E379-S391 WeakPolarHBondContact O-CB 3.49Å; E379-E392 PolarHBondContact N-O 3.11Å; E379-E392 PolarHBondContact O-N 3.1Å; E379-V394 HydrophobicContact CB-CG2 4.42Å
380	Y	97.4	Very high	95	Very high	12 Å²	12	51.6 Å²	51.6	5%	0.047	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	134.8	176.1	-61.1	-97	0	0	0	108.5	R365 I366 V368 K378 S382 F386 S390 S391	R365-Y380 CarbonylContact C-O 3.45Å; R365-Y380 WeakPolarHBondContact CA-O 3.42Å; I366-Y380 PolarHBondContact N-O 2.7Å; I366-Y380 PolarHBondContact O-N 3.06Å; V368-Y380 HydrophobicContact CB-CE2 4.01Å; V368-Y380 HydrophobicContact CG2-CD2 4.06Å; V368-Y380 HydrophobicContact CG2-CE2 3.64Å; K378-Y380 HydrophobicContact CB-CD2 4.36Å; K378-Y380 HydrophobicContact CB-CE2 3.61Å; K378-Y380 HydrophobicContact CD-CE2 4.47Å; K378-Y380 WeakPolarHBondContact CD-OH 3.26Å; Y380-S382 VanDerWaalsContact C-N 3.29Å; Y380-S382 PolarHBondContact O-N 2.75Å; Y380-F386 HydrophobicContact CD1-CB 4.03Å; Y380-F386 AromaticContact CD1-CD2 3.96Å; Y380-F386 HydrophobicContact CD1-CD2 3.96Å; Y380-F386 AromaticContact CD2-CD2 3.77Å; Y380-F386 HydrophobicContact CD2-CD2 3.77Å; Y380-F386 HydrophobicContact CD2-CE2 4.5Å; Y380-F386 AromaticContact CE1-CD2 3.86Å; Y380-F386 HydrophobicContact CE1-CD2 3.86Å; Y380-F386 AromaticContact CE2-CD2 3.71Å; Y380-F386 HydrophobicContact CE2-CD2 3.71Å; Y380-F386 HydrophobicContact CE2-CE2 4.1Å; Y380-F386 HydrophobicContact CG-CB 4.05Å; Y380-F386 AromaticContact CG-CD2 3.89Å; Y380-F386 HydrophobicContact CG-CD2 3.89Å; Y380-F386 HydrophobicContact CG-CG 4.46Å; Y380-F386 AromaticContact CZ-CD2 3.75Å; Y380-S390 WeakPolarHBondContact CD1-O 3.49Å; Y380-S391 VanDerWaalsContact CE1-CB 3.44Å
381	Q	95.5	Very high	95	Very high	102 Å²	102	51.5 Å²	51.5	48%	0.477	29%	0.291	S	S	.	.	S	Bend	trans	-72.9	-20.5	-174.8	-64.3	-59.2	-25.5	0	0	114.1
382	S	94.4	Very high	95	Very high	39 Å²	39	54.1 Å²	54.1	27%	0.273	30%	0.303	S	S	.	.	S	Bend	trans	-162.5	170	-179.6	66.9	0	0	0	0	111.5	E364 Y380 A384 A385 F386	E364-S382 WeakPolarHBondContact O-CA 3.21Å; Y380-S382 VanDerWaalsContact C-N 3.29Å; Y380-S382 PolarHBondContact O-N 2.75Å; S382-A384 PolarHBondContact O-N 3.45Å; S382-A384 PolarHBondContact OG-N 2.75Å; S382-A385 PolarHBondContact O-N 2.93Å; S382-A385 VanDerWaalsContact O-N 3.16Å; S382-A385 PolarHBondContact OG-N 3.46Å; S382-A385 VanDerWaalsContact OG-N 3.14Å; S382-F386 PolarHBondContact O-N 3.18Å
383	M	92.1	Very high	95.1	Very high	40 Å²	40	57.5 Å²	57.5	20%	0.197	32%	0.324	C	S	.	.	H	α-helix	trans	-56.9	-36.1	170.7	-167.7	63.4	66.5	0	0	112.7	V344 W354 I366 F386 Q387	V344-M383 HydrophobicContact CG1-CE 4.41Å; V344-M383 HydrophobicContact CG1-SD 3.44Å; V344-M383 WeakPolarHBondContact CG1-SD 3.28Å; W354-M383 HydrophobicContact CZ3-CE 4.36Å; I366-M383 HydrophobicContact CD1-CB 4.35Å; I366-M383 HydrophobicContact CD1-CE 3.73Å; I366-M383 HydrophobicContact CD1-SD 3.79Å; M383-F386 WeakPolarHBondContact O-CB 3.44Å; M383-F386 PolarHBondContact O-N 3.06Å; M383-F386 HydrophobicContact SD-CD1 4.16Å; M383-Q387 WeakPolarHBondContact O-CG 3.48Å; M383-Q387 PolarHBondContact O-N 3.24Å
384	A	93.6	Very high	95.2	Very high	52 Å²	52	56.3 Å²	56.3	43%	0.43	32%	0.316	S	S	.	.	H	α-helix	trans	-69	-41.8	176.7	0	0	0	0	0	111.6	S382 F386 Q387 N388	S382-A384 PolarHBondContact O-N 3.45Å; S382-A384 PolarHBondContact OG-N 2.75Å; A384-F386 VanDerWaalsContact C-N 3.28Å; A384-F386 PolarHBondContact O-N 2.82Å; A384-Q387 PolarHBondContact O-N 2.72Å; A384-N388 WeakPolarHBondContact O-CB 3.22Å; A384-N388 VanDerWaalsContact O-CG 3.28Å; A384-N388 PolarHBondContact O-N 3.03Å; A384-N388 PolarHBondContact O-ND2 2.85Å
385	A	94.7	Very high	95.3	Very high	14 Å²	14	58.4 Å²	58.4	12%	0.116	32%	0.324	C	S	.	.	H	α-helix	trans	-62.3	-38.7	174.3	0	0	0	0	0	111.4	S382 N388 G389 S390	S382-A385 PolarHBondContact O-N 2.93Å; S382-A385 VanDerWaalsContact O-N 3.16Å; S382-A385 PolarHBondContact OG-N 3.46Å; S382-A385 VanDerWaalsContact OG-N 3.14Å; A385-N388 PolarHBondContact O-N 3.03Å; A385-G389 PolarHBondContact O-N 3.32Å; A385-S390 PolarHBondContact O-N 2.71Å
386	F	94.8	Very high	95.3	Very high	10 Å²	10	53.9 Å²	53.9	4%	0.044	31%	0.307	C	S	.	.	H	α-helix	trans	-60.9	-46.5	174.9	-179	-121.2	0	0	0	112.8	V344 A345 M347 W354 I366 V368 Y380 S382 M383 A384 N388 G389 V567	V344-F386 HydrophobicContact CG1-CD1 4.09Å; V344-F386 HydrophobicContact CG1-CE1 3.91Å; A345-F386 HydrophobicContact CB-CE1 3.78Å; A345-F386 HydrophobicContact CB-CZ 4.1Å; M347-F386 HydrophobicContact CE-CE2 4.17Å; M347-F386 HydrophobicContact CE-CZ 4.32Å; M347-F386 HydrophobicContact SD-CE2 4.18Å; M347-F386 HydrophobicContact SD-CZ 3.78Å; W354-F386 HydrophobicContact CE3-CE1 4.44Å; I366-F386 HydrophobicContact CD1-CB 3.82Å; I366-F386 HydrophobicContact CD1-CD1 4.21Å; I366-F386 HydrophobicContact CD1-CG 4.11Å; V368-F386 HydrophobicContact CG2-CD2 4.32Å; V368-F386 HydrophobicContact CG2-CE2 3.75Å; V368-F386 HydrophobicContact CG2-CZ 4.46Å; Y380-F386 HydrophobicContact CD1-CB 4.03Å; Y380-F386 AromaticContact CD1-CD2 3.96Å; Y380-F386 HydrophobicContact CD1-CD2 3.96Å; Y380-F386 AromaticContact CD2-CD2 3.77Å; Y380-F386 HydrophobicContact CD2-CD2 3.77Å; Y380-F386 HydrophobicContact CD2-CE2 4.5Å; Y380-F386 AromaticContact CE1-CD2 3.86Å; Y380-F386 HydrophobicContact CE1-CD2 3.86Å; Y380-F386 AromaticContact CE2-CD2 3.71Å; Y380-F386 HydrophobicContact CE2-CD2 3.71Å; Y380-F386 HydrophobicContact CE2-CE2 4.1Å; Y380-F386 HydrophobicContact CG-CB 4.05Å; Y380-F386 AromaticContact CG-CD2 3.89Å; Y380-F386 HydrophobicContact CG-CD2 3.89Å; Y380-F386 HydrophobicContact CG-CG 4.46Å; Y380-F386 AromaticContact CZ-CD2 3.75Å; S382-F386 PolarHBondContact O-N 3.18Å; M383-F386 WeakPolarHBondContact O-CB 3.44Å; M383-F386 PolarHBondContact O-N 3.06Å; M383-F386 HydrophobicContact SD-CD1 4.16Å; A384-F386 VanDerWaalsContact C-N 3.28Å; A384-F386 PolarHBondContact O-N 2.82Å; F386-N388 VanDerWaalsContact C-N 3.33Å; F386-N388 PolarHBondContact O-N 2.66Å; F386-G389 PolarHBondContact O-N 3.24Å; F386-V567 HydrophobicContact CE1-CG2 3.91Å; F386-V567 HydrophobicContact CZ-CG2 3.94Å
387	Q	90.3	Very high	95.3	Very high	118 Å²	118	55.5 Å²	55.5	55%	0.551	31%	0.308	S	S	*	.	H	α-helix	trans	-67.7	-32.6	177.5	-71.5	177.6	-25.1	0	0	113.2	M383 A384 G389	M383-Q387 WeakPolarHBondContact O-CG 3.48Å; M383-Q387 PolarHBondContact O-N 3.24Å; A384-Q387 PolarHBondContact O-N 2.72Å; Q387-G389 VanDerWaalsContact C-N 3.34Å
388	N	91.8	Very high	95.3	Very high	137 Å²	137	60.2 Å²	60.2	73%	0.733	33%	0.329	S	S	*	.	H	α-helix	trans	-85.4	-4.9	178.7	-66.4	-13.4	0	0	0	113.5	A384 A385 F386 S390	A384-N388 WeakPolarHBondContact O-CB 3.22Å; A384-N388 VanDerWaalsContact O-CG 3.28Å; A384-N388 PolarHBondContact O-N 3.03Å; A384-N388 PolarHBondContact O-ND2 2.85Å; A385-N388 PolarHBondContact O-N 3.03Å; F386-N388 VanDerWaalsContact C-N 3.33Å; F386-N388 PolarHBondContact O-N 2.66Å; N388-S390 VanDerWaalsContact C-N 3.34Å; N388-S390 PolarHBondContact O-N 3.12Å
389	G	90.3	Very high	95.3	Very high	51 Å²	51	61.2 Å²	61.2	53%	0.526	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	77	11	179.9	0	0	0	0	0	115.6	A385 F386 Q387 S391	A385-G389 PolarHBondContact O-N 3.32Å; F386-G389 PolarHBondContact O-N 3.24Å; Q387-G389 VanDerWaalsContact C-N 3.34Å; G389-S391 PolarHBondContact O-N 3.16Å
390	S	93.4	Very high	95.3	Very high	83 Å²	83	60.7 Å²	60.7	58%	0.58	33%	0.331	S	S	*	.			trans	-82.5	105.9	179.2	-175.7	0	0	0	0	110.7	Y380 A385 N388	Y380-S390 WeakPolarHBondContact CD1-O 3.49Å; A385-S390 PolarHBondContact O-N 2.71Å; N388-S390 VanDerWaalsContact C-N 3.34Å; N388-S390 PolarHBondContact O-N 3.12Å
391	S	95.8	Very high	95.3	Very high	44 Å²	44	61.9 Å²	61.9	31%	0.308	34%	0.336	S	S	.	.			trans	-136.1	154.7	-178.9	49.6	0	0	0	0	113	E379 Y380 G389	E379-S391 CarbonylContact O-C 3.46Å; E379-S391 VanDerWaalsContact O-CA 3.28Å; E379-S391 WeakPolarHBondContact O-CA 3.28Å; E379-S391 WeakPolarHBondContact O-CB 3.49Å; Y380-S391 VanDerWaalsContact CE1-CB 3.44Å; G389-S391 PolarHBondContact O-N 3.16Å
392	E	96.4	Very high	95.3	Very high	120 Å²	120	57 Å²	57	56%	0.561	31%	0.314	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.9	143.5	163.7	-65.8	-173.4	173.1	0	0	109.6	K378 E379	K378-E392 CarbonylContact C-O 3.6Å; K378-E392 WeakPolarHBondContact CA-O 3.48Å; E379-E392 PolarHBondContact N-O 3.11Å; E379-E392 PolarHBondContact O-N 3.1Å
393	T	96.9	Very high	95.5	Very high	81 Å²	81	55.2 Å²	55.2	50%	0.497	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	129.8	178.7	-48	0	0	0	0	110.7	M376	M376-T393 HydrophobicContact CB-CG2 3.64Å; M376-T393 HydrophobicContact CE-CG2 3.44Å; M376-T393 VanDerWaalsContact CE-CG2 3.44Å; M376-T393 HydrophobicContact CG-CG2 4.22Å
394	V	97.8	Very high	95.8	Very high	1 Å²	1	53.4 Å²	53.4	1%	0.006	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	120.1	179.8	173.4	0	0	0	0	110.2	M376 V377 E379 V396 F425 F427 R430	M376-V394 WeakPolarHBondContact CA-O 3.45Å; V377-V394 PolarHBondContact N-O 2.74Å; V377-V394 PolarHBondContact O-N 3.35Å; E379-V394 HydrophobicContact CB-CG2 4.42Å; V394-V396 HydrophobicContact CG1-CG1 4.38Å; V394-F425 HydrophobicContact CG1-CE1 3.72Å; V394-F425 HydrophobicContact CG1-CZ 4.14Å; V394-F427 HydrophobicContact CG1-CD1 4Å; V394-F427 HydrophobicContact CG1-CE1 4.06Å; V394-R430 VanDerWaalsContact CG1-NH1 3.25Å
395	D	97.7	Very high	96	Very high	57 Å²	57	51.1 Å²	51.1	31%	0.305	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	118	167.7	-179.7	-4.1	0	0	0	110.3	R375 M376 R397 F425	R375-D395 WeakPolarHBondContact CG-OD1 3.39Å; R375-D395 IonicContact CZ-OD1 2.69Å; R375-D395 IonicContact CZ-OD2 3.35Å; R375-D395 VanDerWaalsContact CZ-OD2 3.31Å; R375-D395 VanDerWaalsContact NE-CG 3.35Å; R375-D395 IonicContact NE-OD1 2.85Å; R375-D395 PolarHBondContact NE-OD1 3.23Å; R375-D395 IonicContact NE-OD2 3.84Å; R375-D395 PolarHBondContact NE-OD2 3.45Å; R375-D395 IonicContact NH2-OD1 2.7Å; R375-D395 PolarHBondContact NH2-OD1 2.93Å; R375-D395 IonicContact NH2-OD2 2.85Å; R375-D395 PolarHBondContact NH2-OD2 2.99Å; M376-D395 HydrophobicContact CE-CB 4.08Å; M376-D395 HydrophobicContact SD-CB 3.84Å; D395-R397 VanDerWaalsContact C-N 3.28Å; D395-R397 PolarHBondContact O-N 2.65Å; D395-R397 WeakPolarHBondContact OD1-CA 3.25Å; D395-R397 PolarHBondContact OD1-N 2.66Å; D395-F425 WeakPolarHBondContact O-CZ 3.42Å
396	V	97.7	Very high	96.1	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	11.8	179.7	-59.7	0	0	0	0	113.6	R375 V377 V394 K398 Y400 L412 Y414 F425	R375-V396 VanDerWaalsContact O-CG2 3.25Å; R375-V396 WeakPolarHBondContact O-CG2 3.24Å; R375-V396 PolarHBondContact O-N 2.97Å; V377-V396 HydrophobicContact CB-CG1 4.28Å; V377-V396 HydrophobicContact CG2-CG1 3.74Å; V394-V396 HydrophobicContact CG1-CG1 4.38Å; V396-K398 WeakPolarHBondContact CG2-O 3.25Å; V396-K398 PolarHBondContact O-N 3.25Å; V396-Y400 HydrophobicContact CG2-CD1 4.3Å; V396-L412 HydrophobicContact CB-CD2 4.44Å; V396-L412 HydrophobicContact CG1-CD2 3.69Å; V396-Y414 HydrophobicContact CB-CE1 4.22Å; V396-Y414 HydrophobicContact CG2-CE1 4.32Å; V396-Y414 HydrophobicContact CG2-CE2 4.4Å; V396-Y414 PolarHBondContact O-OH 2.8Å; V396-F425 HydrophobicContact CB-CD1 4.36Å; V396-F425 HydrophobicContact CB-CG 4.28Å; V396-F425 HydrophobicContact CG1-CD1 3.99Å; V396-F425 HydrophobicContact CG1-CE1 4.18Å; V396-F425 HydrophobicContact CG1-CG 4.39Å
397	R	96.8	Very high	96.2	Very high	127 Å²	127	50.1 Å²	50.1	48%	0.479	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	71	-37.7	176.2	-53.2	-178.9	173.1	-153.6	-3.6	116.4	R375 D395 F425 R430 L432	R375-R397 PolarHBondContact NE-O 2.65Å; D395-R397 VanDerWaalsContact C-N 3.28Å; D395-R397 PolarHBondContact O-N 2.65Å; D395-R397 WeakPolarHBondContact OD1-CA 3.25Å; D395-R397 PolarHBondContact OD1-N 2.66Å; R397-F425 HydrophobicContact CG-CE2 4.09Å; R397-R430 PolarHBondContact NE-O 3.26Å; R397-R430 PolarHBondContact NH2-O 3.29Å; R397-L432 HydrophobicContact CB-CD2 4.35Å
398	K	97.6	Very high	96.5	Very high	99 Å²	99	45.5 Å²	45.5	43%	0.43	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	145.4	178.3	-65.3	-67.2	-173	175.6	0	110.7	V396 Y400 Y414 I416 L432	V396-K398 WeakPolarHBondContact CG2-O 3.25Å; V396-K398 PolarHBondContact O-N 3.25Å; K398-Y400 PolarHBondContact O-N 2.66Å; K398-Y414 WeakPolarHBondContact O-CE2 3.42Å; K398-Y414 PolarHBondContact O-OH 3.4Å; K398-I416 HydrophobicContact CB-CG1 4.49Å; K398-I416 HydrophobicContact CB-CG2 4.32Å; K398-L432 HydrophobicContact CB-CD2 4.33Å; K398-L432 HydrophobicContact CG-CD2 3.55Å
399	F	98	Very high	96.6	Very high	82 Å²	82	42.6 Å²	42.6	36%	0.36	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	129.4	177.7	-80.6	-96.1	0	0	0	110.9	G374 R375 A417	G374-F399 CarbonylContact O-C 3.52Å; G374-F399 VanDerWaalsContact O-CA 3.22Å; G374-F399 WeakPolarHBondContact O-CA 3.36Å; R375-F399 HydrophobicContact CB-CD1 4.12Å; R375-F399 HydrophobicContact CB-CD2 4.4Å; R375-F399 HydrophobicContact CB-CE1 4.1Å; R375-F399 HydrophobicContact CB-CE2 4.38Å; R375-F399 HydrophobicContact CB-CG 4.28Å; R375-F399 HydrophobicContact CB-CZ 4.23Å; F399-A417 HydrophobicContact CB-CB 4.03Å; F399-A417 PolarHBondContact O-N 3.12Å
400	Y	98.1	Very high	96.8	Very high	6 Å²	6	41.1 Å²	41.1	2%	0.024	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	156.7	169	62	-104.4	0	0	0	111.2	A369 E370 S373 G374 M376 V377 V396 K398 H405 Y414 H415	A369-Y400 HydrophobicContact CB-CE1 4.01Å; A369-Y400 HydrophobicContact CB-CE2 4.1Å; E370-Y400 PolarHBondContact O-OH 2.97Å; S373-Y400 VanDerWaalsContact CA-O 3.25Å; S373-Y400 WeakPolarHBondContact CA-O 3.31Å; S373-Y400 PolarHBondContact OG-O 3.28Å; G374-Y400 VanDerWaalsContact C-CD1 3.47Å; G374-Y400 VanDerWaalsContact CA-CZ 3.42Å; G374-Y400 VanDerWaalsContact N-CE2 3.25Å; G374-Y400 PolarHBondContact N-O 2.94Å; G374-Y400 WeakPolarHBondContact O-CD1 3.44Å; G374-Y400 WeakPolarHBondContact O-CE1 3.13Å; G374-Y400 PolarHBondContact O-N 2.8Å; M376-Y400 PolarHBondContact O-OH 2.8Å; V377-Y400 HydrophobicContact CG2-CE1 4.27Å; V396-Y400 HydrophobicContact CG2-CD1 4.3Å; K398-Y400 PolarHBondContact O-N 2.66Å; Y400-H405 AromaticContact CD2-CE1 3.91Å; Y400-H405 AromaticContact CD2-NE2 3.29Å; Y400-H405 VanDerWaalsContact CD2-NE2 3.29Å; Y400-H405 WeakPolarHBondContact CD2-NE2 3.12Å; Y400-H405 AromaticContact CE2-NE2 3.95Å; Y400-H405 AromaticContact CG-NE2 3.75Å; Y400-Y414 VanDerWaalsContact CB-CD2 3.42Å; Y400-H415 VanDerWaalsContact CA-O 3.28Å; Y400-H415 WeakPolarHBondContact CA-O 3.1Å
401	Q	96.9	Very high	97	Very high	36 Å²	36	37.7 Å²	37.7	17%	0.168	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	145.7	173.4	-175.6	168.3	18.2	0	0	111.6	F372 H405 H415 A417 G418 Y455	F372-Q401 CarbonylContact O-C 3.53Å; F372-Q401 WeakPolarHBondContact O-CA 3.42Å; Q401-H405 PolarHBondContact O-CE1 3.49Å; Q401-H415 PolarHBondContact N-O 2.83Å; Q401-A417 HydrophobicContact CB-CB 3.81Å; Q401-G418 VanDerWaalsContact OE1-N 3.15Å; Q401-Y455 HydrophobicContact CG-CD2 4.4Å; Q401-Y455 HydrophobicContact CG-CE2 4.43Å
402	G	97	Very high	97.2	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.175	C	C	.	.	S	Bend	trans	77.6	-163.1	-175.2	0	0	0	0	0	113.2	F372 H405 K453	F372-G402 PolarHBondContact O-N 2.74Å; G402-H405 PolarHBondContact O-NE2 3.28Å; G402-K453 VanDerWaalsContact CA-O 3.25Å; G402-K453 WeakPolarHBondContact CA-O 3.43Å
403	C	98.1	Very high	97.3	Very high	2 Å²	2	30 Å²	30	1%	0.014	15%	0.149	C	C	.	.	S	Bend	trans	-130.4	29	179.7	-59.5	0	0	0	0	111.5	T353 T454 A548	T353-C403 VanDerWaalsContact CG2-CA 3.43Å; T353-C403 HydrophobicContact CG2-CB 3.67Å; T353-C403 WeakPolarHBondContact CG2-O 3.35Å; C403-T454 PolarHBondContact N-OG1 2.86Å; C403-A548 WeakPolarHBondContact CB-O 3.42Å
404	G	97.7	Very high	97.4	Very high	2 Å²	2	26.2 Å²	26.2	2%	0.021	13%	0.126	C	C	.	.			trans	-98.3	29.3	-176.7	0	0	0	0	0	114.4	M458	G404-M458 WeakPolarHBondContact O-CB 3.4Å; G404-M458 PolarHBondContact O-N 2.92Å
405	H	97.8	Very high	97.4	Very high	4 Å²	4	26.3 Å²	26.3	2%	0.019	13%	0.126	C	C	.	.			trans	-84.6	157.9	-174.5	-43.4	-37.7	0	0	0	111.7	T353 M355 Y400 Q401 G402 L412 Y413 Y414	T353-H405 PolarHBondContact OG1-CD2 3.25Å; M355-H405 HydrophobicContact CE-CB 4.29Å; M355-H405 VanDerWaalsContact SD-C 3.56Å; M355-H405 HydrophobicContact SD-CB 3.73Å; Y400-H405 AromaticContact CD2-CE1 3.91Å; Y400-H405 AromaticContact CD2-NE2 3.29Å; Y400-H405 VanDerWaalsContact CD2-NE2 3.29Å; Y400-H405 WeakPolarHBondContact CD2-NE2 3.12Å; Y400-H405 AromaticContact CE2-NE2 3.95Å; Y400-H405 AromaticContact CG-NE2 3.75Å; Q401-H405 PolarHBondContact O-CE1 3.49Å; G402-H405 PolarHBondContact O-NE2 3.28Å; H405-L412 HydrophobicContact CB-CD1 4.23Å; H405-Y413 WeakPolarHBondContact CA-O 3.43Å; H405-Y414 WeakPolarHBondContact ND1-CB 3.28Å
406	T	97.4	Very high	97.4	Very high	2 Å²	2	24.5 Å²	24.5	1%	0.012	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	143	173.4	-60.4	0	0	0	0	110.4	T358 Y413 M458 A460	T358-T406 HydrophobicContact CG2-CG2 4.12Å; T406-Y413 PolarHBondContact N-O 2.86Å; T406-Y413 VanDerWaalsContact N-O 3.12Å; T406-Y413 PolarHBondContact O-N 3.33Å; T406-M458 WeakPolarHBondContact OG1-CB 3.4Å; T406-M458 PolarHBondContact OG1-O 3.38Å; T406-A460 HydrophobicContact CG2-CB 4.38Å
407	V	97.4	Very high	97.4	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.006	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	127.1	167.6	-179.4	0	0	0	0	109.1	M355 D357 T358 W367 S411 L412 F427	M355-V407 HydrophobicContact CB-CB 4.41Å; M355-V407 HydrophobicContact CB-CG2 4.02Å; M355-V407 HydrophobicContact CE-CG2 4.33Å; M355-V407 HydrophobicContact SD-CG2 4.11Å; D357-V407 HydrophobicContact CB-CG1 4.16Å; T358-V407 PolarHBondContact N-O 2.95Å; T358-V407 PolarHBondContact OG1-O 3.47Å; W367-V407 HydrophobicContact CB-CG2 4.08Å; W367-V407 HydrophobicContact CD2-CG1 4.3Å; W367-V407 HydrophobicContact CD2-CG2 4.04Å; W367-V407 HydrophobicContact CE3-CB 4.14Å; W367-V407 HydrophobicContact CE3-CG1 3.88Å; W367-V407 HydrophobicContact CE3-CG2 3.96Å; W367-V407 HydrophobicContact CG-CG2 4.12Å; W367-V407 HydrophobicContact CH2-CG1 4.21Å; W367-V407 HydrophobicContact CZ3-CB 4.49Å; W367-V407 HydrophobicContact CZ3-CG1 3.85Å; V407-S411 WeakPolarHBondContact CA-O 3.32Å; V407-L412 HydrophobicContact CG2-CD1 3.87Å; V407-F427 HydrophobicContact CG1-CE2 4.06Å; V407-F427 HydrophobicContact CG2-CE2 4.03Å; V407-F427 HydrophobicContact CG2-CZ 4.4Å
408	H	96	Very high	97.3	Very high	21 Å²	21	21.7 Å²	21.7	10%	0.097	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	120.3	179.4	-174.2	78.7	0	0	0	110.2	T358 S411 Y413 A460 Q484	T358-H408 VanDerWaalsContact OG1-CB 3.31Å; T358-H408 WeakPolarHBondContact OG1-CB 3.3Å; T358-H408 PolarHBondContact OG1-ND1 3.28Å; H408-S411 PolarHBondContact N-O 3.19Å; H408-S411 PolarHBondContact O-N 2.97Å; H408-Y413 HydrophobicContact CB-CD2 4.28Å; H408-Y413 HydrophobicContact CB-CE2 3.91Å; H408-A460 HydrophobicContact CB-CB 4.48Å; H408-Q484 PolarHBondContact CD2-NE2 2.92Å; H408-Q484 PolarHBondContact NE2-NE2 2.93Å; H408-Q484 VanDerWaalsContact NE2-NE2 3.17Å
409	N	94.5	Very high	97.3	Very high	76 Å²	76	19.2 Å²	19.2	41%	0.406	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.9	53	177.9	-165.7	18.7	0	0	0	113.3	D357 A359 H360 S411 Q484	D357-N409 PolarHBondContact OD1-N 2.96Å; D357-N409 WeakPolarHBondContact OD2-CA 3.43Å; D357-N409 PolarHBondContact OD2-N 3.08Å; A359-N409 HydrophobicContact CB-CB 3.84Å; H360-N409 PolarHBondContact NE2-OD1 2.91Å; N409-S411 PolarHBondContact O-N 3.35Å; N409-Q484 PolarHBondContact ND2-NE2 3.33Å; N409-Q484 VanDerWaalsContact ND2-NE2 3.11Å
410	G	94.9	Very high	97.2	Very high	19 Å²	19	15.5 Å²	15.5	20%	0.196	10%	0.102	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.7	12.8	177.1	0	0	0	0	0	114.6	D357 F427	D357-G410 PolarHBondContact OD2-N 3.37Å; G410-F427 WeakPolarHBondContact O-CD2 3.34Å; G410-F427 PolarHBondContact O-N 2Å; G410-F427 VanDerWaalsContact O-N 3.09Å
411	S	97.5	Very high	97.2	Very high	11 Å²	11	16.4 Å²	16.4	8%	0.077	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	139.9	-179.8	-59.4	0	0	0	0	111.9	V407 H408 N409 F425	V407-S411 WeakPolarHBondContact CA-O 3.32Å; H408-S411 PolarHBondContact N-O 3.19Å; H408-S411 PolarHBondContact O-N 2.97Å; N409-S411 PolarHBondContact O-N 3.35Å; S411-F425 CarbonylContact C-O 3.58Å; S411-F425 WeakPolarHBondContact CA-O 3.47Å
412	L	98.4	Very high	97.3	Very high	1 Å²	1	14.7 Å²	14.7	1%	0.005	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	128.4	169.7	-178.9	70.3	0	0	0	110.2	M355 V377 V396 H405 V407 Y414 R424 F425 F427	M355-L412 HydrophobicContact CE-CD1 3.9Å; M355-L412 HydrophobicContact SD-CD1 4.07Å; V377-L412 HydrophobicContact CG2-CD2 3.93Å; V396-L412 HydrophobicContact CB-CD2 4.44Å; V396-L412 HydrophobicContact CG1-CD2 3.69Å; H405-L412 HydrophobicContact CB-CD1 4.23Å; V407-L412 HydrophobicContact CG2-CD1 3.87Å; L412-Y414 HydrophobicContact CD2-CD1 3.76Å; L412-Y414 HydrophobicContact CD2-CE1 4.23Å; L412-Y414 HydrophobicContact CD2-CG 4.41Å; L412-Y414 HydrophobicContact CG-CD1 3.86Å; L412-R424 CarbonylContact O-C 3.55Å; L412-R424 WeakPolarHBondContact O-CA 3.31Å; L412-F425 HydrophobicContact CB-CB 4.46Å; L412-F425 PolarHBondContact N-O 2.57Å; L412-F425 PolarHBondContact O-N 3.46Å; L412-F427 HydrophobicContact CB-CE2 3.84Å; L412-F427 HydrophobicContact CB-CZ 3.66Å; L412-F427 HydrophobicContact CG-CZ 4.49Å
413	Y	98.6	Very high	97.4	Very high	3 Å²	3	14.7 Å²	14.7	1%	0.012	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	124.5	172	-61.7	-100.5	0	0	0	109.7	H405 T406 H408 A423 R424 M458 L465 F487	H405-Y413 WeakPolarHBondContact CA-O 3.43Å; T406-Y413 PolarHBondContact N-O 2.86Å; T406-Y413 VanDerWaalsContact N-O 3.12Å; T406-Y413 PolarHBondContact O-N 3.33Å; H408-Y413 HydrophobicContact CB-CD2 4.28Å; H408-Y413 HydrophobicContact CB-CE2 3.91Å; Y413-A423 VanDerWaalsContact CA-O 3.28Å; Y413-A423 WeakPolarHBondContact CA-O 3.37Å; Y413-R424 HydrophobicContact CD1-CB 3.97Å; Y413-R424 HydrophobicContact CD1-CG 4.07Å; Y413-R424 HydrophobicContact CE1-CB 3.78Å; Y413-R424 HydrophobicContact CE1-CG 3.51Å; Y413-R424 HydrophobicContact CE2-CG 4.32Å; Y413-R424 VanDerWaalsContact OH-CD 3.26Å; Y413-R424 WeakPolarHBondContact OH-CD 3.41Å; Y413-M458 HydrophobicContact CD1-CE 3.95Å; Y413-M458 HydrophobicContact CG-CE 3.98Å; Y413-L465 HydrophobicContact CD1-CD2 3.91Å; Y413-L465 HydrophobicContact CE1-CD2 3.53Å; Y413-L465 HydrophobicContact CE2-CD2 4.38Å; Y413-L465 HydrophobicContact CG-CD2 4.46Å; Y413-F487 HydrophobicContact CD1-CD2 4.37Å; Y413-F487 AromaticContact CD1-CE2 3.72Å; Y413-F487 HydrophobicContact CD1-CE2 3.72Å; Y413-F487 HydrophobicContact CD1-CZ 4.4Å; Y413-F487 AromaticContact CE1-CD2 3.89Å; Y413-F487 HydrophobicContact CE1-CD2 3.89Å; Y413-F487 AromaticContact CE1-CE2 3.72Å; Y413-F487 HydrophobicContact CE1-CE2 3.72Å
414	Y	98.6	Very high	97.4	Very high	1 Å²	1	16.5 Å²	16.5	0%	0.004	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	159.3	-174.4	69.7	-84.1	0	0	0	113.1	V396 K398 Y400 H405 L412 I416 I422 A423 F425 L432	V396-Y414 HydrophobicContact CB-CE1 4.22Å; V396-Y414 HydrophobicContact CG2-CE1 4.32Å; V396-Y414 HydrophobicContact CG2-CE2 4.4Å; V396-Y414 PolarHBondContact O-OH 2.8Å; K398-Y414 WeakPolarHBondContact O-CE2 3.42Å; K398-Y414 PolarHBondContact O-OH 3.4Å; Y400-Y414 VanDerWaalsContact CB-CD2 3.42Å; H405-Y414 WeakPolarHBondContact ND1-CB 3.28Å; L412-Y414 HydrophobicContact CD2-CD1 3.76Å; L412-Y414 HydrophobicContact CD2-CE1 4.23Å; L412-Y414 HydrophobicContact CD2-CG 4.41Å; L412-Y414 HydrophobicContact CG-CD1 3.86Å; Y414-I416 HydrophobicContact CE2-CG1 4.45Å; Y414-I422 CarbonylContact O-C 3.56Å; Y414-I422 WeakPolarHBondContact O-CA 3.49Å; Y414-I422 WeakPolarHBondContact O-CG2 3.25Å; Y414-A423 HydrophobicContact CD1-CB 3.77Å; Y414-A423 HydrophobicContact CD2-CB 4.19Å; Y414-A423 HydrophobicContact CE1-CB 3.38Å; Y414-A423 HydrophobicContact CE2-CB 3.87Å; Y414-A423 HydrophobicContact CG-CB 4.18Å; Y414-A423 VanDerWaalsContact CZ-CB 3.44Å; Y414-A423 PolarHBondContact N-O 3.31Å; Y414-A423 PolarHBondContact O-N 3.06Å; Y414-F425 HydrophobicContact CE1-CB 4Å; Y414-L432 HydrophobicContact CE1-CD1 4.22Å
415	H	98.6	Very high	97.4	Very high	2 Å²	2	16.4 Å²	16.4	1%	0.009	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	128	176.1	173.2	-146.4	0	0	0	111.3	Y400 Q401 A417 T419 I422 Y455 F456	Y400-H415 VanDerWaalsContact CA-O 3.28Å; Y400-H415 WeakPolarHBondContact CA-O 3.1Å; Q401-H415 PolarHBondContact N-O 2.83Å; H415-A417 PolarHBondContact O-N 3.09Å; H415-T419 PolarHBondContact CD2-O 3.19Å; H415-T419 PolarHBondContact NE2-O 2.81Å; H415-I422 HydrophobicContact CB-CD1 4.45Å; H415-Y455 AromaticContact CE1-CD2 3.78Å; H415-F456 HydrophobicContact CB-CB 4.15Å; H415-F456 HydrophobicContact CB-CD2 4.14Å; H415-F456 AromaticContact CD2-CD2 3.31Å; H415-F456 WeakPolarHBondContact CD2-CD2 3.42Å; H415-F456 AromaticContact CD2-CE2 3.59Å; H415-F456 AromaticContact CE1-CD2 3.85Å; H415-F456 AromaticContact CG-CD2 3.5Å; H415-F456 AromaticContact ND1-CD2 3.83Å; H415-F456 AromaticContact NE2-CD2 3.55Å; H415-F456 AromaticContact NE2-CE2 3.48Å; H415-F456 WeakPolarHBondContact NE2-CE2 3.3Å
416	I	98.4	Very high	97.4	Very high	19 Å²	19	17.6 Å²	17.6	10%	0.097	11%	0.113	C	C	.	.	B	Isolated β-bridge	trans	-77.4	116.4	172	-58.3	179.4	0	0	0	109.3	K398 Y414 G418 T419 T421 A423 T434	K398-I416 HydrophobicContact CB-CG1 4.49Å; K398-I416 HydrophobicContact CB-CG2 4.32Å; Y414-I416 HydrophobicContact CE2-CG1 4.45Å; I416-G418 PolarHBondContact O-N 2.8Å; I416-T419 WeakPolarHBondContact CB-OG1 3.11Å; I416-T419 HydrophobicContact CG2-CG2 4.22Å; I416-T419 PolarHBondContact O-N 3.23Å; I416-T419 PolarHBondContact O-OG1 2.78Å; I416-T421 HydrophobicContact CD1-CG2 3.81Å; I416-T421 PolarHBondContact N-O 2.86Å; I416-A423 HydrophobicContact CD1-CB 4.01Å; I416-A423 HydrophobicContact CG1-CB 3.75Å; I416-T434 HydrophobicContact CD1-CG2 3.73Å
417	A	96.5	Very high	97.4	Very high	19 Å²	19	18.1 Å²	18.1	16%	0.157	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.1	133.9	-174.7	0	0	0	0	0	113	F399 Q401 H415 T419	F399-A417 HydrophobicContact CB-CB 4.03Å; F399-A417 PolarHBondContact O-N 3.12Å; Q401-A417 HydrophobicContact CB-CB 3.81Å; H415-A417 PolarHBondContact O-N 3.09Å; A417-T419 VanDerWaalsContact C-N 3.26Å; A417-T419 PolarHBondContact O-N 2.72Å
418	G	94.6	Very high	97.3	Very high	49 Å²	49	28.5 Å²	28.5	51%	0.505	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.8	6.9	177.1	0	0	0	0	0	116.1	Q401 I416 F442	Q401-G418 VanDerWaalsContact OE1-N 3.15Å; I416-G418 PolarHBondContact O-N 2.8Å; G418-F442 WeakPolarHBondContact O-CE2 3.3Å
419	T	97.3	Very high	97.3	Very high	48 Å²	48	30.6 Å²	30.6	29%	0.294	17%	0.168	S	C	.	.	S	Bend	trans	-128	163.1	-178.8	73.2	0	0	0	0	112	H415 I416 A417 T421 F442	H415-T419 PolarHBondContact CD2-O 3.19Å; H415-T419 PolarHBondContact NE2-O 2.81Å; I416-T419 WeakPolarHBondContact CB-OG1 3.11Å; I416-T419 HydrophobicContact CG2-CG2 4.22Å; I416-T419 PolarHBondContact O-N 3.23Å; I416-T419 PolarHBondContact O-OG1 2.78Å; A417-T419 VanDerWaalsContact C-N 3.26Å; A417-T419 PolarHBondContact O-N 2.72Å; T419-T421 PolarHBondContact O-N 3.37Å; T419-T421 WeakPolarHBondContact OG1-CB 3.38Å; T419-T421 PolarHBondContact OG1-N 2.76Å; T419-F442 WeakPolarHBondContact O-CB 3.47Å
420	S	97.2	Very high	97.4	Very high	4 Å²	4	32 Å²	32	3%	0.028	17%	0.168	C	C	.	.	S	Bend	trans	-84.7	34.2	169.1	-154.7	0	0	0	0	112.6	I437 F442	S420-I437 PolarHBondContact O-N 3.45Å; S420-I437 PolarHBondContact OG-O 2.87Å; S420-F442 VanDerWaalsContact CB-CD1 3.49Å
421	T	98.4	Very high	97.5	Very high	25 Å²	25	38.9 Å²	38.9	15%	0.153	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	135.9	-169.7	-53.6	0	0	0	0	111.8	I416 T419 T434 L435	I416-T421 HydrophobicContact CD1-CG2 3.81Å; I416-T421 PolarHBondContact N-O 2.86Å; T419-T421 PolarHBondContact O-N 3.37Å; T419-T421 WeakPolarHBondContact OG1-CB 3.38Å; T419-T421 PolarHBondContact OG1-N 2.76Å; T421-T434 HydrophobicContact CG2-CG2 4.34Å; T421-L435 CarbonylContact C-O 3.59Å; T421-L435 WeakPolarHBondContact CA-O 3.18Å; T421-L435 WeakPolarHBondContact CG2-O 3.19Å
422	I	98.5	Very high	97.6	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	139.1	171.3	-50.6	-59.8	0	0	0	109.3	Y414 H415 T434 L435 I437 F456 M458 L467 F487	Y414-I422 CarbonylContact O-C 3.56Å; Y414-I422 WeakPolarHBondContact O-CA 3.49Å; Y414-I422 WeakPolarHBondContact O-CG2 3.25Å; H415-I422 HydrophobicContact CB-CD1 4.45Å; I422-T434 CarbonylContact O-C 3.49Å; I422-T434 WeakPolarHBondContact O-CA 3.2Å; I422-L435 PolarHBondContact N-O 2.87Å; I422-L435 PolarHBondContact O-N 2.79Å; I422-I437 HydrophobicContact CG1-CD1 4.31Å; I422-I437 HydrophobicContact CG1-CG1 3.87Å; I422-F456 HydrophobicContact CD1-CB 3.55Å; I422-F456 HydrophobicContact CD1-CD1 3.69Å; I422-F456 HydrophobicContact CD1-CD2 4.12Å; I422-F456 HydrophobicContact CD1-CE1 4.38Å; I422-F456 HydrophobicContact CD1-CG 3.53Å; I422-M458 HydrophobicContact CG2-SD 3.8Å; I422-L467 HydrophobicContact CD1-CD1 3.75Å; I422-L467 HydrophobicContact CD1-CD2 4.36Å; I422-L467 HydrophobicContact CG1-CD1 3.95Å; I422-L467 HydrophobicContact CG1-CD2 3.86Å; I422-F487 HydrophobicContact CB-CZ 4.41Å; I422-F487 HydrophobicContact CG2-CZ 4.17Å
423	A	98.4	Very high	97.6	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	143.8	174.2	0	0	0	0	0	111.3	Y413 Y414 I416 L432 H433	Y413-A423 VanDerWaalsContact CA-O 3.28Å; Y413-A423 WeakPolarHBondContact CA-O 3.37Å; Y414-A423 HydrophobicContact CD1-CB 3.77Å; Y414-A423 HydrophobicContact CD2-CB 4.19Å; Y414-A423 HydrophobicContact CE1-CB 3.38Å; Y414-A423 HydrophobicContact CE2-CB 3.87Å; Y414-A423 HydrophobicContact CG-CB 4.18Å; Y414-A423 VanDerWaalsContact CZ-CB 3.44Å; Y414-A423 PolarHBondContact N-O 3.31Å; Y414-A423 PolarHBondContact O-N 3.06Å; I416-A423 HydrophobicContact CD1-CB 4.01Å; I416-A423 HydrophobicContact CG1-CB 3.75Å; A423-L432 HydrophobicContact CB-CD1 3.66Å; A423-H433 CarbonylContact C-O 3.53Å; A423-H433 WeakPolarHBondContact CA-O 3.31Å
424	R	98.5	Very high	97.5	Very high	39 Å²	39	47.9 Å²	47.9	15%	0.147	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	108.2	161.3	179.3	-175.9	75.9	175.2	1.5	108.5	L412 Y413 H433 Q484 F487	L412-R424 CarbonylContact O-C 3.55Å; L412-R424 WeakPolarHBondContact O-CA 3.31Å; Y413-R424 HydrophobicContact CD1-CB 3.97Å; Y413-R424 HydrophobicContact CD1-CG 4.07Å; Y413-R424 HydrophobicContact CE1-CB 3.78Å; Y413-R424 HydrophobicContact CE1-CG 3.51Å; Y413-R424 HydrophobicContact CE2-CG 4.32Å; Y413-R424 VanDerWaalsContact OH-CD 3.26Å; Y413-R424 WeakPolarHBondContact OH-CD 3.41Å; R424-H433 HydrophobicContact CB-CB 4.39Å; R424-H433 PolarHBondContact N-O 2.76Å; R424-H433 PolarHBondContact O-N 2.86Å; R424-Q484 PolarHBondContact NH1-O 2.87Å; R424-F487 HydrophobicContact CB-CD1 3.94Å; R424-F487 HydrophobicContact CB-CD2 4.12Å; R424-F487 HydrophobicContact CB-CE1 3.66Å; R424-F487 HydrophobicContact CB-CE2 3.88Å; R424-F487 HydrophobicContact CB-CG 4.16Å; R424-F487 HydrophobicContact CB-CZ 3.64Å
425	F	98.5	Very high	97.5	Very high	1 Å²	1	49 Å²	49	0%	0.004	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	118.5	177.9	178.2	-96.4	0	0	0	110.6	V394 D395 V396 R397 S411 L412 Y414 F427 R430 L432	V394-F425 HydrophobicContact CG1-CE1 3.72Å; V394-F425 HydrophobicContact CG1-CZ 4.14Å; D395-F425 WeakPolarHBondContact O-CZ 3.42Å; V396-F425 HydrophobicContact CB-CD1 4.36Å; V396-F425 HydrophobicContact CB-CG 4.28Å; V396-F425 HydrophobicContact CG1-CD1 3.99Å; V396-F425 HydrophobicContact CG1-CE1 4.18Å; V396-F425 HydrophobicContact CG1-CG 4.39Å; R397-F425 HydrophobicContact CG-CE2 4.09Å; S411-F425 CarbonylContact C-O 3.58Å; S411-F425 WeakPolarHBondContact CA-O 3.47Å; L412-F425 HydrophobicContact CB-CB 4.46Å; L412-F425 PolarHBondContact N-O 2.57Å; L412-F425 PolarHBondContact O-N 3.46Å; Y414-F425 HydrophobicContact CE1-CB 4Å; F425-F427 HydrophobicContact CD1-CD1 4.16Å; F425-F427 HydrophobicContact CD1-CE1 4.3Å; F425-F427 AromaticContact CE1-CD1 3.92Å; F425-F427 HydrophobicContact CE1-CD1 3.92Å; F425-F427 HydrophobicContact CE1-CE1 4.3Å; F425-R430 HydrophobicContact CZ-CB 4.41Å; F425-L432 HydrophobicContact CB-CD1 3.92Å; F425-L432 HydrophobicContact CD2-CB 4.44Å; F425-L432 HydrophobicContact CD2-CD1 4.23Å
426	D	97.8	Very high	97.5	Very high	29 Å²	29	55.3 Å²	55.3	16%	0.155	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	120.8	177	176.9	-33.2	0	0	0	110	R428 T429 R430 R431	D426-R428 VanDerWaalsContact C-N 3.31Å; D426-R428 PolarHBondContact O-N 3.48Å; D426-R428 WeakPolarHBondContact OD1-CA 3.33Å; D426-R428 WeakPolarHBondContact OD1-CB 3.04Å; D426-R428 PolarHBondContact OD1-N 2.83Å; D426-T429 VanDerWaalsContact CB-OG1 3.3Å; D426-T429 WeakPolarHBondContact CB-OG1 3.42Å; D426-T429 PolarHBondContact OD1-N 2.95Å; D426-T429 PolarHBondContact OD1-OG1 2.81Å; D426-T429 WeakPolarHBondContact OD2-CG2 3.37Å; D426-T429 PolarHBondContact OD2-OG1 3.49Å; D426-R430 WeakPolarHBondContact O-CA 3.3Å; D426-R430 PolarHBondContact O-N 2.84Å; D426-R431 PolarHBondContact N-O 3.35Å
427	F	96.6	Very high	97.5	Very high	12 Å²	12	54.4 Å²	54.4	5%	0.053	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-31.8	-176.9	-73	-69.1	0	0	0	113.3	W367 V394 V407 G410 L412 F425 R430	W367-F427 AromaticContact CD1-CE1 3.65Å; W367-F427 AromaticContact CD1-CE2 3.9Å; W367-F427 AromaticContact CD1-CZ 3.36Å; W367-F427 HydrophobicContact CD2-CE2 4.24Å; W367-F427 HydrophobicContact CD2-CZ 4.38Å; W367-F427 AromaticContact CE2-CE2 3.86Å; W367-F427 HydrophobicContact CG-CE2 4.23Å; W367-F427 AromaticContact CG-CZ 3.9Å; W367-F427 HydrophobicContact CG-CZ 3.9Å; W367-F427 HydrophobicContact CZ2-CD2 4.32Å; W367-F427 HydrophobicContact CZ2-CE2 4.41Å; W367-F427 AromaticContact NE1-CD1 3.97Å; W367-F427 AromaticContact NE1-CD2 3.95Å; W367-F427 AromaticContact NE1-CE1 3.69Å; W367-F427 AromaticContact NE1-CE2 3.66Å; W367-F427 AromaticContact NE1-CZ 3.51Å; V394-F427 HydrophobicContact CG1-CD1 4Å; V394-F427 HydrophobicContact CG1-CE1 4.06Å; V407-F427 HydrophobicContact CG1-CE2 4.06Å; V407-F427 HydrophobicContact CG2-CE2 4.03Å; V407-F427 HydrophobicContact CG2-CZ 4.4Å; G410-F427 WeakPolarHBondContact O-CD2 3.34Å; G410-F427 PolarHBondContact O-N 2Å; G410-F427 VanDerWaalsContact O-N 3.09Å; L412-F427 HydrophobicContact CB-CE2 3.84Å; L412-F427 HydrophobicContact CB-CZ 3.66Å; L412-F427 HydrophobicContact CG-CZ 4.49Å; F425-F427 HydrophobicContact CD1-CD1 4.16Å; F425-F427 HydrophobicContact CD1-CE1 4.3Å; F425-F427 AromaticContact CE1-CD1 3.92Å; F425-F427 HydrophobicContact CE1-CD1 3.92Å; F425-F427 HydrophobicContact CE1-CE1 4.3Å; F427-R430 WeakPolarHBondContact O-CD 3.34Å; F427-R430 PolarHBondContact O-NE 3.16Å; F427-R430 VanDerWaalsContact O-NE 3.12Å
428	R	95.4	Very high	97.4	Very high	220 Å²	220	57.9 Å²	57.9	83%	0.83	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-51.9	-177.4	179.6	178.6	61.3	-164.7	-3.8	111.4	D426 R430	D426-R428 VanDerWaalsContact C-N 3.31Å; D426-R428 PolarHBondContact O-N 3.48Å; D426-R428 WeakPolarHBondContact OD1-CA 3.33Å; D426-R428 WeakPolarHBondContact OD1-CB 3.04Å; D426-R428 PolarHBondContact OD1-N 2.83Å; R428-R430 VanDerWaalsContact C-N 3.3Å
429	T	96.9	Very high	97.3	Very high	64 Å²	64	61.7 Å²	61.7	39%	0.393	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-11.8	-177.7	67.2	0	0	0	0	112.6	D426 R431	D426-T429 VanDerWaalsContact CB-OG1 3.3Å; D426-T429 WeakPolarHBondContact CB-OG1 3.42Å; D426-T429 PolarHBondContact OD1-N 2.95Å; D426-T429 PolarHBondContact OD1-OG1 2.81Å; D426-T429 WeakPolarHBondContact OD2-CG2 3.37Å; D426-T429 PolarHBondContact OD2-OG1 3.49Å; T429-R431 PolarHBondContact O-N 2.82Å; T429-R431 VanDerWaalsContact O-N 3.13Å; T429-R431 PolarHBondContact OG1-N 2.98Å
430	R	96.5	Very high	97.4	Very high	106 Å²	106	59.8 Å²	59.8	40%	0.4	28%	0.276	S	S	.	.			trans	57.3	19.8	-174.2	-57.2	-66.9	-178	137.5	-0.7	112.9	V394 R397 F425 D426 F427 R428	V394-R430 VanDerWaalsContact CG1-NH1 3.25Å; R397-R430 PolarHBondContact NE-O 3.26Å; R397-R430 PolarHBondContact NH2-O 3.29Å; F425-R430 HydrophobicContact CZ-CB 4.41Å; D426-R430 WeakPolarHBondContact O-CA 3.3Å; D426-R430 PolarHBondContact O-N 2.84Å; F427-R430 WeakPolarHBondContact O-CD 3.34Å; F427-R430 PolarHBondContact O-NE 3.16Å; F427-R430 VanDerWaalsContact O-NE 3.12Å; R428-R430 VanDerWaalsContact C-N 3.3Å
431	R	97.2	Very high	97.4	Very high	164 Å²	164	61 Å²	61	62%	0.619	28%	0.281	S	S	*	.			trans	-87.4	138.4	-179.4	-69.7	-174.2	175.1	-168.9	-0.5	110.8	D426 T429	D426-R431 PolarHBondContact N-O 3.35Å; T429-R431 PolarHBondContact O-N 2.82Å; T429-R431 VanDerWaalsContact O-N 3.13Å; T429-R431 PolarHBondContact OG1-N 2.98Å
432	L	98.1	Very high	97.2	Very high	42 Å²	42	62.2 Å²	62.2	22%	0.22	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	125	175.3	-174.7	72.4	0	0	0	109.5	R397 K398 Y414 A423 F425 T434	R397-L432 HydrophobicContact CB-CD2 4.35Å; K398-L432 HydrophobicContact CB-CD2 4.33Å; K398-L432 HydrophobicContact CG-CD2 3.55Å; Y414-L432 HydrophobicContact CE1-CD1 4.22Å; A423-L432 HydrophobicContact CB-CD1 3.66Å; F425-L432 HydrophobicContact CB-CD1 3.92Å; F425-L432 HydrophobicContact CD2-CB 4.44Å; F425-L432 HydrophobicContact CD2-CD1 4.23Å; L432-T434 HydrophobicContact CD2-CG2 4.48Å; L432-T434 HydrophobicContact CG-CG2 4.41Å
433	H	98.1	Very high	96.9	Very high	74 Å²	74	65.3 Å²	65.3	34%	0.343	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	150.3	170.3	-56.7	66.3	0	0	0	108.2	A423 R424 F487	A423-H433 CarbonylContact C-O 3.53Å; A423-H433 WeakPolarHBondContact CA-O 3.31Å; R424-H433 HydrophobicContact CB-CB 4.39Å; R424-H433 PolarHBondContact N-O 2.76Å; R424-H433 PolarHBondContact O-N 2.86Å; H433-F487 HydrophobicContact CB-CD1 3.95Å; H433-F487 HydrophobicContact CB-CE1 4.35Å
434	T	98.4	Very high	96.5	Very high	87 Å²	87	72.2 Å²	72.2	53%	0.534	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	144.9	-175	56.4	0	0	0	0	110.9	I416 T421 I422 L432	I416-T434 HydrophobicContact CD1-CG2 3.73Å; T421-T434 HydrophobicContact CG2-CG2 4.34Å; I422-T434 CarbonylContact O-C 3.49Å; I422-T434 WeakPolarHBondContact O-CA 3.2Å; L432-T434 HydrophobicContact CD2-CG2 4.48Å; L432-T434 HydrophobicContact CG-CG2 4.41Å
435	L	98.5	Very high	96.2	Very high	25 Å²	25	76.2 Å²	76.2	13%	0.131	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	118.5	178.4	175.1	61.4	0	0	0	108.9	T421 I422 I437 L482 F487 V489	T421-L435 CarbonylContact C-O 3.59Å; T421-L435 WeakPolarHBondContact CA-O 3.18Å; T421-L435 WeakPolarHBondContact CG2-O 3.19Å; I422-L435 PolarHBondContact N-O 2.87Å; I422-L435 PolarHBondContact O-N 2.79Å; L435-I437 HydrophobicContact CD2-CD1 4.09Å; L435-I437 HydrophobicContact CG-CD1 3.98Å; L435-L482 HydrophobicContact CD2-CD2 3.88Å; L435-F487 HydrophobicContact CB-CD1 4.02Å; L435-F487 HydrophobicContact CB-CE1 3.59Å; L435-F487 HydrophobicContact CB-CE2 4.37Å; L435-F487 HydrophobicContact CB-CZ 3.78Å; L435-F487 HydrophobicContact CD2-CE2 4.37Å; L435-V489 HydrophobicContact CD2-CG2 4.07Å
436	Y	98.3	Very high	96.1	Very high	134 Å²	134	77 Å²	77	53%	0.525	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	139.8	174.2	-175.4	-96.7	0	0	0	110.3	D438	Y436-D438 WeakPolarHBondContact CD1-OD1 2.98Å; Y436-D438 WeakPolarHBondContact CE1-OD1 3.29Å
437	I	98.1	Very high	96.1	Very high	0 Å²	0	76.7 Å²	76.7	0%	0	37%	0.365	C	S	.	.			trans	-115.4	116.3	179.5	-52	-62.9	0	0	0	109	S420 I422 L435 A440 F456 L467 F469 V489	S420-I437 PolarHBondContact O-N 3.45Å; S420-I437 PolarHBondContact OG-O 2.87Å; I422-I437 HydrophobicContact CG1-CD1 4.31Å; I422-I437 HydrophobicContact CG1-CG1 3.87Å; L435-I437 HydrophobicContact CD2-CD1 4.09Å; L435-I437 HydrophobicContact CG-CD1 3.98Å; I437-A440 HydrophobicContact CB-CB 4.4Å; I437-A440 HydrophobicContact CG2-CB 3.9Å; I437-F456 HydrophobicContact CB-CE1 4.07Å; I437-F456 HydrophobicContact CG1-CE1 4.22Å; I437-F456 HydrophobicContact CG2-CE1 4.15Å; I437-L467 HydrophobicContact CD1-CD2 3.44Å; I437-L467 VanDerWaalsContact CD1-CD2 3.44Å; I437-L467 HydrophobicContact CG1-CD2 3.67Å; I437-L467 HydrophobicContact CG2-CD2 4.38Å; I437-F469 HydrophobicContact CG2-CD1 4.45Å; I437-F469 HydrophobicContact CG2-CD2 4.28Å; I437-F469 HydrophobicContact CG2-CE1 4.23Å; I437-F469 HydrophobicContact CG2-CE2 4.02Å; I437-F469 HydrophobicContact CG2-CG 4.47Å; I437-F469 HydrophobicContact CG2-CZ 4Å; I437-V489 HydrophobicContact CD1-CG2 4.07Å
438	D	94.4	Very high	96.2	Very high	93 Å²	93	76.1 Å²	76.1	50%	0.497	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	146.7	177.7	-64.4	-48.8	0	0	0	112	Y436 A440	Y436-D438 WeakPolarHBondContact CD1-OD1 2.98Å; Y436-D438 WeakPolarHBondContact CE1-OD1 3.29Å; D438-A440 PolarHBondContact O-N 2.81Å; D438-A440 VanDerWaalsContact O-N 3.12Å
439	N	93.4	Very high	96.3	Very high	128 Å²	128	65.7 Å²	65.7	68%	0.684	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	32.8	172.9	-58.7	-39.9	0	0	0	114.9	S471 G472	N439-S471 CarbonylContact O-C 3.46Å; N439-G472 PolarHBondContact O-N 3.35Å
440	A	97.6	Very high	96.3	Very high	9 Å²	9	66.7 Å²	66.7	7%	0.074	33%	0.329	C	S	.	.	B	Isolated β-bridge	trans	-101.6	147.8	175.5	0	0	0	0	0	112	I437 D438 F442 F456 F469 A470	I437-A440 HydrophobicContact CB-CB 4.4Å; I437-A440 HydrophobicContact CG2-CB 3.9Å; D438-A440 PolarHBondContact O-N 2.81Å; D438-A440 VanDerWaalsContact O-N 3.12Å; A440-F442 WeakPolarHBondContact O-CD1 3.27Å; A440-F456 HydrophobicContact CB-CE1 3.49Å; A440-F456 VanDerWaalsContact CB-CE1 3.49Å; A440-F456 HydrophobicContact CB-CZ 3.55Å; A440-F469 HydrophobicContact CB-CD2 3.4Å; A440-F469 HydrophobicContact CB-CE2 3.86Å; A440-F469 HydrophobicContact CB-CG 4.24Å; A440-A470 WeakPolarHBondContact CA-O 3.12Å
441	L	97.1	Very high	96.2	Very high	28 Å²	28	64.3 Å²	64.3	15%	0.147	32%	0.324	C	S	.	.			trans	-79.1	129.2	169.2	-68.4	178.6	0	0	0	110.6	A470 E475	L441-A470 HydrophobicContact CB-CB 4.31Å; L441-A470 HydrophobicContact CD1-CB 3.92Å; L441-A470 HydrophobicContact CG-CB 4.4Å; L441-A470 PolarHBondContact N-O 3.11Å; L441-E475 HydrophobicContact CD1-CG 4.3Å
442	F	95.3	Very high	96.2	Very high	51 Å²	51	56.5 Å²	56.5	22%	0.224	30%	0.295	C	S	.	.			trans	-145.3	-2.2	-175.1	67.5	-92.3	0	0	0	115.7	G418 T419 S420 A440 Y455 F456	G418-F442 WeakPolarHBondContact O-CE2 3.3Å; T419-F442 WeakPolarHBondContact O-CB 3.47Å; S420-F442 VanDerWaalsContact CB-CD1 3.49Å; A440-F442 WeakPolarHBondContact O-CD1 3.27Å; F442-Y455 VanDerWaalsContact C-CE1 3.43Å; F442-Y455 VanDerWaalsContact CA-CD1 3.45Å; F442-F456 HydrophobicContact CB-CE2 3.73Å; F442-F456 HydrophobicContact CB-CZ 4.17Å
443	N	91.1	Very high	96.1	Very high	66 Å²	66	56.1 Å²	56.1	35%	0.353	29%	0.292	S	S	.	.	S	Bend	trans	-140.7	-171.6	-175.5	65.2	13.2	0	0	0	111.6	L445 S446 Y455	N443-L445 PolarHBondContact O-N 2.58Å; N443-S446 PolarHBondContact O-N 3.36Å; N443-S446 PolarHBondContact O-OG 3.37Å; N443-Y455 PolarHBondContact O-OH 2.82Å
444	N	91.3	Very high	96.1	Very high	145 Å²	145	52.7 Å²	52.7	78%	0.775	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	27.8	173.7	-63.2	-16.7	0	0	0	115.6	S446	N444-S446 PolarHBondContact O-N 2.87Å; N444-S446 VanDerWaalsContact O-N 3.13Å
445	L	92.8	Very high	96.2	Very high	122 Å²	122	48.8 Å²	48.8	64%	0.639	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.4	18.2	-176.7	-49	173.7	0	0	0	113.5	N443 Y447 Y455	N443-L445 PolarHBondContact O-N 2.58Å; L445-Y447 HydrophobicContact CB-CD2 4.48Å; L445-Y447 HydrophobicContact CB-CE2 3.9Å; L445-Y447 HydrophobicContact CD2-CE2 3.92Å; L445-Y447 WeakPolarHBondContact CD2-OH 3.26Å; L445-Y447 WeakPolarHBondContact O-CD2 2.96Å; L445-Y447 PolarHBondContact O-N 2.95Å; L445-Y455 VanDerWaalsContact CA-OH 3.32Å; L445-Y455 WeakPolarHBondContact CA-OH 3.27Å; L445-Y455 PolarHBondContact N-OH 2.9Å
446	S	95.1	Very high	96.2	Very high	19 Å²	19	47.8 Å²	47.8	13%	0.133	25%	0.246	C	C	.	.			trans	-82.2	57.2	178.7	71.6	0	0	0	0	111.2	N443 N444 Y455	N443-S446 PolarHBondContact O-N 3.36Å; N443-S446 PolarHBondContact O-OG 3.37Å; N444-S446 PolarHBondContact O-N 2.87Å; N444-S446 VanDerWaalsContact O-N 3.13Å; S446-Y455 WeakPolarHBondContact O-CD1 3.44Å; S446-Y455 WeakPolarHBondContact O-CE1 3.22Å
447	Y	97.9	Very high	96.2	Very high	21 Å²	21	41.6 Å²	41.6	8%	0.082	22%	0.222	C	C	.	.			trans	-61.2	146	-175.1	-59.5	-69.8	0	0	0	112.4	L445 K453 Y455 R499	L445-Y447 HydrophobicContact CB-CD2 4.48Å; L445-Y447 HydrophobicContact CB-CE2 3.9Å; L445-Y447 HydrophobicContact CD2-CE2 3.92Å; L445-Y447 WeakPolarHBondContact CD2-OH 3.26Å; L445-Y447 WeakPolarHBondContact O-CD2 2.96Å; L445-Y447 PolarHBondContact O-N 2.95Å; Y447-K453 HydrophobicContact CD1-CB 4.25Å; Y447-K453 WeakPolarHBondContact CD1-O 3.06Å; Y447-K453 HydrophobicContact CE1-CB 3.72Å; Y447-K453 HydrophobicContact CE1-CG 4.4Å; Y447-K453 WeakPolarHBondContact CE1-O 3.09Å; Y447-K453 HydrophobicContact CE2-CG 4.4Å; Y447-Y455 HydrophobicContact CD1-CD1 4.15Å; Y447-Y455 AromaticContact CD1-CD2 3.85Å; Y447-Y455 HydrophobicContact CD1-CD2 3.85Å; Y447-Y455 AromaticContact CD1-CE1 3.81Å; Y447-Y455 HydrophobicContact CD1-CE1 3.81Å; Y447-Y455 AromaticContact CD1-CE2 3.46Å; Y447-Y455 HydrophobicContact CD1-CE2 3.46Å; Y447-Y455 VanDerWaalsContact CD1-CE2 3.46Å; Y447-Y455 HydrophobicContact CD1-CG 4.17Å; Y447-Y455 AromaticContact CD1-CZ 3.44Å; Y447-Y455 VanDerWaalsContact CD1-CZ 3.44Å; Y447-Y455 HydrophobicContact CE1-CD2 4.02Å; Y447-Y455 HydrophobicContact CE1-CE1 4.24Å; Y447-Y455 AromaticContact CE1-CE2 3.28Å; Y447-Y455 HydrophobicContact CE1-CE2 3.28Å; Y447-Y455 AromaticContact CE1-CZ 3.41Å; Y447-Y455 VanDerWaalsContact CE1-CZ 3.41Å; Y447-Y455 WeakPolarHBondContact CE1-OH 3.06Å; Y447-Y455 HydrophobicContact CG-CE1 4.36Å; Y447-R499 PolarHBondContact O-NH1 2.76Å
448	L	98.4	Very high	96.2	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.005	22%	0.222	C	C	.	.	S	Bend	trans	-63.7	-49.2	161.9	167.9	72.3	0	0	0	109.3	T454 Y455 K457 I468 A470 I477 R499	L448-T454 WeakPolarHBondContact CB-O 3.47Å; L448-T454 PolarHBondContact N-O 2.86Å; L448-Y455 WeakPolarHBondContact CB-O 3.33Å; L448-K457 HydrophobicContact CD2-CB 4.31Å; L448-I468 HydrophobicContact CD1-CG2 4.45Å; L448-I468 HydrophobicContact CD2-CB 4.23Å; L448-I468 HydrophobicContact CD2-CG2 3.83Å; L448-I468 WeakPolarHBondContact CD2-O 3.39Å; L448-A470 HydrophobicContact CB-CB 4.26Å; L448-A470 HydrophobicContact CD1-CB 4Å; L448-I477 HydrophobicContact CD1-CB 4.48Å; L448-I477 HydrophobicContact CD1-CD1 4.23Å; L448-I477 HydrophobicContact CD1-CG1 3.81Å; L448-I477 HydrophobicContact CD1-CG2 4.28Å; L448-R499 HydrophobicContact CD1-CB 4.46Å
449	L	98.1	Very high	96.4	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	20%	0.2	C	C	.	.	B	Isolated β-bridge	trans	-122.4	98.7	-178.7	-52.6	176.1	0	0	0	109.2	N451 S452 K453 T454 K457 A502 N504	L449-N451 VanDerWaalsContact C-N 3.33Å; L449-N451 PolarHBondContact O-N 3.11Å; L449-S452 WeakPolarHBondContact CB-OG 3.41Å; L449-S452 PolarHBondContact O-N 3.02Å; L449-S452 PolarHBondContact O-OG 2.89Å; L449-K453 PolarHBondContact O-N 2.79Å; L449-K453 VanDerWaalsContact O-N 3.12Å; L449-T454 PolarHBondContact N-O 3.32Å; L449-T454 PolarHBondContact O-N 2.81Å; L449-T454 VanDerWaalsContact O-N 3.08Å; L449-K457 HydrophobicContact CD1-CD 3.83Å; L449-A502 HydrophobicContact CD2-CB 4.2Å; L449-N504 WeakPolarHBondContact CD1-OD1 3.47Å
450	T	96.4	Very high	96.5	Very high	84 Å²	84	31.4 Å²	31.4	52%	0.515	17%	0.168	S	C	.	.	G	3₁₀ helix	trans	-61.4	-41.2	-175.6	-54.5	0	0	0	0	112.2	S452 K453	T450-S452 PolarHBondContact O-N 3.34Å; T450-K453 PolarHBondContact O-N 3.38Å; T450-K453 VanDerWaalsContact O-N 3.14Å
451	N	95.2	Very high	96.4	Very high	56 Å²	56	31.4 Å²	31.4	30%	0.299	17%	0.167	S	C	.	.	G	3₁₀ helix	trans	-60.9	-30.4	-175.7	-67.2	-4.2	0	0	0	113	F351 L449 T517 D519	F351-N451 WeakPolarHBondContact CE1-O 3.47Å; L449-N451 VanDerWaalsContact C-N 3.33Å; L449-N451 PolarHBondContact O-N 3.11Å; N451-T517 PolarHBondContact ND2-O 3.18Å; N451-D519 PolarHBondContact ND2-OD2 2.83Å
452	S	96.6	Very high	96.1	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.007	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-108.9	5.6	-179.7	60.1	0	0	0	0	113.8	L449 T450 T454 A548	L449-S452 WeakPolarHBondContact CB-OG 3.41Å; L449-S452 PolarHBondContact O-N 3.02Å; L449-S452 PolarHBondContact O-OG 2.89Å; T450-S452 PolarHBondContact O-N 3.34Å; S452-T454 PolarHBondContact O-N 3.34Å; S452-T454 PolarHBondContact O-OG1 3.37Å; S452-T454 WeakPolarHBondContact OG-CB 3.2Å; S452-T454 PolarHBondContact OG-OG1 2.9Å; S452-A548 WeakPolarHBondContact CB-O 3.28Å
453	K	96.7	Very high	96	Very high	34 Å²	34	35 Å²	35	15%	0.148	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.8	37.3	-174.6	-61.3	168	175.2	164.6	0	112.8	Y171 F372 G402 Y447 L449 T450	Y171-K453 PolarHBondContact OH-NZ 2.94Å; F372-K453 HydrophobicContact CB-CB 4.35Å; F372-K453 HydrophobicContact CB-CD 4.25Å; F372-K453 HydrophobicContact CD1-CD 3.68Å; F372-K453 HydrophobicContact CD2-CD 3.83Å; F372-K453 HydrophobicContact CE1-CD 3.97Å; F372-K453 HydrophobicContact CE2-CD 4.12Å; F372-K453 HydrophobicContact CG-CB 4.49Å; F372-K453 HydrophobicContact CG-CD 3.62Å; F372-K453 HydrophobicContact CZ-CD 4.19Å; G402-K453 VanDerWaalsContact CA-O 3.25Å; G402-K453 WeakPolarHBondContact CA-O 3.43Å; Y447-K453 HydrophobicContact CD1-CB 4.25Å; Y447-K453 WeakPolarHBondContact CD1-O 3.06Å; Y447-K453 HydrophobicContact CE1-CB 3.72Å; Y447-K453 HydrophobicContact CE1-CG 4.4Å; Y447-K453 WeakPolarHBondContact CE1-O 3.09Å; Y447-K453 HydrophobicContact CE2-CG 4.4Å; L449-K453 PolarHBondContact O-N 2.79Å; L449-K453 VanDerWaalsContact O-N 3.12Å; T450-K453 PolarHBondContact O-N 3.38Å; T450-K453 VanDerWaalsContact O-N 3.14Å
454	T	98.5	Very high	96.1	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.006	18%	0.181	C	C	.	.	B	Isolated β-bridge	trans	-103.5	126.8	-173.5	-59.9	0	0	0	0	110.6	C403 L448 L449 S452 F456 K457	C403-T454 PolarHBondContact N-OG1 2.86Å; L448-T454 WeakPolarHBondContact CB-O 3.47Å; L448-T454 PolarHBondContact N-O 2.86Å; L449-T454 PolarHBondContact N-O 3.32Å; L449-T454 PolarHBondContact O-N 2.81Å; L449-T454 VanDerWaalsContact O-N 3.08Å; S452-T454 PolarHBondContact O-N 3.34Å; S452-T454 PolarHBondContact O-OG1 3.37Å; S452-T454 WeakPolarHBondContact OG-CB 3.2Å; S452-T454 PolarHBondContact OG-OG1 2.9Å; T454-F456 WeakPolarHBondContact CG2-O 3.4Å; T454-K457 HydrophobicContact CG2-CB 4.25Å
455	Y	98.6	Very high	96.4	Very high	6 Å²	6	26.4 Å²	26.4	2%	0.024	15%	0.146	C	C	.	.	S	Bend	trans	-91	-40.1	172.2	-67.5	-81.4	0	0	0	112.3	Q401 H415 F442 N443 L445 S446 Y447 L448	Q401-Y455 HydrophobicContact CG-CD2 4.4Å; Q401-Y455 HydrophobicContact CG-CE2 4.43Å; H415-Y455 AromaticContact CE1-CD2 3.78Å; F442-Y455 VanDerWaalsContact C-CE1 3.43Å; F442-Y455 VanDerWaalsContact CA-CD1 3.45Å; N443-Y455 PolarHBondContact O-OH 2.82Å; L445-Y455 VanDerWaalsContact CA-OH 3.32Å; L445-Y455 WeakPolarHBondContact CA-OH 3.27Å; L445-Y455 PolarHBondContact N-OH 2.9Å; S446-Y455 WeakPolarHBondContact O-CD1 3.44Å; S446-Y455 WeakPolarHBondContact O-CE1 3.22Å; Y447-Y455 HydrophobicContact CD1-CD1 4.15Å; Y447-Y455 AromaticContact CD1-CD2 3.85Å; Y447-Y455 HydrophobicContact CD1-CD2 3.85Å; Y447-Y455 AromaticContact CD1-CE1 3.81Å; Y447-Y455 HydrophobicContact CD1-CE1 3.81Å; Y447-Y455 AromaticContact CD1-CE2 3.46Å; Y447-Y455 HydrophobicContact CD1-CE2 3.46Å; Y447-Y455 VanDerWaalsContact CD1-CE2 3.46Å; Y447-Y455 HydrophobicContact CD1-CG 4.17Å; Y447-Y455 AromaticContact CD1-CZ 3.44Å; Y447-Y455 VanDerWaalsContact CD1-CZ 3.44Å; Y447-Y455 HydrophobicContact CE1-CD2 4.02Å; Y447-Y455 HydrophobicContact CE1-CE1 4.24Å; Y447-Y455 AromaticContact CE1-CE2 3.28Å; Y447-Y455 HydrophobicContact CE1-CE2 3.28Å; Y447-Y455 AromaticContact CE1-CZ 3.41Å; Y447-Y455 VanDerWaalsContact CE1-CZ 3.41Å; Y447-Y455 WeakPolarHBondContact CE1-OH 3.06Å; Y447-Y455 HydrophobicContact CG-CE1 4.36Å; L448-Y455 WeakPolarHBondContact CB-O 3.33Å
456	F	98.7	Very high	96.7	Very high	3 Å²	3	20.7 Å²	20.7	1%	0.013	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	133	-177.4	-64.2	-88.6	0	0	0	109.6	H415 I422 I437 A440 F442 T454 L467 I468 F469	H415-F456 HydrophobicContact CB-CB 4.15Å; H415-F456 HydrophobicContact CB-CD2 4.14Å; H415-F456 AromaticContact CD2-CD2 3.31Å; H415-F456 WeakPolarHBondContact CD2-CD2 3.42Å; H415-F456 AromaticContact CD2-CE2 3.59Å; H415-F456 AromaticContact CE1-CD2 3.85Å; H415-F456 AromaticContact CG-CD2 3.5Å; H415-F456 AromaticContact ND1-CD2 3.83Å; H415-F456 AromaticContact NE2-CD2 3.55Å; H415-F456 AromaticContact NE2-CE2 3.48Å; H415-F456 WeakPolarHBondContact NE2-CE2 3.3Å; I422-F456 HydrophobicContact CD1-CB 3.55Å; I422-F456 HydrophobicContact CD1-CD1 3.69Å; I422-F456 HydrophobicContact CD1-CD2 4.12Å; I422-F456 HydrophobicContact CD1-CE1 4.38Å; I422-F456 HydrophobicContact CD1-CG 3.53Å; I437-F456 HydrophobicContact CB-CE1 4.07Å; I437-F456 HydrophobicContact CG1-CE1 4.22Å; I437-F456 HydrophobicContact CG2-CE1 4.15Å; A440-F456 HydrophobicContact CB-CE1 3.49Å; A440-F456 VanDerWaalsContact CB-CE1 3.49Å; A440-F456 HydrophobicContact CB-CZ 3.55Å; F442-F456 HydrophobicContact CB-CE2 3.73Å; F442-F456 HydrophobicContact CB-CZ 4.17Å; T454-F456 WeakPolarHBondContact CG2-O 3.4Å; F456-L467 HydrophobicContact CB-CD1 3.97Å; F456-L467 HydrophobicContact CD1-CD1 4.08Å; F456-L467 HydrophobicContact CD1-CD2 4.31Å; F456-L467 HydrophobicContact CD1-CG 4.47Å; F456-L467 HydrophobicContact CG-CD1 4.49Å; F456-I468 WeakPolarHBondContact CA-O 3.22Å; F456-F469 HydrophobicContact CD1-CB 3.54Å; F456-F469 HydrophobicContact CD1-CG 4.35Å; F456-F469 HydrophobicContact CE1-CB 3.8Å; F456-F469 HydrophobicContact CE1-CG 4.29Å; F456-F469 HydrophobicContact CG-CB 4.48Å
457	K	98.6	Very high	96.8	Very high	5 Å²	5	19.8 Å²	19.8	2%	0.022	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	116.3	179.1	-179.9	164	-165.2	163.2	0	111	L448 L449 T454 I468 N504 A505 L550	L448-K457 HydrophobicContact CD2-CB 4.31Å; L449-K457 HydrophobicContact CD1-CD 3.83Å; T454-K457 HydrophobicContact CG2-CB 4.25Å; K457-I468 HydrophobicContact CB-CB 4.22Å; K457-I468 HydrophobicContact CB-CD1 4.49Å; K457-I468 HydrophobicContact CD-CD1 4.41Å; K457-I468 HydrophobicContact CG-CD1 4.3Å; K457-I468 PolarHBondContact N-O 2.63Å; K457-I468 PolarHBondContact O-N 3.27Å; K457-N504 PolarHBondContact NZ-OD1 3.31Å; K457-A505 VanDerWaalsContact CD-O 3.31Å; K457-A505 WeakPolarHBondContact CD-O 3.44Å; K457-A505 WeakPolarHBondContact CE-O 3.45Å; K457-A505 PolarHBondContact NZ-O 3.19Å; K457-L550 VanDerWaalsContact CE-O 3.27Å; K457-L550 WeakPolarHBondContact CE-O 3.39Å; K457-L550 PolarHBondContact NZ-O 3.39Å
458	M	98.3	Very high	96.9	Very high	2 Å²	2	18.8 Å²	18.8	1%	0.01	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	145	170.7	-60.7	-60.5	-52.3	0	0	109.9	G404 T406 Y413 I422 L465 L467 L482	G404-M458 WeakPolarHBondContact O-CB 3.4Å; G404-M458 PolarHBondContact O-N 2.92Å; T406-M458 WeakPolarHBondContact OG1-CB 3.4Å; T406-M458 PolarHBondContact OG1-O 3.38Å; Y413-M458 HydrophobicContact CD1-CE 3.95Å; Y413-M458 HydrophobicContact CG-CE 3.98Å; I422-M458 HydrophobicContact CG2-SD 3.8Å; M458-L465 HydrophobicContact CE-CD1 3.92Å; M458-L465 HydrophobicContact CE-CD2 3.98Å; M458-L465 HydrophobicContact CE-CG 3.9Å; M458-L467 HydrophobicContact SD-CB 4.35Å; M458-L467 HydrophobicContact SD-CD1 3.55Å; M458-L467 VanDerWaalsContact SD-CD1 3.55Å; M458-L482 HydrophobicContact CE-CD1 3.66Å
459	A	98.1	Very high	96.9	Very high	4 Å²	4	18.7 Å²	18.7	3%	0.033	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	142.1	169.3	0	0	0	0	0	109.4	W466 I507	A459-W466 HydrophobicContact CB-CB 4.48Å; A459-W466 PolarHBondContact N-O 2.83Å; A459-W466 PolarHBondContact O-N 2.81Å; A459-I507 HydrophobicContact CB-CB 4.03Å; A459-I507 HydrophobicContact CB-CD1 4.15Å; A459-I507 HydrophobicContact CB-CG1 4.33Å
460	A	96.1	Very high	96.9	Very high	1 Å²	1	18.7 Å²	18.7	1%	0.008	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	136.7	171.4	0	0	0	0	0	108.5	T358 T406 H408 G464 L465 P554	T358-A460 HydrophobicContact CG2-CB 4.37Å; T358-A460 WeakPolarHBondContact OG1-CB 3.42Å; T406-A460 HydrophobicContact CG2-CB 4.38Å; H408-A460 HydrophobicContact CB-CB 4.48Å; A460-G464 WeakPolarHBondContact CA-O 3.43Å; A460-L465 HydrophobicContact CB-CD1 3.95Å; A460-P554 WeakPolarHBondContact O-CD 3.39Å
461	D	95.1	Very high	97	Very high	9 Å²	9	15 Å²	15	5%	0.048	8%	0.083	C	C	.	.			trans	-138.3	-165.6	178.4	83	-27.9	0	0	0	110.3	N463 G464 W466 I507 C509 G510 Y552	D461-N463 PolarHBondContact O-N 3.45Å; D461-N463 WeakPolarHBondContact OD1-CA 3.35Å; D461-N463 PolarHBondContact OD1-N 2.77Å; D461-N463 PolarHBondContact OD2-ND2 2.9Å; D461-G464 PolarHBondContact N-O 3.24Å; D461-G464 PolarHBondContact OD1-N 3.31Å; D461-W466 PolarHBondContact OD1-NE1 2.85Å; D461-I507 HydrophobicContact CB-CG2 4.23Å; D461-C509 PolarHBondContact OD2-N 3.16Å; D461-G510 WeakPolarHBondContact OD2-CA 3.29Å; D461-G510 PolarHBondContact OD2-N 2.69Å; D461-Y552 HydrophobicContact CB-CD1 4.42Å; D461-Y552 HydrophobicContact CB-CE1 4.47Å
462	E	92.2	Very high	97	Very high	86 Å²	86	14.5 Å²	14.5	40%	0.402	9%	0.09	S	C	.	.	S	Bend	trans	-65.1	-21.8	177.4	-58.9	78.7	-173.1	0	0	113.4	C509 Y552 P554	E462-C509 VanDerWaalsContact CD-SG 3.58Å; E462-C509 WeakPolarHBondContact OE2-CA 3.48Å; E462-C509 PolarHBondContact OE2-N 3.19Å; E462-C509 PolarHBondContact OE2-SG 2.81Å; E462-Y552 WeakPolarHBondContact OE1-CE1 3.37Å; E462-Y552 PolarHBondContact OE1-OH 2.85Å; E462-P554 HydrophobicContact CG-CB 4.01Å; E462-P554 WeakPolarHBondContact OE1-CB 3.44Å
463	N	93.3	Very high	96.9	Very high	68 Å²	68	18.8 Å²	18.8	36%	0.364	13%	0.126	S	C	.	.	S	Bend	trans	-103.9	-12.9	-172.5	-62.5	-82.4	0	0	0	113.2	D461 W466 G510	D461-N463 PolarHBondContact O-N 3.45Å; D461-N463 WeakPolarHBondContact OD1-CA 3.35Å; D461-N463 PolarHBondContact OD1-N 2.77Å; D461-N463 PolarHBondContact OD2-ND2 2.9Å; N463-W466 HydrophobicContact CB-CZ2 3.83Å; N463-G510 PolarHBondContact ND2-N 3.23Å
464	G	92.4	Very high	96.8	Very high	26 Å²	26	21.4 Å²	21.4	27%	0.268	14%	0.141	S	C	.	.			trans	148.8	-156.5	169.7	0	0	0	0	0	114.2	A460 D461 W466	A460-G464 WeakPolarHBondContact CA-O 3.43Å; D461-G464 PolarHBondContact N-O 3.24Å; D461-G464 PolarHBondContact OD1-N 3.31Å; G464-W466 PolarHBondContact O-NE1 2.58Å
465	L	97.3	Very high	96.6	Very high	5 Å²	5	25.6 Å²	25.6	3%	0.026	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	132.2	178.1	-170.8	69.8	0	0	0	109.6	Y413 M458 A460 L482	Y413-L465 HydrophobicContact CD1-CD2 3.91Å; Y413-L465 HydrophobicContact CE1-CD2 3.53Å; Y413-L465 HydrophobicContact CE2-CD2 4.38Å; Y413-L465 HydrophobicContact CG-CD2 4.46Å; M458-L465 HydrophobicContact CE-CD1 3.92Å; M458-L465 HydrophobicContact CE-CD2 3.98Å; M458-L465 HydrophobicContact CE-CG 3.9Å; A460-L465 HydrophobicContact CB-CD1 3.95Å; L465-L482 HydrophobicContact CB-CB 4.29Å; L465-L482 HydrophobicContact CD2-CB 4.17Å; L465-L482 HydrophobicContact CD2-CD1 3.96Å; L465-L482 HydrophobicContact CG-CB 4.32Å; L465-L482 HydrophobicContact CG-CD1 4.18Å; L465-L482 PolarHBondContact O-N 2.87Å
466	W	98.4	Very high	96.6	Very high	1 Å²	1	25.5 Å²	25.5	0%	0.004	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	148.6	-173.3	-48.5	92.6	0	0	0	110.5	A459 D461 N463 G464 V479 A480 Q481 I493 I507 L528 L529	A459-W466 HydrophobicContact CB-CB 4.48Å; A459-W466 PolarHBondContact N-O 2.83Å; A459-W466 PolarHBondContact O-N 2.81Å; D461-W466 PolarHBondContact OD1-NE1 2.85Å; N463-W466 HydrophobicContact CB-CZ2 3.83Å; G464-W466 PolarHBondContact O-NE1 2.58Å; W466-V479 HydrophobicContact CB-CG1 4.15Å; W466-V479 HydrophobicContact CE3-CG1 3.96Å; W466-A480 CarbonylContact C-O 3.57Å; W466-A480 WeakPolarHBondContact CA-O 3.18Å; W466-Q481 HydrophobicContact CE3-CB 3.89Å; W466-Q481 HydrophobicContact CE3-CG 4.01Å; W466-Q481 HydrophobicContact CH2-CG 4.05Å; W466-Q481 HydrophobicContact CZ3-CB 3.67Å; W466-Q481 HydrophobicContact CZ3-CG 3.67Å; W466-I493 HydrophobicContact CZ3-CD1 4.07Å; W466-I507 HydrophobicContact CB-CD1 3.46Å; W466-I507 VanDerWaalsContact CB-CD1 3.46Å; W466-I507 HydrophobicContact CD2-CD1 4.39Å; W466-I507 HydrophobicContact CG-CD1 3.7Å; W466-I507 HydrophobicContact CG-CG2 4.4Å; W466-L528 HydrophobicContact CD2-CD1 4.18Å; W466-L528 HydrophobicContact CE3-CD1 4.07Å; W466-L528 HydrophobicContact CH2-CB 4.43Å; W466-L528 HydrophobicContact CZ3-CB 4.34Å; W466-L528 HydrophobicContact CZ3-CD1 4.26Å; W466-L529 HydrophobicContact CH2-CD2 4.07Å
467	L	98.7	Very high	96.6	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	117.7	172.6	172.9	72.5	0	0	0	109.1	I422 I437 F456 M458 F469 V479 A480 L482	I422-L467 HydrophobicContact CD1-CD1 3.75Å; I422-L467 HydrophobicContact CD1-CD2 4.36Å; I422-L467 HydrophobicContact CG1-CD1 3.95Å; I422-L467 HydrophobicContact CG1-CD2 3.86Å; I437-L467 HydrophobicContact CD1-CD2 3.44Å; I437-L467 VanDerWaalsContact CD1-CD2 3.44Å; I437-L467 HydrophobicContact CG1-CD2 3.67Å; I437-L467 HydrophobicContact CG2-CD2 4.38Å; F456-L467 HydrophobicContact CB-CD1 3.97Å; F456-L467 HydrophobicContact CD1-CD1 4.08Å; F456-L467 HydrophobicContact CD1-CD2 4.31Å; F456-L467 HydrophobicContact CD1-CG 4.47Å; F456-L467 HydrophobicContact CG-CD1 4.49Å; M458-L467 HydrophobicContact SD-CB 4.35Å; M458-L467 HydrophobicContact SD-CD1 3.55Å; M458-L467 VanDerWaalsContact SD-CD1 3.55Å; L467-F469 HydrophobicContact CD2-CD1 4.23Å; L467-F469 HydrophobicContact CG-CD1 4.17Å; L467-V479 CarbonylContact O-C 3.56Å; L467-V479 VanDerWaalsContact O-CA 3.32Å; L467-V479 WeakPolarHBondContact O-CA 3.49Å; L467-A480 HydrophobicContact CB-CB 4.24Å; L467-A480 PolarHBondContact N-O 2.59Å; L467-A480 PolarHBondContact O-N 3.26Å; L467-L482 HydrophobicContact CB-CD1 4.16Å; L467-L482 HydrophobicContact CB-CG 4.39Å
468	I	98.8	Very high	96.6	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	129.6	175.3	-46.3	164.6	0	0	0	107.9	L448 F456 K457 I477 L478 V479 A505 I507 L512	L448-I468 HydrophobicContact CD1-CG2 4.45Å; L448-I468 HydrophobicContact CD2-CB 4.23Å; L448-I468 HydrophobicContact CD2-CG2 3.83Å; L448-I468 WeakPolarHBondContact CD2-O 3.39Å; F456-I468 WeakPolarHBondContact CA-O 3.22Å; K457-I468 HydrophobicContact CB-CB 4.22Å; K457-I468 HydrophobicContact CB-CD1 4.49Å; K457-I468 HydrophobicContact CD-CD1 4.41Å; K457-I468 HydrophobicContact CG-CD1 4.3Å; K457-I468 PolarHBondContact N-O 2.63Å; K457-I468 PolarHBondContact O-N 3.27Å; I468-I477 HydrophobicContact CG2-CG2 3.56Å; I468-L478 WeakPolarHBondContact CA-O 3.07Å; I468-V479 HydrophobicContact CG1-CG2 4.29Å; I468-V479 HydrophobicContact CG2-CG2 4.39Å; I468-A505 HydrophobicContact CD1-CB 4.19Å; I468-I507 HydrophobicContact CD1-CD1 3.97Å; I468-I507 HydrophobicContact CD1-CG1 4.18Å; I468-I507 HydrophobicContact CG1-CD1 3.91Å; I468-L512 HydrophobicContact CD1-CD1 3.6Å; I468-L512 HydrophobicContact CG1-CD1 4.18Å
469	F	98.7	Very high	96.6	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	165.9	179.5	67.1	-81.2	0	0	0	110.8	I437 A440 F456 L467 L478 A480 Y492	I437-F469 HydrophobicContact CG2-CD1 4.45Å; I437-F469 HydrophobicContact CG2-CD2 4.28Å; I437-F469 HydrophobicContact CG2-CE1 4.23Å; I437-F469 HydrophobicContact CG2-CE2 4.02Å; I437-F469 HydrophobicContact CG2-CG 4.47Å; I437-F469 HydrophobicContact CG2-CZ 4Å; A440-F469 HydrophobicContact CB-CD2 3.4Å; A440-F469 HydrophobicContact CB-CE2 3.86Å; A440-F469 HydrophobicContact CB-CG 4.24Å; F456-F469 HydrophobicContact CD1-CB 3.54Å; F456-F469 HydrophobicContact CD1-CG 4.35Å; F456-F469 HydrophobicContact CE1-CB 3.8Å; F456-F469 HydrophobicContact CE1-CG 4.29Å; F456-F469 HydrophobicContact CG-CB 4.48Å; L467-F469 HydrophobicContact CD2-CD1 4.23Å; L467-F469 HydrophobicContact CG-CD1 4.17Å; F469-L478 HydrophobicContact CD1-CB 4.26Å; F469-L478 HydrophobicContact CD2-CB 4.33Å; F469-L478 HydrophobicContact CE1-CB 3.8Å; F469-L478 HydrophobicContact CE2-CB 3.9Å; F469-L478 HydrophobicContact CE2-CD1 3.67Å; F469-L478 HydrophobicContact CE2-CG 4.33Å; F469-L478 HydrophobicContact CZ-CB 3.61Å; F469-L478 HydrophobicContact CZ-CD1 3.76Å; F469-L478 HydrophobicContact CZ-CG 4.32Å; F469-L478 PolarHBondContact N-O 2.69Å; F469-L478 PolarHBondContact O-N 3.08Å; F469-L478 VanDerWaalsContact O-O 3.13Å; F469-A480 HydrophobicContact CE1-CB 3.94Å; F469-Y492 HydrophobicContact CE1-CD1 4.03Å; F469-Y492 AromaticContact CE1-CE1 3.98Å; F469-Y492 HydrophobicContact CE1-CE1 3.98Å; F469-Y492 AromaticContact CZ-CD1 3.74Å; F469-Y492 HydrophobicContact CZ-CD1 3.74Å; F469-Y492 AromaticContact CZ-CE1 3.63Å; F469-Y492 HydrophobicContact CZ-CE1 3.63Å
470	A	98.4	Very high	96.6	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	133.5	176.7	0	0	0	0	0	110.6	A440 L441 L448 S476 R499	A440-A470 WeakPolarHBondContact CA-O 3.12Å; L441-A470 HydrophobicContact CB-CB 4.31Å; L441-A470 HydrophobicContact CD1-CB 3.92Å; L441-A470 HydrophobicContact CG-CB 4.4Å; L441-A470 PolarHBondContact N-O 3.11Å; L448-A470 HydrophobicContact CB-CB 4.26Å; L448-A470 HydrophobicContact CD1-CB 4Å; A470-S476 WeakPolarHBondContact CA-O 3.33Å; A470-R499 HydrophobicContact CB-CB 4.26Å
471	S	97.8	Very high	96.7	Very high	8 Å²	8	28.6 Å²	28.6	6%	0.056	18%	0.175	C	C	.	.	B	Isolated β-bridge	trans	-63.1	132.5	174.4	171.2	0	0	0	0	111.2	N439 A473 D474 E475 S476	N439-S471 CarbonylContact O-C 3.46Å; S471-A473 PolarHBondContact O-N 2.69Å; S471-A473 PolarHBondContact OG-N 2.99Å; S471-D474 WeakPolarHBondContact CB-OD1 3.33Å; S471-D474 PolarHBondContact OG-N 3.43Å; S471-D474 PolarHBondContact OG-OD1 3.4Å; S471-E475 WeakPolarHBondContact O-CA 3.46Å; S471-E475 PolarHBondContact O-N 2.89Å; S471-S476 WeakPolarHBondContact CB-O 3.05Å; S471-S476 PolarHBondContact N-O 3.01Å
472	G	95.4	Very high	96.8	Very high	44 Å²	44	28.6 Å²	28.6	45%	0.454	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-12	171.9	0	0	0	0	0	114.1	N439	N439-G472 PolarHBondContact O-N 3.35Å
473	A	93.9	Very high	97	Very high	91 Å²	91	27.1 Å²	27.1	75%	0.752	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-43.5	-177.4	0	0	0	0	0	112.9	S471	S471-A473 PolarHBondContact O-N 2.69Å; S471-A473 PolarHBondContact OG-N 2.99Å
474	D	95	Very high	96.9	Very high	90 Å²	90	26.9 Å²	26.9	48%	0.481	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-133.9	5.7	-171.7	67.1	-10.4	0	0	0	113.6	S471 S476	S471-D474 WeakPolarHBondContact CB-OD1 3.33Å; S471-D474 PolarHBondContact OG-N 3.43Å; S471-D474 PolarHBondContact OG-OD1 3.4Å; D474-S476 PolarHBondContact O-N 2.86Å; D474-S476 WeakPolarHBondContact OD1-CB 3.36Å; D474-S476 PolarHBondContact OD1-N 2.83Å; D474-S476 PolarHBondContact OD1-OG 2.93Å; D474-S476 PolarHBondContact OD2-OG 3.38Å; D474-S476 VanDerWaalsContact OD2-OG 3.12Å
475	E	95.8	Very high	96.9	Very high	88 Å²	88	34.5 Å²	34.5	41%	0.411	19%	0.193	S	C	.	.			trans	56.7	18.3	-179	-52.8	-165.7	-158.3	0	0	114.9	L441 S471 R499	L441-E475 HydrophobicContact CD1-CG 4.3Å; S471-E475 WeakPolarHBondContact O-CA 3.46Å; S471-E475 PolarHBondContact O-N 2.89Å; E475-R499 HydrophobicContact CB-CG 4.42Å; E475-R499 WeakPolarHBondContact O-CG 3.44Å; E475-R499 PolarHBondContact O-N 3.21Å; E475-R499 VanDerWaalsContact O-N 3.11Å; E475-R499 IonicContact OE2-CZ 3.16Å; E475-R499 IonicContact OE2-NE 3.21Å; E475-R499 PolarHBondContact OE2-NE 2.88Å; E475-R499 IonicContact OE2-NH2 3.78Å; E475-R499 PolarHBondContact OE2-NH2 2.99Å
476	S	97.3	Very high	96.8	Very high	5 Å²	5	38.7 Å²	38.7	4%	0.035	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	152.7	173.7	68.3	0	0	0	0	111.4	A470 S471 D474 L478 N494 Y497	A470-S476 WeakPolarHBondContact CA-O 3.33Å; S471-S476 WeakPolarHBondContact CB-O 3.05Å; S471-S476 PolarHBondContact N-O 3.01Å; D474-S476 PolarHBondContact O-N 2.86Å; D474-S476 WeakPolarHBondContact OD1-CB 3.36Å; D474-S476 PolarHBondContact OD1-N 2.83Å; D474-S476 PolarHBondContact OD1-OG 2.93Å; D474-S476 PolarHBondContact OD2-OG 3.38Å; D474-S476 VanDerWaalsContact OD2-OG 3.12Å; S476-L478 PolarHBondContact O-N 2.83Å; S476-N494 PolarHBondContact OG-OD1 3.01Å; S476-Y497 CarbonylContact C-O 3.6Å; S476-Y497 WeakPolarHBondContact CA-O 3.47Å
477	I	98.6	Very high	96.8	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	121.4	172.7	-60.9	-177.4	0	0	0	108.5	L448 I468 T495 Y497 R499 A502 L512	L448-I477 HydrophobicContact CD1-CB 4.48Å; L448-I477 HydrophobicContact CD1-CD1 4.23Å; L448-I477 HydrophobicContact CD1-CG1 3.81Å; L448-I477 HydrophobicContact CD1-CG2 4.28Å; I468-I477 HydrophobicContact CG2-CG2 3.56Å; I477-T495 HydrophobicContact CG2-CG2 4.46Å; I477-T495 WeakPolarHBondContact O-CB 3.18Å; I477-T495 WeakPolarHBondContact O-CG2 3.12Å; I477-T495 PolarHBondContact O-N 3.07Å; I477-T495 PolarHBondContact O-OG1 2.88Å; I477-Y497 HydrophobicContact CD1-CD1 3.87Å; I477-Y497 WeakPolarHBondContact CG1-O 3.19Å; I477-Y497 PolarHBondContact N-O 3.27Å; I477-R499 HydrophobicContact CG1-CB 4.3Å; I477-A502 HydrophobicContact CD1-CB 3.79Å; I477-L512 HydrophobicContact CG2-CD2 4.33Å
478	L	98.4	Very high	96.7	Very high	22 Å²	22	41.3 Å²	41.3	12%	0.115	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	148.7	171.9	-61.2	-177	0	0	0	109.9	I468 F469 S476 I493 N494	I468-L478 WeakPolarHBondContact CA-O 3.07Å; F469-L478 HydrophobicContact CD1-CB 4.26Å; F469-L478 HydrophobicContact CD2-CB 4.33Å; F469-L478 HydrophobicContact CE1-CB 3.8Å; F469-L478 HydrophobicContact CE2-CB 3.9Å; F469-L478 HydrophobicContact CE2-CD1 3.67Å; F469-L478 HydrophobicContact CE2-CG 4.33Å; F469-L478 HydrophobicContact CZ-CB 3.61Å; F469-L478 HydrophobicContact CZ-CD1 3.76Å; F469-L478 HydrophobicContact CZ-CG 4.32Å; F469-L478 PolarHBondContact N-O 2.69Å; F469-L478 PolarHBondContact O-N 3.08Å; F469-L478 VanDerWaalsContact O-O 3.13Å; S476-L478 PolarHBondContact O-N 2.83Å; L478-I493 WeakPolarHBondContact CA-O 3.37Å; L478-N494 HydrophobicContact CD2-CB 3.58Å; L478-N494 VanDerWaalsContact CD2-CG 3.49Å
479	V	98.6	Very high	96.7	Very high	0 Å²	0	43 Å²	43	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	120.7	171.7	-175.6	0	0	0	0	108.8	W466 L467 I468 I493 T495 I507 L512 L528	W466-V479 HydrophobicContact CB-CG1 4.15Å; W466-V479 HydrophobicContact CE3-CG1 3.96Å; L467-V479 CarbonylContact O-C 3.56Å; L467-V479 VanDerWaalsContact O-CA 3.32Å; L467-V479 WeakPolarHBondContact O-CA 3.49Å; I468-V479 HydrophobicContact CG1-CG2 4.29Å; I468-V479 HydrophobicContact CG2-CG2 4.39Å; V479-I493 HydrophobicContact CB-CB 4.43Å; V479-I493 PolarHBondContact N-O 3.34Å; V479-I493 PolarHBondContact O-N 3.5Å; V479-T495 HydrophobicContact CG2-CG2 4.15Å; V479-I507 HydrophobicContact CG1-CD1 4.04Å; V479-L512 HydrophobicContact CG2-CD2 3.96Å; V479-L528 HydrophobicContact CB-CD2 3.87Å; V479-L528 HydrophobicContact CG1-CD1 4.13Å; V479-L528 HydrophobicContact CG1-CD2 4.03Å; V479-L528 HydrophobicContact CG2-CD2 3.83Å
480	A	98.3	Very high	96.6	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	131.8	170.5	0	0	0	0	0	110	W466 L467 F469 L482 V489 S491 Y492	W466-A480 CarbonylContact C-O 3.57Å; W466-A480 WeakPolarHBondContact CA-O 3.18Å; L467-A480 HydrophobicContact CB-CB 4.24Å; L467-A480 PolarHBondContact N-O 2.59Å; L467-A480 PolarHBondContact O-N 3.26Å; F469-A480 HydrophobicContact CE1-CB 3.94Å; A480-L482 HydrophobicContact CB-CD2 4.44Å; A480-V489 HydrophobicContact CB-CG1 3.87Å; A480-V489 HydrophobicContact CB-CG2 4.33Å; A480-S491 VanDerWaalsContact CA-O 3.3Å; A480-S491 WeakPolarHBondContact CA-O 3.42Å; A480-Y492 HydrophobicContact CB-CD1 3.91Å; A480-Y492 HydrophobicContact CB-CE1 3.9Å
481	Q	98	Very high	96.5	Very high	57 Å²	57	48.7 Å²	48.7	27%	0.266	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	135.1	167.2	-169.7	-178.8	37.8	0	0	108.8	W466 V489 T490 S491	W466-Q481 HydrophobicContact CE3-CB 3.89Å; W466-Q481 HydrophobicContact CE3-CG 4.01Å; W466-Q481 HydrophobicContact CH2-CG 4.05Å; W466-Q481 HydrophobicContact CZ3-CB 3.67Å; W466-Q481 HydrophobicContact CZ3-CG 3.67Å; Q481-V489 WeakPolarHBondContact O-CA 3.45Å; Q481-T490 WeakPolarHBondContact CB-OG1 3.45Å; Q481-T490 PolarHBondContact O-N 3.2Å; Q481-T490 PolarHBondContact O-OG1 2.96Å; Q481-T490 VanDerWaalsContact O-OG1 3.11Å; Q481-T490 PolarHBondContact OE1-OG1 3.17Å; Q481-S491 WeakPolarHBondContact CB-OG 3.26Å; Q481-S491 PolarHBondContact N-O 3.48Å
482	L	97.8	Very high	96.5	Very high	9 Å²	9	53.5 Å²	53.5	5%	0.047	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	135.3	-176.1	-56.7	-176.9	0	0	0	111.1	L435 M458 L465 L467 A480 S488 V489	L435-L482 HydrophobicContact CD2-CD2 3.88Å; M458-L482 HydrophobicContact CE-CD1 3.66Å; L465-L482 HydrophobicContact CB-CB 4.29Å; L465-L482 HydrophobicContact CD2-CB 4.17Å; L465-L482 HydrophobicContact CD2-CD1 3.96Å; L465-L482 HydrophobicContact CG-CB 4.32Å; L465-L482 HydrophobicContact CG-CD1 4.18Å; L465-L482 PolarHBondContact O-N 2.87Å; L467-L482 HydrophobicContact CB-CD1 4.16Å; L467-L482 HydrophobicContact CB-CG 4.39Å; A480-L482 HydrophobicContact CB-CD2 4.44Å; L482-S488 WeakPolarHBondContact CA-O 3.18Å; L482-V489 HydrophobicContact CD2-CB 4.43Å; L482-V489 HydrophobicContact CD2-CG2 3.82Å
483	D	96.3	Very high	96.6	Very high	55 Å²	55	52.6 Å²	52.6	29%	0.294	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	122.2	165.5	-178.8	56.6	0	0	0	109.7	K485 T486 F487 S488 T490	D483-K485 VanDerWaalsContact C-N 3.33Å; D483-K485 PolarHBondContact O-N 3.31Å; D483-K485 WeakPolarHBondContact OD2-CB 3.35Å; D483-K485 PolarHBondContact OD2-N 3.09Å; D483-T486 WeakPolarHBondContact CB-OG1 3.27Å; D483-T486 WeakPolarHBondContact OD2-CG2 3.47Å; D483-T486 PolarHBondContact OD2-N 3Å; D483-T486 PolarHBondContact OD2-OG1 2.93Å; D483-F487 WeakPolarHBondContact O-CA 3.5Å; D483-F487 PolarHBondContact O-N 3.35Å; D483-S488 PolarHBondContact N-O 3.47Å; D483-T490 HydrophobicContact CB-CG2 3.71Å
484	Q	90.8	Very high	96.8	Very high	64 Å²	64	51.8 Å²	51.8	30%	0.299	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-33.8	-176.5	-172.9	-177.3	15.7	0	0	112.4	H408 N409 R424	H408-Q484 PolarHBondContact CD2-NE2 2.92Å; H408-Q484 PolarHBondContact NE2-NE2 2.93Å; H408-Q484 VanDerWaalsContact NE2-NE2 3.17Å; N409-Q484 PolarHBondContact ND2-NE2 3.33Å; N409-Q484 VanDerWaalsContact ND2-NE2 3.11Å; R424-Q484 PolarHBondContact NH1-O 2.87Å
485	K	92.6	Very high	96.9	Very high	186 Å²	186	47.5 Å²	47.5	81%	0.809	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-51.4	-173.8	-66.5	179.5	-179.2	175.3	0	110.6	D483	D483-K485 VanDerWaalsContact C-N 3.33Å; D483-K485 PolarHBondContact O-N 3.31Å; D483-K485 WeakPolarHBondContact OD2-CB 3.35Å; D483-K485 PolarHBondContact OD2-N 3.09Å
486	T	95.9	Very high	96.9	Very high	92 Å²	92	48.7 Å²	48.7	56%	0.564	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	-18.6	-178.6	61.6	0	0	0	0	113.3	D483 S488	D483-T486 WeakPolarHBondContact CB-OG1 3.27Å; D483-T486 WeakPolarHBondContact OD2-CG2 3.47Å; D483-T486 PolarHBondContact OD2-N 3Å; D483-T486 PolarHBondContact OD2-OG1 2.93Å; T486-S488 PolarHBondContact OG1-OG 3.48Å
487	F	97.3	Very high	97	Very high	10 Å²	10	50 Å²	50	4%	0.044	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.5	54.5	-171	-170.3	-130	0	0	0	111.9	Y413 I422 R424 H433 L435 D483	Y413-F487 HydrophobicContact CD1-CD2 4.37Å; Y413-F487 AromaticContact CD1-CE2 3.72Å; Y413-F487 HydrophobicContact CD1-CE2 3.72Å; Y413-F487 HydrophobicContact CD1-CZ 4.4Å; Y413-F487 AromaticContact CE1-CD2 3.89Å; Y413-F487 HydrophobicContact CE1-CD2 3.89Å; Y413-F487 AromaticContact CE1-CE2 3.72Å; Y413-F487 HydrophobicContact CE1-CE2 3.72Å; I422-F487 HydrophobicContact CB-CZ 4.41Å; I422-F487 HydrophobicContact CG2-CZ 4.17Å; R424-F487 HydrophobicContact CB-CD1 3.94Å; R424-F487 HydrophobicContact CB-CD2 4.12Å; R424-F487 HydrophobicContact CB-CE1 3.66Å; R424-F487 HydrophobicContact CB-CE2 3.88Å; R424-F487 HydrophobicContact CB-CG 4.16Å; R424-F487 HydrophobicContact CB-CZ 3.64Å; H433-F487 HydrophobicContact CB-CD1 3.95Å; H433-F487 HydrophobicContact CB-CE1 4.35Å; L435-F487 HydrophobicContact CB-CD1 4.02Å; L435-F487 HydrophobicContact CB-CE1 3.59Å; L435-F487 HydrophobicContact CB-CE2 4.37Å; L435-F487 HydrophobicContact CB-CZ 3.78Å; L435-F487 HydrophobicContact CD2-CE2 4.37Å; D483-F487 WeakPolarHBondContact O-CA 3.5Å; D483-F487 PolarHBondContact O-N 3.35Å
488	S	97.9	Very high	97	Very high	46 Å²	46	52.1 Å²	52.1	32%	0.322	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	157.9	177.5	62.5	0	0	0	0	111.5	L482 D483 T486	L482-S488 WeakPolarHBondContact CA-O 3.18Å; D483-S488 PolarHBondContact N-O 3.47Å; T486-S488 PolarHBondContact OG1-OG 3.48Å
489	V	98.1	Very high	96.9	Very high	35 Å²	35	52.9 Å²	52.9	21%	0.212	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	131	173.6	-176.7	0	0	0	0	110	L435 I437 A480 Q481 L482 S491 Y492	L435-V489 HydrophobicContact CD2-CG2 4.07Å; I437-V489 HydrophobicContact CD1-CG2 4.07Å; A480-V489 HydrophobicContact CB-CG1 3.87Å; A480-V489 HydrophobicContact CB-CG2 4.33Å; Q481-V489 WeakPolarHBondContact O-CA 3.45Å; L482-V489 HydrophobicContact CD2-CB 4.43Å; L482-V489 HydrophobicContact CD2-CG2 3.82Å; V489-S491 WeakPolarHBondContact CG1-O 2.83Å; V489-Y492 HydrophobicContact CB-CE2 4.39Å; V489-Y492 HydrophobicContact CG1-CD1 4.38Å; V489-Y492 HydrophobicContact CG1-CD2 4.07Å; V489-Y492 HydrophobicContact CG1-CE1 4.04Å; V489-Y492 HydrophobicContact CG1-CE2 3.68Å; V489-Y492 HydrophobicContact CG1-CG 4.41Å
490	T	97.3	Very high	96.8	Very high	78 Å²	78	57.3 Å²	57.3	48%	0.479	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	-35.7	174.7	57.5	0	0	0	0	112.2	Q481 D483	Q481-T490 WeakPolarHBondContact CB-OG1 3.45Å; Q481-T490 PolarHBondContact O-N 3.2Å; Q481-T490 PolarHBondContact O-OG1 2.96Å; Q481-T490 VanDerWaalsContact O-OG1 3.11Å; Q481-T490 PolarHBondContact OE1-OG1 3.17Å; D483-T490 HydrophobicContact CB-CG2 3.71Å
491	S	96.5	Very high	96.8	Very high	43 Å²	43	63.2 Å²	63.2	30%	0.301	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	156.2	179.1	64.2	0	0	0	0	111.7	A480 Q481 V489	A480-S491 VanDerWaalsContact CA-O 3.3Å; A480-S491 WeakPolarHBondContact CA-O 3.42Å; Q481-S491 WeakPolarHBondContact CB-OG 3.26Å; Q481-S491 PolarHBondContact N-O 3.48Å; V489-S491 WeakPolarHBondContact CG1-O 2.83Å
492	Y	97.2	Very high	96.8	Very high	108 Å²	108	60.8 Å²	60.8	42%	0.424	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	135.1	171	-68.3	-82.6	0	0	0	109.7	F469 A480 V489	F469-Y492 HydrophobicContact CE1-CD1 4.03Å; F469-Y492 AromaticContact CE1-CE1 3.98Å; F469-Y492 HydrophobicContact CE1-CE1 3.98Å; F469-Y492 AromaticContact CZ-CD1 3.74Å; F469-Y492 HydrophobicContact CZ-CD1 3.74Å; F469-Y492 AromaticContact CZ-CE1 3.63Å; F469-Y492 HydrophobicContact CZ-CE1 3.63Å; A480-Y492 HydrophobicContact CB-CD1 3.91Å; A480-Y492 HydrophobicContact CB-CE1 3.9Å; V489-Y492 HydrophobicContact CB-CE2 4.39Å; V489-Y492 HydrophobicContact CG1-CD1 4.38Å; V489-Y492 HydrophobicContact CG1-CD2 4.07Å; V489-Y492 HydrophobicContact CG1-CE1 4.04Å; V489-Y492 HydrophobicContact CG1-CE2 3.68Å; V489-Y492 HydrophobicContact CG1-CG 4.41Å
493	I	97.8	Very high	96.7	Very high	26 Å²	26	60.4 Å²	60.4	13%	0.133	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	118.3	-179.6	-57.5	164.2	0	0	0	107.5	W466 L478 V479 F526 L528	W466-I493 HydrophobicContact CZ3-CD1 4.07Å; L478-I493 WeakPolarHBondContact CA-O 3.37Å; V479-I493 HydrophobicContact CB-CB 4.43Å; V479-I493 PolarHBondContact N-O 3.34Å; V479-I493 PolarHBondContact O-N 3.5Å; I493-F526 HydrophobicContact CG2-CE1 3.71Å; I493-F526 HydrophobicContact CG2-CZ 4.42Å; I493-L528 HydrophobicContact CD1-CB 3.93Å; I493-L528 HydrophobicContact CD1-CD2 4.12Å; I493-L528 HydrophobicContact CG2-CD2 4.15Å
494	N	96.9	Very high	96.8	Very high	73 Å²	73	57.8 Å²	57.8	39%	0.39	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	118.2	173.6	-169.4	-17.7	0	0	0	109.9	S476 L478 T496	S476-N494 PolarHBondContact OG-OD1 3.01Å; L478-N494 HydrophobicContact CD2-CB 3.58Å; L478-N494 VanDerWaalsContact CD2-CG 3.49Å; N494-T496 VanDerWaalsContact C-N 3.33Å; N494-T496 WeakPolarHBondContact OD1-CA 3.32Å; N494-T496 PolarHBondContact OD1-N 3.36Å
495	T	97.4	Very high	97.2	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	-14.9	179	71.8	0	0	0	0	112.5	I477 V479 Y497 L512 F526	I477-T495 HydrophobicContact CG2-CG2 4.46Å; I477-T495 WeakPolarHBondContact O-CB 3.18Å; I477-T495 WeakPolarHBondContact O-CG2 3.12Å; I477-T495 PolarHBondContact O-N 3.07Å; I477-T495 PolarHBondContact O-OG1 2.88Å; V479-T495 HydrophobicContact CG2-CG2 4.15Å; T495-Y497 PolarHBondContact O-N 3.07Å; T495-Y497 WeakPolarHBondContact OG1-CB 3.23Å; T495-Y497 PolarHBondContact OG1-N 3.32Å; T495-L512 HydrophobicContact CG2-CD2 3.72Å; T495-F526 HydrophobicContact CG2-CD1 4.3Å; T495-F526 HydrophobicContact CG2-CG 4.31Å
496	T	96.9	Very high	97.4	Very high	113 Å²	113	46 Å²	46	69%	0.693	25%	0.252	S	S	*	.	E	Extended strand (participates in β ladder)	trans	58.9	3.3	-169.9	69	0	0	0	0	114.7	N494	N494-T496 VanDerWaalsContact C-N 3.33Å; N494-T496 WeakPolarHBondContact OD1-CA 3.32Å; N494-T496 PolarHBondContact OD1-N 3.36Å
497	Y	98.1	Very high	97.5	Very high	32 Å²	32	41.6 Å²	41.6	13%	0.125	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	127.3	-178.4	-165.5	-96.1	0	0	0	109.9	S476 I477 T495 K501 A502 V514 F524	S476-Y497 CarbonylContact C-O 3.6Å; S476-Y497 WeakPolarHBondContact CA-O 3.47Å; I477-Y497 HydrophobicContact CD1-CD1 3.87Å; I477-Y497 WeakPolarHBondContact CG1-O 3.19Å; I477-Y497 PolarHBondContact N-O 3.27Å; T495-Y497 PolarHBondContact O-N 3.07Å; T495-Y497 WeakPolarHBondContact OG1-CB 3.23Å; T495-Y497 PolarHBondContact OG1-N 3.32Å; Y497-K501 HydrophobicContact CE1-CB 3.8Å; Y497-K501 WeakPolarHBondContact OH-CB 3.37Å; Y497-A502 HydrophobicContact CE1-CB 4.31Å; Y497-V514 HydrophobicContact CD1-CG1 4.28Å; Y497-V514 HydrophobicContact CE1-CG1 3.81Å; Y497-F524 HydrophobicContact CD1-CD1 4.29Å; Y497-F524 HydrophobicContact CD2-CB 4.01Å; Y497-F524 AromaticContact CD2-CD1 3.58Å; Y497-F524 HydrophobicContact CD2-CD1 3.58Å; Y497-F524 AromaticContact CD2-CD2 3.48Å; Y497-F524 HydrophobicContact CD2-CD2 3.48Å; Y497-F524 VanDerWaalsContact CD2-CD2 3.48Å; Y497-F524 AromaticContact CD2-CE1 3.79Å; Y497-F524 HydrophobicContact CD2-CE1 3.79Å; Y497-F524 AromaticContact CD2-CE2 3.69Å; Y497-F524 HydrophobicContact CD2-CE2 3.69Å; Y497-F524 AromaticContact CD2-CG 3.4Å; Y497-F524 HydrophobicContact CD2-CG 3.4Å; Y497-F524 AromaticContact CD2-CZ 3.83Å; Y497-F524 HydrophobicContact CD2-CZ 3.83Å; Y497-F524 HydrophobicContact CE2-CB 3.51Å; Y497-F524 AromaticContact CE2-CD1 3.99Å; Y497-F524 HydrophobicContact CE2-CD1 3.99Å; Y497-F524 AromaticContact CE2-CD2 3.68Å; Y497-F524 HydrophobicContact CE2-CD2 3.68Å; Y497-F524 HydrophobicContact CE2-CE2 4.35Å; Y497-F524 AromaticContact CE2-CG 3.45Å; Y497-F524 HydrophobicContact CE2-CG 3.45Å; Y497-F524 VanDerWaalsContact CE2-CG 3.45Å; Y497-F524 AromaticContact CG-CD1 3.72Å; Y497-F524 HydrophobicContact CG-CD1 3.72Å; Y497-F524 HydrophobicContact CG-CD2 4.4Å; Y497-F524 AromaticContact CG-CE1 3.77Å; Y497-F524 HydrophobicContact CG-CE1 3.77Å; Y497-F524 HydrophobicContact CG-CE2 4.44Å; Y497-F524 HydrophobicContact CG-CG 4.04Å; Y497-F524 HydrophobicContact CG-CZ 4.12Å
498	P	97.9	Very high	97.5	Very high	45 Å²	45	41.1 Å²	41.1	29%	0.292	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	134.8	-177.3	29.5	-34.9	0	0	0	111.3	T500 K501	P498-T500 PolarHBondContact O-N 3.37Å; P498-T500 VanDerWaalsContact O-N 3.12Å; P498-K501 HydrophobicContact CG-CB 4.38Å; P498-K501 HydrophobicContact CG-CD 3.75Å; P498-K501 HydrophobicContact CG-CG 3.94Å; P498-K501 PolarHBondContact O-N 2.92Å
499	R	96.9	Very high	97.3	Very high	38 Å²	38	40.2 Å²	40.2	14%	0.143	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-56.7	-30.4	178.8	74.1	-176.2	-177.7	88.4	5.2	113.3	Y447 L448 A470 E475 I477 K501 A502	Y447-R499 PolarHBondContact O-NH1 2.76Å; L448-R499 HydrophobicContact CD1-CB 4.46Å; A470-R499 HydrophobicContact CB-CB 4.26Å; E475-R499 HydrophobicContact CB-CG 4.42Å; E475-R499 WeakPolarHBondContact O-CG 3.44Å; E475-R499 PolarHBondContact O-N 3.21Å; E475-R499 VanDerWaalsContact O-N 3.11Å; E475-R499 IonicContact OE2-CZ 3.16Å; E475-R499 IonicContact OE2-NE 3.21Å; E475-R499 PolarHBondContact OE2-NE 2.88Å; E475-R499 IonicContact OE2-NH2 3.78Å; E475-R499 PolarHBondContact OE2-NH2 2.99Å; I477-R499 HydrophobicContact CG1-CB 4.3Å; R499-K501 PolarHBondContact O-N 2.81Å; R499-K501 VanDerWaalsContact O-N 3.12Å; R499-A502 PolarHBondContact O-N 3.41Å
500	T	96.9	Very high	97.2	Very high	94 Å²	94	38.5 Å²	38.5	58%	0.577	21%	0.207	S	C	*	.	G	3₁₀ helix	trans	-65.3	-15.9	-177.1	55.6	0	0	0	0	114.1	P498	P498-T500 PolarHBondContact O-N 3.37Å; P498-T500 VanDerWaalsContact O-N 3.12Å
501	K	97.4	Very high	97.2	Very high	123 Å²	123	35.1 Å²	35.1	54%	0.535	19%	0.186	S	C	.	.	G	3₁₀ helix	trans	-98.3	-7.6	176.3	-63.6	-175.1	-176.7	176.7	0	113.4	Y497 P498 R499	Y497-K501 HydrophobicContact CE1-CB 3.8Å; Y497-K501 WeakPolarHBondContact OH-CB 3.37Å; P498-K501 HydrophobicContact CG-CB 4.38Å; P498-K501 HydrophobicContact CG-CD 3.75Å; P498-K501 HydrophobicContact CG-CG 3.94Å; P498-K501 PolarHBondContact O-N 2.92Å; R499-K501 PolarHBondContact O-N 2.81Å; R499-K501 VanDerWaalsContact O-N 3.12Å
502	A	98	Very high	97.3	Very high	7 Å²	7	33 Å²	33	6%	0.058	17%	0.171	C	C	.	.			trans	-92.9	126.9	-178.5	0	0	0	0	0	111.1	L449 I477 Y497 R499 V514	L449-A502 HydrophobicContact CD2-CB 4.2Å; I477-A502 HydrophobicContact CD1-CB 3.79Å; Y497-A502 HydrophobicContact CE1-CB 4.31Å; R499-A502 PolarHBondContact O-N 3.41Å; A502-V514 HydrophobicContact CB-CG1 3.43Å; A502-V514 VanDerWaalsContact CB-CG1 3.43Å
503	G	97.3	Very high	97.3	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	15%	0.151	C	C	.	.	S	Bend	trans	-81	-52	165.7	0	0	0	0	0	111.2	T515 D516 D519	G503-T515 PolarHBondContact N-O 2.94Å; G503-D516 WeakPolarHBondContact CA-O 3.31Å; G503-D516 PolarHBondContact N-O 2.97Å; G503-D519 VanDerWaalsContact CA-OD1 3.3Å; G503-D519 WeakPolarHBondContact CA-OD1 3.33Å
504	N	97.9	Very high	97.3	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.145	C	C	.	.			trans	-152.3	172.7	-178.8	-136.3	-57.3	0	0	0	109.7	L449 K457 T515 D519 L547 L550	L449-N504 WeakPolarHBondContact CD1-OD1 3.47Å; K457-N504 PolarHBondContact NZ-OD1 3.31Å; N504-T515 WeakPolarHBondContact CA-OG1 3.25Å; N504-T515 WeakPolarHBondContact CB-OG1 3.49Å; N504-T515 PolarHBondContact N-OG1 3.43Å; N504-T515 PolarHBondContact O-N 2.92Å; N504-T515 PolarHBondContact O-OG1 3.34Å; N504-T515 VanDerWaalsContact O-OG1 3.05Å; N504-D519 VanDerWaalsContact CB-OD1 3.26Å; N504-D519 WeakPolarHBondContact CB-OD1 3.3Å; N504-D519 PolarHBondContact N-OD1 2.89Å; N504-D519 VanDerWaalsContact N-OD1 3.07Å; N504-L547 HydrophobicContact CB-CD2 4.18Å; N504-L547 PolarHBondContact ND2-O 3.33Å; N504-L550 HydrophobicContact CB-CB 4.42Å; N504-L550 HydrophobicContact CB-CD2 4.04Å
505	A	98.3	Very high	97.4	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	156.9	179	0	0	0	0	0	112.1	K457 I468 L512 Y513 V514	K457-A505 VanDerWaalsContact CD-O 3.31Å; K457-A505 WeakPolarHBondContact CD-O 3.44Å; K457-A505 WeakPolarHBondContact CE-O 3.45Å; K457-A505 PolarHBondContact NZ-O 3.19Å; I468-A505 HydrophobicContact CD1-CB 4.19Å; A505-L512 HydrophobicContact CB-CD1 4.07Å; A505-Y513 CarbonylContact C-O 3.59Å; A505-Y513 WeakPolarHBondContact CA-O 3.04Å; A505-Y513 WeakPolarHBondContact CB-O 3.26Å; A505-V514 HydrophobicContact CB-CG2 4.14Å
506	F	98.1	Very high	97.4	Very high	2 Å²	2	24.9 Å²	24.9	1%	0.009	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	165.1	170.7	65.4	-84	0	0	0	110	I335 Y513 V522 F538 L550 L559	I335-F506 HydrophobicContact CD1-CE2 3.62Å; I335-F506 HydrophobicContact CD1-CZ 4.04Å; F506-Y513 HydrophobicContact CD2-CD2 4.01Å; F506-Y513 HydrophobicContact CD2-CG 4.45Å; F506-Y513 HydrophobicContact CE1-CG 4.27Å; F506-Y513 AromaticContact CE2-CD2 3.54Å; F506-Y513 HydrophobicContact CE2-CD2 3.54Å; F506-Y513 HydrophobicContact CE2-CE2 4.32Å; F506-Y513 AromaticContact CE2-CG 3.84Å; F506-Y513 HydrophobicContact CE2-CG 3.84Å; F506-Y513 HydrophobicContact CZ-CD1 4.48Å; F506-Y513 AromaticContact CZ-CD2 3.96Å; F506-Y513 HydrophobicContact CZ-CD2 3.96Å; F506-Y513 AromaticContact CZ-CG 3.75Å; F506-Y513 HydrophobicContact CZ-CG 3.75Å; F506-Y513 PolarHBondContact N-O 2.92Å; F506-Y513 PolarHBondContact O-N 3.37Å; F506-V522 HydrophobicContact CE1-CG2 4.12Å; F506-F538 HydrophobicContact CZ-CZ 4.13Å; F506-L550 HydrophobicContact CD1-CD2 3.6Å; F506-L550 HydrophobicContact CD1-CG 3.9Å; F506-L550 HydrophobicContact CE1-CD2 4.12Å; F506-L559 HydrophobicContact CD1-CD1 4.27Å; F506-L559 HydrophobicContact CD2-CD1 3.84Å; F506-L559 HydrophobicContact CE1-CD1 4.42Å; F506-L559 HydrophobicContact CE2-CD1 4.01Å; F506-L559 HydrophobicContact CG-CD1 3.96Å; F506-L559 HydrophobicContact CZ-CD1 4.29Å
507	I	98.1	Very high	97.4	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.005	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	132.8	178.3	-66.2	165.7	0	0	0	108.6	A459 D461 W466 I468 V479 V511 L512 L528 Y552	A459-I507 HydrophobicContact CB-CB 4.03Å; A459-I507 HydrophobicContact CB-CD1 4.15Å; A459-I507 HydrophobicContact CB-CG1 4.33Å; D461-I507 HydrophobicContact CB-CG2 4.23Å; W466-I507 HydrophobicContact CB-CD1 3.46Å; W466-I507 VanDerWaalsContact CB-CD1 3.46Å; W466-I507 HydrophobicContact CD2-CD1 4.39Å; W466-I507 HydrophobicContact CG-CD1 3.7Å; W466-I507 HydrophobicContact CG-CG2 4.4Å; I468-I507 HydrophobicContact CD1-CD1 3.97Å; I468-I507 HydrophobicContact CD1-CG1 4.18Å; I468-I507 HydrophobicContact CG1-CD1 3.91Å; V479-I507 HydrophobicContact CG1-CD1 4.04Å; I507-V511 WeakPolarHBondContact CA-O 3.42Å; I507-L512 HydrophobicContact CD1-CD1 4.25Å; I507-L512 HydrophobicContact CG1-CB 4.19Å; I507-L512 HydrophobicContact CG1-CD1 3.75Å; I507-L528 HydrophobicContact CD1-CD1 3.67Å; I507-L528 HydrophobicContact CG1-CD1 4.01Å; I507-L528 HydrophobicContact CG2-CD1 3.97Å; I507-Y552 WeakPolarHBondContact O-CB 3.16Å; I507-Y552 VanDerWaalsContact O-CD1 3.3Å; I507-Y552 WeakPolarHBondContact O-CD1 3.24Å
508	A	96.5	Very high	97.3	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	137.6	170.9	0	0	0	0	0	108.4	I335 G510 V511 Y513 Y552	I335-A508 HydrophobicContact CD1-CB 4.04Å; A508-G510 PolarHBondContact O-N 2.93Å; A508-G510 VanDerWaalsContact O-N 3.11Å; A508-V511 PolarHBondContact N-O 2.91Å; A508-V511 VanDerWaalsContact N-O 3.1Å; A508-V511 PolarHBondContact O-N 2.75Å; A508-Y513 HydrophobicContact CB-CD2 4.49Å; A508-Y513 HydrophobicContact CB-CE2 4.04Å; A508-Y552 HydrophobicContact CB-CD1 3.5Å; A508-Y552 VanDerWaalsContact CB-CD1 3.5Å; A508-Y552 HydrophobicContact CB-CD2 4.01Å; A508-Y552 HydrophobicContact CB-CE1 3.63Å; A508-Y552 HydrophobicContact CB-CE2 4.14Å; A508-Y552 HydrophobicContact CB-CG 3.69Å
509	C	93.9	Very high	97.2	Very high	26 Å²	26	26.1 Å²	26.1	18%	0.176	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.9	37.6	177.5	-79.3	0	0	0	0	115.7	C333 D461 E462 V511	C333-C509 HydrophobicContact CB-CB 3.36Å; C333-C509 WeakPolarHBondContact CB-SG 3.29Å; C333-C509 WeakPolarHBondContact SG-CB 3.42Å; C333-C509 CovalentContact SG-SG 2Å; C333-C509 PolarHBondContact SG-SG 2.71Å; D461-C509 PolarHBondContact OD2-N 3.16Å; E462-C509 VanDerWaalsContact CD-SG 3.58Å; E462-C509 WeakPolarHBondContact OE2-CA 3.48Å; E462-C509 PolarHBondContact OE2-N 3.19Å; E462-C509 PolarHBondContact OE2-SG 2.81Å; C509-V511 PolarHBondContact O-N 2.88Å
510	G	95.4	Very high	97.2	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.8	11.7	176.7	0	0	0	0	0	112.8	D461 N463 A508 L528	D461-G510 WeakPolarHBondContact OD2-CA 3.29Å; D461-G510 PolarHBondContact OD2-N 2.69Å; N463-G510 PolarHBondContact ND2-N 3.23Å; A508-G510 PolarHBondContact O-N 2.93Å; A508-G510 VanDerWaalsContact O-N 3.11Å; G510-L528 VanDerWaalsContact O-CB 3.25Å; G510-L528 WeakPolarHBondContact O-CB 3.48Å; G510-L528 PolarHBondContact O-N 3.36Å
511	V	97.1	Very high	97.2	Very high	6 Å²	6	25.3 Å²	25.3	4%	0.036	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	124.1	178.5	-175.7	0	0	0	0	108.9	L334 I507 A508 C509 Y513 A525 F526	L334-V511 HydrophobicContact CD2-CG1 4.44Å; L334-V511 HydrophobicContact CD2-CG2 3.91Å; I507-V511 WeakPolarHBondContact CA-O 3.42Å; A508-V511 PolarHBondContact N-O 2.91Å; A508-V511 VanDerWaalsContact N-O 3.1Å; A508-V511 PolarHBondContact O-N 2.75Å; C509-V511 PolarHBondContact O-N 2.88Å; V511-Y513 HydrophobicContact CB-CD2 4.49Å; V511-Y513 HydrophobicContact CB-CE2 3.73Å; V511-Y513 HydrophobicContact CG1-CD2 4.4Å; V511-Y513 HydrophobicContact CG1-CE1 4.08Å; V511-Y513 HydrophobicContact CG1-CE2 3.86Å; V511-Y513 WeakPolarHBondContact O-CD2 3.37Å; V511-Y513 VanDerWaalsContact O-CE2 3.31Å; V511-Y513 WeakPolarHBondContact O-CE2 3.37Å; V511-A525 HydrophobicContact CG1-CB 4.06Å; V511-F526 CarbonylContact C-O 3.53Å; V511-F526 WeakPolarHBondContact CA-O 3.31Å
512	L	98.4	Very high	97.2	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	127.7	168.5	174.4	70.3	0	0	0	109	I468 I477 V479 T495 A505 I507 V514 A525 F526 L528	I468-L512 HydrophobicContact CD1-CD1 3.6Å; I468-L512 HydrophobicContact CG1-CD1 4.18Å; I477-L512 HydrophobicContact CG2-CD2 4.33Å; V479-L512 HydrophobicContact CG2-CD2 3.96Å; T495-L512 HydrophobicContact CG2-CD2 3.72Å; A505-L512 HydrophobicContact CB-CD1 4.07Å; I507-L512 HydrophobicContact CD1-CD1 4.25Å; I507-L512 HydrophobicContact CG1-CB 4.19Å; I507-L512 HydrophobicContact CG1-CD1 3.75Å; L512-V514 HydrophobicContact CD1-CG2 4.41Å; L512-V514 HydrophobicContact CD2-CG2 4.02Å; L512-V514 HydrophobicContact CG-CG2 3.94Å; L512-A525 CarbonylContact O-C 3.59Å; L512-A525 WeakPolarHBondContact O-CA 3.23Å; L512-F526 HydrophobicContact CB-CB 4.34Å; L512-F526 PolarHBondContact N-O 2.86Å; L512-F526 PolarHBondContact O-N 3.09Å; L512-L528 HydrophobicContact CB-CD1 4.32Å; L512-L528 HydrophobicContact CB-CD2 4.15Å; L512-L528 HydrophobicContact CB-CG 4.24Å
513	Y	98.4	Very high	97.1	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	127.7	174.6	-64.7	-83.3	0	0	0	109.4	I335 A505 F506 A508 V511 V522 A525 M536 F538	I335-Y513 HydrophobicContact CB-CE1 4.32Å; I335-Y513 HydrophobicContact CD1-CD2 4.27Å; I335-Y513 HydrophobicContact CD1-CE1 4.46Å; I335-Y513 HydrophobicContact CD1-CE2 3.84Å; I335-Y513 HydrophobicContact CG1-CE1 4.48Å; I335-Y513 HydrophobicContact CG1-CE2 4.23Å; I335-Y513 PolarHBondContact N-OH 2.98Å; A505-Y513 CarbonylContact C-O 3.59Å; A505-Y513 WeakPolarHBondContact CA-O 3.04Å; A505-Y513 WeakPolarHBondContact CB-O 3.26Å; F506-Y513 HydrophobicContact CD2-CD2 4.01Å; F506-Y513 HydrophobicContact CD2-CG 4.45Å; F506-Y513 HydrophobicContact CE1-CG 4.27Å; F506-Y513 AromaticContact CE2-CD2 3.54Å; F506-Y513 HydrophobicContact CE2-CD2 3.54Å; F506-Y513 HydrophobicContact CE2-CE2 4.32Å; F506-Y513 AromaticContact CE2-CG 3.84Å; F506-Y513 HydrophobicContact CE2-CG 3.84Å; F506-Y513 HydrophobicContact CZ-CD1 4.48Å; F506-Y513 AromaticContact CZ-CD2 3.96Å; F506-Y513 HydrophobicContact CZ-CD2 3.96Å; F506-Y513 AromaticContact CZ-CG 3.75Å; F506-Y513 HydrophobicContact CZ-CG 3.75Å; F506-Y513 PolarHBondContact N-O 2.92Å; F506-Y513 PolarHBondContact O-N 3.37Å; A508-Y513 HydrophobicContact CB-CD2 4.49Å; A508-Y513 HydrophobicContact CB-CE2 4.04Å; V511-Y513 HydrophobicContact CB-CD2 4.49Å; V511-Y513 HydrophobicContact CB-CE2 3.73Å; V511-Y513 HydrophobicContact CG1-CD2 4.4Å; V511-Y513 HydrophobicContact CG1-CE1 4.08Å; V511-Y513 HydrophobicContact CG1-CE2 3.86Å; V511-Y513 WeakPolarHBondContact O-CD2 3.37Å; V511-Y513 VanDerWaalsContact O-CE2 3.31Å; V511-Y513 WeakPolarHBondContact O-CE2 3.37Å; Y513-V522 HydrophobicContact CD1-CG1 4.01Å; Y513-A525 HydrophobicContact CD1-CB 4.13Å; Y513-A525 HydrophobicContact CE1-CB 4.31Å; Y513-M536 HydrophobicContact CD1-CE 4.39Å; Y513-M536 HydrophobicContact CD1-SD 4.28Å; Y513-M536 HydrophobicContact CE1-CE 3.49Å; Y513-M536 VanDerWaalsContact CE1-CE 3.49Å; Y513-M536 HydrophobicContact CE1-SD 3.44Å; Y513-M536 WeakPolarHBondContact CE1-SD 3.24Å; Y513-F538 HydrophobicContact CD1-CE1 4.05Å; Y513-F538 HydrophobicContact CD1-CZ 4.32Å; Y513-F538 HydrophobicContact CE1-CE1 4.12Å
514	V	98.4	Very high	97.1	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	128.8	-178.5	-176.2	0	0	0	0	109.8	Y497 A502 A505 L512 T523 F524	Y497-V514 HydrophobicContact CD1-CG1 4.28Å; Y497-V514 HydrophobicContact CE1-CG1 3.81Å; A502-V514 HydrophobicContact CB-CG1 3.43Å; A502-V514 VanDerWaalsContact CB-CG1 3.43Å; A505-V514 HydrophobicContact CB-CG2 4.14Å; L512-V514 HydrophobicContact CD1-CG2 4.41Å; L512-V514 HydrophobicContact CD2-CG2 4.02Å; L512-V514 HydrophobicContact CG-CG2 3.94Å; V514-T523 PolarHBondContact O-N 3.4Å; V514-F524 HydrophobicContact CB-CB 4.22Å; V514-F524 HydrophobicContact CB-CD1 4.11Å; V514-F524 HydrophobicContact CG2-CD1 3.84Å; V514-F524 PolarHBondContact N-O 2.92Å; V514-F524 PolarHBondContact O-N 3.44Å
515	T	98.1	Very high	97.1	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	156	177.2	57.8	0	0	0	0	111.4	G503 N504 D519 R521 V522 L540 L550	G503-T515 PolarHBondContact N-O 2.94Å; N504-T515 WeakPolarHBondContact CA-OG1 3.25Å; N504-T515 WeakPolarHBondContact CB-OG1 3.49Å; N504-T515 PolarHBondContact N-OG1 3.43Å; N504-T515 PolarHBondContact O-N 2.92Å; N504-T515 PolarHBondContact O-OG1 3.34Å; N504-T515 VanDerWaalsContact O-OG1 3.05Å; T515-D519 PolarHBondContact OG1-OD1 3.32Å; T515-R521 CarbonylContact C-O 3.57Å; T515-R521 WeakPolarHBondContact CA-O 3.42Å; T515-V522 HydrophobicContact CG2-CG2 4.11Å; T515-L540 HydrophobicContact CG2-CD2 3.72Å; T515-L550 HydrophobicContact CG2-CD2 3.85Å
516	D	97.2	Very high	97.1	Very high	35 Å²	35	24.4 Å²	24.4	19%	0.187	12%	0.123	C	C	.	.			trans	-61.9	165.7	167.7	72.9	-36.5	0	0	0	111.9	G503 K518 D519 A520 R521 T523	G503-D516 WeakPolarHBondContact CA-O 3.31Å; G503-D516 PolarHBondContact N-O 2.97Å; D516-K518 PolarHBondContact O-N 3.24Å; D516-D519 PolarHBondContact O-N 3.11Å; D516-D519 PolarHBondContact OD1-N 3.46Å; D516-A520 PolarHBondContact OD1-N 3.21Å; D516-R521 PolarHBondContact N-O 3.49Å; D516-R521 PolarHBondContact OD1-N 3.41Å; D516-T523 HydrophobicContact CB-CG2 3.92Å
517	T	96.6	Very high	97	Very high	76 Å²	76	25.1 Å²	25.1	47%	0.466	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-14.7	-177.5	56.3	0	0	0	0	114.4	N451	N451-T517 PolarHBondContact ND2-O 3.18Å
518	K	96.1	Very high	97	Very high	139 Å²	139	25.4 Å²	25.4	60%	0.604	13%	0.128	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-1.7	175.6	-61.6	-177.5	-179.6	178.6	0	113.5	D516 A520	D516-K518 PolarHBondContact O-N 3.24Å; K518-A520 HydrophobicContact CB-CB 4.45Å; K518-A520 PolarHBondContact O-N 3.14Å
519	D	96.8	Very high	96.9	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.005	15%	0.154	C	C	.	.	S	Bend	trans	53.9	36.5	-176.8	-69.6	-46.1	0	0	0	113.6	N451 G503 N504 T515 D516 R541 L547	N451-D519 PolarHBondContact ND2-OD2 2.83Å; G503-D519 VanDerWaalsContact CA-OD1 3.3Å; G503-D519 WeakPolarHBondContact CA-OD1 3.33Å; N504-D519 VanDerWaalsContact CB-OD1 3.26Å; N504-D519 WeakPolarHBondContact CB-OD1 3.3Å; N504-D519 PolarHBondContact N-OD1 2.89Å; N504-D519 VanDerWaalsContact N-OD1 3.07Å; T515-D519 PolarHBondContact OG1-OD1 3.32Å; D516-D519 PolarHBondContact O-N 3.11Å; D516-D519 PolarHBondContact OD1-N 3.46Å; D519-R541 WeakPolarHBondContact O-CG 3.19Å; D519-R541 PolarHBondContact O-NE 3.06Å; D519-L547 HydrophobicContact CB-CB 3.76Å; D519-L547 HydrophobicContact CB-CD2 3.61Å; D519-L547 HydrophobicContact CB-CG 4.32Å
520	A	95.9	Very high	96.9	Very high	10 Å²	10	34.7 Å²	34.7	8%	0.083	17%	0.17	C	C	.	.	S	Bend	trans	-101.7	-34.4	-178.1	0	0	0	0	0	111.7	D516 K518 L540 R541 P543	D516-A520 PolarHBondContact OD1-N 3.21Å; K518-A520 HydrophobicContact CB-CB 4.45Å; K518-A520 PolarHBondContact O-N 3.14Å; A520-L540 WeakPolarHBondContact O-CB 3.39Å; A520-L540 PolarHBondContact O-N 3.25Å; A520-R541 WeakPolarHBondContact CA-O 3.46Å; A520-R541 PolarHBondContact O-N 2.95Å; A520-P543 HydrophobicContact CB-CB 3.97Å
521	R	96.4	Very high	96.9	Very high	105 Å²	105	37 Å²	37	40%	0.396	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	147.5	-174.1	-60.6	-172.7	52.9	176.7	-6	111.7	T515 D516 T523 T537 F538 D539	T515-R521 CarbonylContact C-O 3.57Å; T515-R521 WeakPolarHBondContact CA-O 3.42Å; D516-R521 PolarHBondContact N-O 3.49Å; D516-R521 PolarHBondContact OD1-N 3.41Å; R521-T523 HydrophobicContact CB-CG2 4.24Å; R521-T537 PolarHBondContact NH2-OG1 3.35Å; R521-F538 WeakPolarHBondContact CA-O 3.42Å; R521-D539 WeakPolarHBondContact CD-OD1 3.48Å; R521-D539 VanDerWaalsContact CG-OD1 3.22Å; R521-D539 WeakPolarHBondContact CG-OD1 3.35Å; R521-D539 IonicContact CZ-OD1 2.75Å; R521-D539 IonicContact NE-OD1 3.45Å; R521-D539 PolarHBondContact NE-OD1 3.47Å
522	V	97.6	Very high	96.8	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	124.1	163.1	174.7	0	0	0	0	108.4	F506 Y513 T515 T537 F538	F506-V522 HydrophobicContact CE1-CG2 4.12Å; Y513-V522 HydrophobicContact CD1-CG1 4.01Å; T515-V522 HydrophobicContact CG2-CG2 4.11Å; V522-T537 VanDerWaalsContact O-CA 3.27Å; V522-T537 WeakPolarHBondContact O-CA 3.4Å; V522-T537 WeakPolarHBondContact O-CB 3.49Å; V522-T537 PolarHBondContact O-OG1 2.91Å; V522-F538 HydrophobicContact CB-CD1 4.21Å; V522-F538 HydrophobicContact CB-CD2 4.43Å; V522-F538 HydrophobicContact CB-CE1 3.89Å; V522-F538 HydrophobicContact CB-CE2 4.13Å; V522-F538 HydrophobicContact CB-CG 4.48Å; V522-F538 HydrophobicContact CB-CZ 3.85Å; V522-F538 HydrophobicContact CG1-CE1 4Å; V522-F538 HydrophobicContact CG1-CZ 4.25Å; V522-F538 HydrophobicContact CG2-CD2 4.31Å; V522-F538 HydrophobicContact CG2-CE1 4.03Å; V522-F538 HydrophobicContact CG2-CE2 3.62Å; V522-F538 HydrophobicContact CG2-CZ 3.47Å; V522-F538 VanDerWaalsContact CG2-CZ 3.47Å; V522-F538 PolarHBondContact N-O 2.96Å; V522-F538 PolarHBondContact O-N 3.48Å
523	T	96.8	Very high	96.7	Very high	67 Å²	67	46.4 Å²	46.4	41%	0.411	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	-12.4	-175.1	57.6	0	0	0	0	113.5	V514 D516 R521	V514-T523 PolarHBondContact O-N 3.4Å; D516-T523 HydrophobicContact CB-CG2 3.92Å; R521-T523 HydrophobicContact CB-CG2 4.24Å
524	F	97.8	Very high	96.5	Very high	32 Å²	32	48.1 Å²	48.1	14%	0.14	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	140	175.3	176.4	-101.3	0	0	0	109.9	Y497 V514 F526 A533	Y497-F524 HydrophobicContact CD1-CD1 4.29Å; Y497-F524 HydrophobicContact CD2-CB 4.01Å; Y497-F524 AromaticContact CD2-CD1 3.58Å; Y497-F524 HydrophobicContact CD2-CD1 3.58Å; Y497-F524 AromaticContact CD2-CD2 3.48Å; Y497-F524 HydrophobicContact CD2-CD2 3.48Å; Y497-F524 VanDerWaalsContact CD2-CD2 3.48Å; Y497-F524 AromaticContact CD2-CE1 3.79Å; Y497-F524 HydrophobicContact CD2-CE1 3.79Å; Y497-F524 AromaticContact CD2-CE2 3.69Å; Y497-F524 HydrophobicContact CD2-CE2 3.69Å; Y497-F524 AromaticContact CD2-CG 3.4Å; Y497-F524 HydrophobicContact CD2-CG 3.4Å; Y497-F524 AromaticContact CD2-CZ 3.83Å; Y497-F524 HydrophobicContact CD2-CZ 3.83Å; Y497-F524 HydrophobicContact CE2-CB 3.51Å; Y497-F524 AromaticContact CE2-CD1 3.99Å; Y497-F524 HydrophobicContact CE2-CD1 3.99Å; Y497-F524 AromaticContact CE2-CD2 3.68Å; Y497-F524 HydrophobicContact CE2-CD2 3.68Å; Y497-F524 HydrophobicContact CE2-CE2 4.35Å; Y497-F524 AromaticContact CE2-CG 3.45Å; Y497-F524 HydrophobicContact CE2-CG 3.45Å; Y497-F524 VanDerWaalsContact CE2-CG 3.45Å; Y497-F524 AromaticContact CG-CD1 3.72Å; Y497-F524 HydrophobicContact CG-CD1 3.72Å; Y497-F524 HydrophobicContact CG-CD2 4.4Å; Y497-F524 AromaticContact CG-CE1 3.77Å; Y497-F524 HydrophobicContact CG-CE1 3.77Å; Y497-F524 HydrophobicContact CG-CE2 4.44Å; Y497-F524 HydrophobicContact CG-CG 4.04Å; Y497-F524 HydrophobicContact CG-CZ 4.12Å; V514-F524 HydrophobicContact CB-CB 4.22Å; V514-F524 HydrophobicContact CB-CD1 4.11Å; V514-F524 HydrophobicContact CG2-CD1 3.84Å; V514-F524 PolarHBondContact N-O 2.92Å; V514-F524 PolarHBondContact O-N 3.44Å; F524-F526 HydrophobicContact CE1-CB 3.86Å; F524-F526 HydrophobicContact CE1-CD2 4.47Å; F524-F526 HydrophobicContact CZ-CB 4.03Å; F524-F526 AromaticContact CZ-CD2 3.9Å; F524-F526 HydrophobicContact CZ-CD2 3.9Å; F524-F526 HydrophobicContact CZ-CG 4.43Å; F524-A533 HydrophobicContact CE2-CB 4.07Å
525	A	97.7	Very high	96.2	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	147.3	172.5	0	0	0	0	0	110.5	V511 L512 Y513 A533 V534 M536	V511-A525 HydrophobicContact CG1-CB 4.06Å; L512-A525 CarbonylContact O-C 3.59Å; L512-A525 WeakPolarHBondContact O-CA 3.23Å; Y513-A525 HydrophobicContact CD1-CB 4.13Å; Y513-A525 HydrophobicContact CE1-CB 4.31Å; A525-A533 WeakPolarHBondContact O-CA 3.35Å; A525-V534 HydrophobicContact CB-CB 4.14Å; A525-V534 PolarHBondContact O-N 3.4Å; A525-M536 HydrophobicContact CB-CG 3.52Å; A525-M536 HydrophobicContact CB-SD 3.74Å
526	F	97.7	Very high	95.9	Very high	13 Å²	13	57.2 Å²	57.2	6%	0.057	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	119.9	-177.9	-167.5	-84.3	0	0	0	110.5	I493 T495 V511 L512 F524 L528 A533	I493-F526 HydrophobicContact CG2-CE1 3.71Å; I493-F526 HydrophobicContact CG2-CZ 4.42Å; T495-F526 HydrophobicContact CG2-CD1 4.3Å; T495-F526 HydrophobicContact CG2-CG 4.31Å; V511-F526 CarbonylContact C-O 3.53Å; V511-F526 WeakPolarHBondContact CA-O 3.31Å; L512-F526 HydrophobicContact CB-CB 4.34Å; L512-F526 PolarHBondContact N-O 2.86Å; L512-F526 PolarHBondContact O-N 3.09Å; F524-F526 HydrophobicContact CE1-CB 3.86Å; F524-F526 HydrophobicContact CE1-CD2 4.47Å; F524-F526 HydrophobicContact CZ-CB 4.03Å; F524-F526 AromaticContact CZ-CD2 3.9Å; F524-F526 HydrophobicContact CZ-CD2 3.9Å; F524-F526 HydrophobicContact CZ-CG 4.43Å; F526-L528 HydrophobicContact CD1-CD2 4.04Å; F526-L528 PolarHBondContact O-N 3Å; F526-A533 HydrophobicContact CD2-CB 4.29Å
527	D	96.7	Very high	95.8	Very high	16 Å²	16	59 Å²	59	9%	0.086	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	106.5	174.5	-174.3	-33	0	0	0	108.5	L529 K530 G531 K532 V534	D527-L529 VanDerWaalsContact C-N 3.3Å; D527-L529 PolarHBondContact OD1-N 3.16Å; D527-L529 VanDerWaalsContact OD1-N 3.11Å; D527-K530 HydrophobicContact CB-CB 4.2Å; D527-K530 PolarHBondContact OD1-N 3.47Å; D527-K530 VanDerWaalsContact OD2-CD 3.24Å; D527-K530 WeakPolarHBondContact OD2-CD 3.43Å; D527-K530 WeakPolarHBondContact OD2-CE 3.49Å; D527-K530 VanDerWaalsContact OD2-CG 3.31Å; D527-K530 WeakPolarHBondContact OD2-CG 3.38Å; D527-K530 IonicContact OD2-NZ 2.73Å; D527-K530 PolarHBondContact OD2-NZ 3Å; D527-G531 WeakPolarHBondContact O-CA 3.44Å; D527-G531 PolarHBondContact O-N 3.33Å; D527-K532 WeakPolarHBondContact CB-O 3.44Å; D527-K532 PolarHBondContact N-O 3.31Å; D527-K532 PolarHBondContact O-N 3.31Å; D527-K532 VanDerWaalsContact O-N 3.15Å; D527-V534 HydrophobicContact CB-CG2 3.77Å
528	L	96.8	Very high	95.7	Very high	8 Å²	8	56 Å²	56	4%	0.042	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-31	-175.9	-62.5	169.9	0	0	0	111.5	W466 V479 I493 I507 G510 L512 F526	W466-L528 HydrophobicContact CD2-CD1 4.18Å; W466-L528 HydrophobicContact CE3-CD1 4.07Å; W466-L528 HydrophobicContact CH2-CB 4.43Å; W466-L528 HydrophobicContact CZ3-CB 4.34Å; W466-L528 HydrophobicContact CZ3-CD1 4.26Å; V479-L528 HydrophobicContact CB-CD2 3.87Å; V479-L528 HydrophobicContact CG1-CD1 4.13Å; V479-L528 HydrophobicContact CG1-CD2 4.03Å; V479-L528 HydrophobicContact CG2-CD2 3.83Å; I493-L528 HydrophobicContact CD1-CB 3.93Å; I493-L528 HydrophobicContact CD1-CD2 4.12Å; I493-L528 HydrophobicContact CG2-CD2 4.15Å; I507-L528 HydrophobicContact CD1-CD1 3.67Å; I507-L528 HydrophobicContact CG1-CD1 4.01Å; I507-L528 HydrophobicContact CG2-CD1 3.97Å; G510-L528 VanDerWaalsContact O-CB 3.25Å; G510-L528 WeakPolarHBondContact O-CB 3.48Å; G510-L528 PolarHBondContact O-N 3.36Å; L512-L528 HydrophobicContact CB-CD1 4.32Å; L512-L528 HydrophobicContact CB-CD2 4.15Å; L512-L528 HydrophobicContact CB-CG 4.24Å; F526-L528 HydrophobicContact CD1-CD2 4.04Å; F526-L528 PolarHBondContact O-N 3Å
529	L	94.4	Very high	95.7	Very high	102 Å²	102	54.4 Å²	54.4	53%	0.534	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-34.4	-179.1	-54.8	179.7	0	0	0	111.5	W466 D527	W466-L529 HydrophobicContact CH2-CD2 4.07Å; D527-L529 VanDerWaalsContact C-N 3.3Å; D527-L529 PolarHBondContact OD1-N 3.16Å; D527-L529 VanDerWaalsContact OD1-N 3.11Å
530	K	94.3	Very high	95.5	Very high	118 Å²	118	54.8 Å²	54.8	51%	0.513	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-10.7	177.6	-59.7	-171.1	-165.4	104.9	0	113.8	D527 K532	D527-K530 HydrophobicContact CB-CB 4.2Å; D527-K530 PolarHBondContact OD1-N 3.47Å; D527-K530 VanDerWaalsContact OD2-CD 3.24Å; D527-K530 WeakPolarHBondContact OD2-CD 3.43Å; D527-K530 WeakPolarHBondContact OD2-CE 3.49Å; D527-K530 VanDerWaalsContact OD2-CG 3.31Å; D527-K530 WeakPolarHBondContact OD2-CG 3.38Å; D527-K530 IonicContact OD2-NZ 2.73Å; D527-K530 PolarHBondContact OD2-NZ 3Å; K530-K532 VanDerWaalsContact C-N 3.35Å; K530-K532 PolarHBondContact O-N 3.04Å
531	G	95.6	Very high	95.4	Very high	48 Å²	48	55.7 Å²	55.7	50%	0.495	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.7	36	-177.1	0	0	0	0	0	113.3	D527	D527-G531 WeakPolarHBondContact O-CA 3.44Å; D527-G531 PolarHBondContact O-N 3.33Å
532	K	95.6	Very high	95	Very high	149 Å²	149	55.6 Å²	55.6	65%	0.648	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.9	140.3	-172.8	-168.4	-179.1	176.2	-179.7	0	112.8	D527 K530	D527-K532 WeakPolarHBondContact CB-O 3.44Å; D527-K532 PolarHBondContact N-O 3.31Å; D527-K532 PolarHBondContact O-N 3.31Å; D527-K532 VanDerWaalsContact O-N 3.15Å; K530-K532 VanDerWaalsContact C-N 3.35Å; K530-K532 PolarHBondContact O-N 3.04Å
533	A	95.6	Very high	94.4	Very high	56 Å²	56	60 Å²	60	46%	0.463	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	140.5	171	0	0	0	0	0	112.2	F524 A525 F526	F524-A533 HydrophobicContact CE2-CB 4.07Å; A525-A533 WeakPolarHBondContact O-CA 3.35Å; F526-A533 HydrophobicContact CD2-CB 4.29Å
534	V	94.3	Very high	93.7	Very high	35 Å²	35	58.8 Å²	58.8	21%	0.212	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	129.9	177.6	-178.4	0	0	0	0	108.6	L334 A525 D527 M536	L334-V534 HydrophobicContact CD1-CG1 4.07Å; L334-V534 HydrophobicContact CD2-CG1 4.18Å; A525-V534 HydrophobicContact CB-CB 4.14Å; A525-V534 PolarHBondContact O-N 3.4Å; D527-V534 HydrophobicContact CB-CG2 3.77Å; V534-M536 HydrophobicContact CG1-CG 4.31Å; V534-M536 HydrophobicContact CG1-SD 4.07Å; V534-M536 PolarHBondContact O-N 3.46Å
535	N	92.3	Very high	93.3	Very high	168 Å²	168	59.8 Å²	59.8	90%	0.898	36%	0.361	S	S	*	.			trans	-82.2	100.7	178.4	-175.5	18.6	0	0	0	110.2
536	M	91.4	Very high	93.1	Very high	23 Å²	23	61.9 Å²	61.9	11%	0.113	37%	0.374	C	S	.	.			trans	-156.1	152.7	174.6	61.7	-173.4	-60	0	0	112	L334 I335 Y513 A525 V534 F538	L334-M536 HydrophobicContact CB-CE 4.46Å; L334-M536 HydrophobicContact CD2-SD 4.05Å; I335-M536 WeakPolarHBondContact O-CE 3.37Å; Y513-M536 HydrophobicContact CD1-CE 4.39Å; Y513-M536 HydrophobicContact CD1-SD 4.28Å; Y513-M536 HydrophobicContact CE1-CE 3.49Å; Y513-M536 VanDerWaalsContact CE1-CE 3.49Å; Y513-M536 HydrophobicContact CE1-SD 3.44Å; Y513-M536 WeakPolarHBondContact CE1-SD 3.24Å; A525-M536 HydrophobicContact CB-CG 3.52Å; A525-M536 HydrophobicContact CB-SD 3.74Å; V534-M536 HydrophobicContact CG1-CG 4.31Å; V534-M536 HydrophobicContact CG1-SD 4.07Å; V534-M536 PolarHBondContact O-N 3.46Å; M536-F538 HydrophobicContact CE-CD1 4.08Å; M536-F538 HydrophobicContact CE-CE1 3.9Å
537	T	95.1	Very high	93	Very high	73 Å²	73	61.3 Å²	61.3	45%	0.448	37%	0.371	S	S	.	.			trans	-151.4	142.7	175.7	-178.2	0	0	0	0	109.6	R521 V522	R521-T537 PolarHBondContact NH2-OG1 3.35Å; V522-T537 VanDerWaalsContact O-CA 3.27Å; V522-T537 WeakPolarHBondContact O-CA 3.4Å; V522-T537 WeakPolarHBondContact O-CB 3.49Å; V522-T537 PolarHBondContact O-OG1 2.91Å
538	F	95.3	Very high	93.1	Very high	12 Å²	12	60.5 Å²	60.5	5%	0.053	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	160	172.6	58.1	-93.5	0	0	0	109.9	I335 K336 L338 F506 Y513 R521 V522 M536	I335-F538 HydrophobicContact CB-CE1 4Å; I335-F538 HydrophobicContact CB-CZ 4.15Å; I335-F538 HydrophobicContact CG2-CD1 4.39Å; I335-F538 HydrophobicContact CG2-CE1 3.84Å; I335-F538 HydrophobicContact CG2-CE2 4.15Å; I335-F538 HydrophobicContact CG2-CZ 3.69Å; K336-F538 VanDerWaalsContact O-CB 3.32Å; K336-F538 WeakPolarHBondContact O-CB 3.37Å; L338-F538 HydrophobicContact CD1-CE2 4.04Å; L338-F538 HydrophobicContact CD2-CE2 4.46Å; L338-F538 HydrophobicContact CG-CD2 4.3Å; L338-F538 HydrophobicContact CG-CE2 3.94Å; F506-F538 HydrophobicContact CZ-CZ 4.13Å; Y513-F538 HydrophobicContact CD1-CE1 4.05Å; Y513-F538 HydrophobicContact CD1-CZ 4.32Å; Y513-F538 HydrophobicContact CE1-CE1 4.12Å; R521-F538 WeakPolarHBondContact CA-O 3.42Å; V522-F538 HydrophobicContact CB-CD1 4.21Å; V522-F538 HydrophobicContact CB-CD2 4.43Å; V522-F538 HydrophobicContact CB-CE1 3.89Å; V522-F538 HydrophobicContact CB-CE2 4.13Å; V522-F538 HydrophobicContact CB-CG 4.48Å; V522-F538 HydrophobicContact CB-CZ 3.85Å; V522-F538 HydrophobicContact CG1-CE1 4Å; V522-F538 HydrophobicContact CG1-CZ 4.25Å; V522-F538 HydrophobicContact CG2-CD2 4.31Å; V522-F538 HydrophobicContact CG2-CE1 4.03Å; V522-F538 HydrophobicContact CG2-CE2 3.62Å; V522-F538 HydrophobicContact CG2-CZ 3.47Å; V522-F538 VanDerWaalsContact CG2-CZ 3.47Å; V522-F538 PolarHBondContact N-O 2.96Å; V522-F538 PolarHBondContact O-N 3.48Å; M536-F538 HydrophobicContact CE-CD1 4.08Å; M536-F538 HydrophobicContact CE-CE1 3.9Å
539	D	94.9	Very high	93.1	Very high	106 Å²	106	60.2 Å²	60.2	57%	0.567	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.2	136.4	-179.5	-62.4	-26	0	0	0	110.6	R521	R521-D539 WeakPolarHBondContact CD-OD1 3.48Å; R521-D539 VanDerWaalsContact CG-OD1 3.22Å; R521-D539 WeakPolarHBondContact CG-OD1 3.35Å; R521-D539 IonicContact CZ-OD1 2.75Å; R521-D539 IonicContact NE-OD1 3.45Å; R521-D539 PolarHBondContact NE-OD1 3.47Å
540	L	93.9	Very high	93.3	Very high	9 Å²	9	55.3 Å²	55.3	5%	0.047	34%	0.34	C	S	.	.			trans	-98.7	-54	177.3	173.3	62.3	0	0	0	110.7	L338 T515 A520 L547 L550 L559	L338-L540 HydrophobicContact CD1-CD1 3.22Å; L338-L540 HydrophobicContact CD1-CG 4.44Å; T515-L540 HydrophobicContact CG2-CD2 3.72Å; A520-L540 WeakPolarHBondContact O-CB 3.39Å; A520-L540 PolarHBondContact O-N 3.25Å; L540-L547 HydrophobicContact CD2-CD2 3.97Å; L540-L550 HydrophobicContact CD1-CD1 4.01Å; L540-L550 HydrophobicContact CD2-CD1 4.04Å; L540-L550 HydrophobicContact CD2-CD2 3.96Å; L540-L559 HydrophobicContact CD1-CD2 3.77Å
541	R	92.9	Very high	93.4	Very high	30 Å²	30	50.4 Å²	50.4	11%	0.113	32%	0.32	C	S	.	.	S	Bend	trans	-163.1	168.2	-177	64	-179.8	-160.4	98.6	13.5	110.6	D519 A520 G544 G545 D563	D519-R541 WeakPolarHBondContact O-CG 3.19Å; D519-R541 PolarHBondContact O-NE 3.06Å; A520-R541 WeakPolarHBondContact CA-O 3.46Å; A520-R541 PolarHBondContact O-N 2.95Å; R541-G544 VanDerWaalsContact CZ-O 3.29Å; R541-G544 PolarHBondContact NH1-O 3.43Å; R541-G544 PolarHBondContact NH2-O 3.45Å; R541-G545 PolarHBondContact NH2-O 2.97Å; R541-D563 WeakPolarHBondContact CD-OD2 3.18Å; R541-D563 IonicContact CZ-OD1 3.95Å; R541-D563 IonicContact CZ-OD2 3.31Å; R541-D563 IonicContact NE-OD2 3.24Å; R541-D563 VanDerWaalsContact NH1-CG 3.32Å; R541-D563 IonicContact NH1-OD1 3.9Å; R541-D563 PolarHBondContact NH1-OD1 3.49Å; R541-D563 VanDerWaalsContact NH1-OD1 3.11Å; R541-D563 IonicContact NH1-OD2 3.65Å; R541-D563 PolarHBondContact NH1-OD2 3.29Å
542	S	88.6	Confident	93.4	Very high	102 Å²	102	48.3 Å²	48.3	71%	0.713	30%	0.297	S	S	*	.			trans	-61.6	140.2	171.6	-55.1	0	0	0	0	111
543	P	85.6	Confident	93.3	Very high	93 Å²	93	41.4 Å²	41.4	60%	0.604	27%	0.268	S	S	*	.	S	Bend	trans	-65.9	141.9	179.6	27	-33.9	0	0	0	111.1	A520	A520-P543 HydrophobicContact CB-CB 3.97Å
544	G	82.2	Confident	93.1	Very high	42 Å²	42	39.7 Å²	39.7	43%	0.433	25%	0.252	S	S	.	.			trans	124.4	152.3	174.6	0	0	0	0	0	113.6	R541	R541-G544 VanDerWaalsContact CZ-O 3.29Å; R541-G544 PolarHBondContact NH1-O 3.43Å; R541-G544 PolarHBondContact NH2-O 3.45Å
545	G	88.4	Confident	92.6	Very high	52 Å²	52	42.2 Å²	42.2	54%	0.536	26%	0.26	S	S	.	.	S	Bend	trans	71.8	175.2	-174.8	0	0	0	0	0	113.9	R541	R541-G545 PolarHBondContact NH2-O 2.97Å
546	V	93.3	Very high	92.4	Very high	45 Å²	45	36.7 Å²	36.7	27%	0.273	23%	0.231	S	C	.	.			trans	-91	124.5	-175.5	175	0	0	0	0	110.3	T350 F351 Q564	T350-V546 HydrophobicContact CG2-CB 4.3Å; F351-V546 HydrophobicContact CD1-CG1 4.26Å; F351-V546 HydrophobicContact CE1-CG1 3.59Å; F351-V546 HydrophobicContact CE2-CG1 4.3Å; F351-V546 HydrophobicContact CZ-CG1 3.6Å; F351-V546 HydrophobicContact CZ-CG2 4.44Å; V546-Q564 PolarHBondContact O-N 3.26Å
547	L	96.9	Very high	92.4	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	97.9	166.8	-176.6	66.9	0	0	0	109.4	N504 D519 L540 L550 V561 D563	N504-L547 HydrophobicContact CB-CD2 4.18Å; N504-L547 PolarHBondContact ND2-O 3.33Å; D519-L547 HydrophobicContact CB-CB 3.76Å; D519-L547 HydrophobicContact CB-CD2 3.61Å; D519-L547 HydrophobicContact CB-CG 4.32Å; L540-L547 HydrophobicContact CD2-CD2 3.97Å; L547-L550 HydrophobicContact CD2-CB 4.18Å; L547-L550 HydrophobicContact CD2-CD1 4.39Å; L547-L550 HydrophobicContact CD2-CD2 4.19Å; L547-V561 HydrophobicContact CD1-CG1 3.52Å; L547-D563 HydrophobicContact CD1-CB 4.34Å
548	A	97.3	Very high	92.3	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	-43.3	-177.2	0	0	0	0	0	111.8	F351 C403 S452 W562	F351-A548 HydrophobicContact CB-CB 4.42Å; F351-A548 HydrophobicContact CD1-CB 4.03Å; F351-A548 HydrophobicContact CG-CB 4.49Å; C403-A548 WeakPolarHBondContact CB-O 3.42Å; S452-A548 WeakPolarHBondContact CB-O 3.28Å; A548-W562 HydrophobicContact CB-CB 4.21Å; A548-W562 HydrophobicContact CB-CG 4.13Å; A548-W562 PolarHBondContact N-O 2.91Å
549	M	97.8	Very high	92.3	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.005	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	142.6	-177	-168.7	-160.3	80.6	0	0	111.4	T353 W354 Y560 V561 W562	T353-M549 WeakPolarHBondContact CA-SD 3.17Å; T353-M549 VanDerWaalsContact CB-SD 3.55Å; T353-M549 HydrophobicContact CG2-CB 4.25Å; T353-M549 HydrophobicContact CG2-CG 3.9Å; T353-M549 HydrophobicContact CG2-SD 3.87Å; W354-M549 VanDerWaalsContact CD1-CE 3.42Å; W354-M549 HydrophobicContact CG-CE 4.38Å; W354-M549 PolarHBondContact N-SD 3.34Å; W354-M549 VanDerWaalsContact N-SD 3.35Å; W354-M549 VanDerWaalsContact O-CE 3.27Å; W354-M549 WeakPolarHBondContact O-CE 3.48Å; M549-Y560 VanDerWaalsContact CE-C 3.42Å; M549-Y560 WeakPolarHBondContact CE-O 3.43Å; M549-V561 WeakPolarHBondContact O-CA 3.31Å; M549-W562 HydrophobicContact CB-CB 3.67Å; M549-W562 PolarHBondContact N-O 3.25Å; M549-W562 PolarHBondContact O-N 3.46Å
550	L	97.5	Very high	92.4	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	101.3	175.7	-175.3	66.8	0	0	0	108.3	K457 N504 F506 T515 L540 L547 L559 Y560 V561	K457-L550 VanDerWaalsContact CE-O 3.27Å; K457-L550 WeakPolarHBondContact CE-O 3.39Å; K457-L550 PolarHBondContact NZ-O 3.39Å; N504-L550 HydrophobicContact CB-CB 4.42Å; N504-L550 HydrophobicContact CB-CD2 4.04Å; F506-L550 HydrophobicContact CD1-CD2 3.6Å; F506-L550 HydrophobicContact CD1-CG 3.9Å; F506-L550 HydrophobicContact CE1-CD2 4.12Å; T515-L550 HydrophobicContact CG2-CD2 3.85Å; L540-L550 HydrophobicContact CD1-CD1 4.01Å; L540-L550 HydrophobicContact CD2-CD1 4.04Å; L540-L550 HydrophobicContact CD2-CD2 3.96Å; L547-L550 HydrophobicContact CD2-CB 4.18Å; L547-L550 HydrophobicContact CD2-CD1 4.39Å; L547-L550 HydrophobicContact CD2-CD2 4.19Å; L550-L559 HydrophobicContact CD1-CD1 4.2Å; L550-L559 HydrophobicContact CD1-CD2 3.37Å; L550-L559 HydrophobicContact CD1-CG 3.74Å; L550-L559 HydrophobicContact CG-CD1 4.48Å; L550-L559 HydrophobicContact CG-CD2 4.34Å; L550-Y560 WeakPolarHBondContact CA-O 3.4Å; L550-V561 HydrophobicContact CD1-CG2 3.64Å
551	S	96.9	Very high	92.5	Very high	15 Å²	15	35.2 Å²	35.2	11%	0.105	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	135.7	-176.5	-166.3	0	0	0	0	111.2	L559 Y560	S551-L559 CarbonylContact O-C 3.57Å; S551-L559 WeakPolarHBondContact O-CA 3.22Å; S551-Y560 PolarHBondContact N-O 2.91Å; S551-Y560 PolarHBondContact O-N 2.94Å
552	Y	96.8	Very high	92.8	Very high	4 Å²	4	33.8 Å²	33.8	2%	0.016	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	148.2	172.3	174	-110.5	0	0	0	110.1	D461 E462 I507 A508 P554 V572 Y574	D461-Y552 HydrophobicContact CB-CD1 4.42Å; D461-Y552 HydrophobicContact CB-CE1 4.47Å; E462-Y552 WeakPolarHBondContact OE1-CE1 3.37Å; E462-Y552 PolarHBondContact OE1-OH 2.85Å; I507-Y552 WeakPolarHBondContact O-CB 3.16Å; I507-Y552 VanDerWaalsContact O-CD1 3.3Å; I507-Y552 WeakPolarHBondContact O-CD1 3.24Å; A508-Y552 HydrophobicContact CB-CD1 3.5Å; A508-Y552 VanDerWaalsContact CB-CD1 3.5Å; A508-Y552 HydrophobicContact CB-CD2 4.01Å; A508-Y552 HydrophobicContact CB-CE1 3.63Å; A508-Y552 HydrophobicContact CB-CE2 4.14Å; A508-Y552 HydrophobicContact CB-CG 3.69Å; Y552-P554 VanDerWaalsContact CE1-CA 3.44Å; Y552-P554 HydrophobicContact CE1-CB 3.82Å; Y552-P554 WeakPolarHBondContact OH-CA 3.49Å; Y552-V572 HydrophobicContact CD2-CG2 4.09Å; Y552-V572 HydrophobicContact CE2-CG2 4.11Å; Y552-Y574 WeakPolarHBondContact CE2-OH 3.49Å; Y552-Y574 VanDerWaalsContact CZ-OH 3.26Å; Y552-Y574 PolarHBondContact OH-OH 2.97Å
553	S	93.4	Very high	93.1	Very high	4 Å²	4	29.4 Å²	29.4	3%	0.028	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	116.4	170.4	162.2	0	0	0	0	109	K555 D556 R557 H558	S553-K555 PolarHBondContact O-N 3.46Å; S553-D556 WeakPolarHBondContact CB-OD1 3.35Å; S553-D556 PolarHBondContact OG-OD1 3.09Å; S553-R557 WeakPolarHBondContact O-CA 3.16Å; S553-R557 PolarHBondContact O-N 3.05Å; S553-R557 VanDerWaalsContact O-N 3.08Å; S553-H558 PolarHBondContact N-O 3.38Å
554	P	90.1	Very high	93.4	Very high	19 Å²	19	28.7 Å²	28.7	12%	0.123	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-18.1	-178.8	27.9	-35.2	0	0	0	113.2	A460 E462 Y552	A460-P554 WeakPolarHBondContact O-CD 3.39Å; E462-P554 HydrophobicContact CG-CB 4.01Å; E462-P554 WeakPolarHBondContact OE1-CB 3.44Å; Y552-P554 VanDerWaalsContact CE1-CA 3.44Å; Y552-P554 HydrophobicContact CE1-CB 3.82Å; Y552-P554 WeakPolarHBondContact OH-CA 3.49Å
555	K	85.1	Confident	94	Very high	88 Å²	88	27.8 Å²	27.8	38%	0.383	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-46.1	-172.3	-68.1	-75	147.2	166.5	0	111.9	T358 A359 L361 S553	T358-K555 VanDerWaalsContact O-CE 3.24Å; T358-K555 WeakPolarHBondContact O-CE 3.45Å; T358-K555 WeakPolarHBondContact O-CG 3.46Å; A359-K555 WeakPolarHBondContact O-CE 3.34Å; A359-K555 PolarHBondContact O-NZ 3.3Å; L361-K555 HydrophobicContact CD1-CD 4.03Å; L361-K555 HydrophobicContact CD2-CB 3.91Å; L361-K555 HydrophobicContact CG-CB 4.04Å; L361-K555 HydrophobicContact CG-CD 3.76Å; L361-K555 HydrophobicContact CG-CG 4.39Å; S553-K555 PolarHBondContact O-N 3.46Å
556	D	87.7	Confident	94.3	Very high	53 Å²	53	29 Å²	29	28%	0.283	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.7	-1	-177.4	59.6	-2.4	0	0	0	112.6	S553 H558 Y560	S553-D556 WeakPolarHBondContact CB-OD1 3.35Å; S553-D556 PolarHBondContact OG-OD1 3.09Å; D556-H558 WeakPolarHBondContact CB-ND1 3.25Å; D556-H558 PolarHBondContact O-CE1 3.02Å; D556-H558 PolarHBondContact O-N 3.38Å; D556-H558 PolarHBondContact O-ND1 3.18Å; D556-H558 PolarHBondContact OD1-N 3.08Å; D556-H558 IonicContact OD1-ND1 2.59Å; D556-H558 IonicContact OD2-CG 2.69Å; D556-H558 IonicContact OD2-ND1 3.81Å; D556-Y560 WeakPolarHBondContact OD2-CE2 3.41Å; D556-Y560 PolarHBondContact OD2-OH 3.29Å
557	R	90.8	Very high	94.4	Very high	132 Å²	132	26.8 Å²	26.8	50%	0.498	12%	0.123	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.5	35	-175	-58.7	177.6	179	-167.4	1.4	112.5	S553 V572 Y574	S553-R557 WeakPolarHBondContact O-CA 3.16Å; S553-R557 PolarHBondContact O-N 3.05Å; S553-R557 VanDerWaalsContact O-N 3.08Å; R557-V572 WeakPolarHBondContact O-CB 3.4Å; R557-V572 WeakPolarHBondContact O-CG2 3.47Å; R557-V572 PolarHBondContact O-N 3.27Å; R557-Y574 HydrophobicContact CB-CE2 4.5Å; R557-Y574 HydrophobicContact CG-CE2 4.34Å
558	H	93.3	Very high	94.3	Very high	48 Å²	48	29.4 Å²	29.4	22%	0.222	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	151.9	176.4	-72	77.9	0	0	0	111.9	S553 D556 Y560 L569 Y570	S553-H558 PolarHBondContact N-O 3.38Å; D556-H558 WeakPolarHBondContact CB-ND1 3.25Å; D556-H558 PolarHBondContact O-CE1 3.02Å; D556-H558 PolarHBondContact O-N 3.38Å; D556-H558 PolarHBondContact O-ND1 3.18Å; D556-H558 PolarHBondContact OD1-N 3.08Å; D556-H558 IonicContact OD1-ND1 2.59Å; D556-H558 IonicContact OD2-CG 2.69Å; D556-H558 IonicContact OD2-ND1 3.81Å; H558-Y560 HydrophobicContact CB-CD2 4.32Å; H558-Y560 HydrophobicContact CB-CE2 3.9Å; H558-L569 HydrophobicContact CB-CD2 4.12Å; H558-Y570 CarbonylContact C-O 3.47Å; H558-Y570 VanDerWaalsContact CA-O 3.23Å; H558-Y570 WeakPolarHBondContact CA-O 3.42Å
559	L	95.6	Very high	94.2	Very high	0 Å²	0	30 Å²	30	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	116.1	165.9	-158.7	70.2	0	0	0	108.9	L338 F506 L540 L550 S551 V561 L569 Y570 V572	L338-L559 HydrophobicContact CD1-CD2 3.67Å; L338-L559 HydrophobicContact CD2-CD2 4.27Å; F506-L559 HydrophobicContact CD1-CD1 4.27Å; F506-L559 HydrophobicContact CD2-CD1 3.84Å; F506-L559 HydrophobicContact CE1-CD1 4.42Å; F506-L559 HydrophobicContact CE2-CD1 4.01Å; F506-L559 HydrophobicContact CG-CD1 3.96Å; F506-L559 HydrophobicContact CZ-CD1 4.29Å; L540-L559 HydrophobicContact CD1-CD2 3.77Å; L550-L559 HydrophobicContact CD1-CD1 4.2Å; L550-L559 HydrophobicContact CD1-CD2 3.37Å; L550-L559 HydrophobicContact CD1-CG 3.74Å; L550-L559 HydrophobicContact CG-CD1 4.48Å; L550-L559 HydrophobicContact CG-CD2 4.34Å; S551-L559 CarbonylContact O-C 3.57Å; S551-L559 WeakPolarHBondContact O-CA 3.22Å; L559-V561 HydrophobicContact CD2-CG2 4.32Å; L559-V561 HydrophobicContact CG-CG2 4.2Å; L559-L569 WeakPolarHBondContact O-CA 3.43Å; L559-Y570 PolarHBondContact N-O 3.12Å; L559-Y570 PolarHBondContact O-N 3.35Å; L559-V572 HydrophobicContact CB-CG2 4.38Å
560	Y	96.4	Very high	94.1	Very high	11 Å²	11	30.6 Å²	30.6	4%	0.043	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	124.4	175.6	-71.9	-110.9	0	0	0	108.7	W354 K356 M549 L550 S551 D556 H558 L569	W354-Y560 HydrophobicContact CD2-CD1 4.02Å; W354-Y560 AromaticContact CE2-CD1 3.65Å; W354-Y560 HydrophobicContact CE3-CD1 4.16Å; W354-Y560 HydrophobicContact CE3-CE1 4.42Å; W354-Y560 AromaticContact CH2-CD1 3.6Å; W354-Y560 HydrophobicContact CH2-CD1 3.6Å; W354-Y560 AromaticContact CH2-CE1 3.73Å; W354-Y560 HydrophobicContact CH2-CE1 3.73Å; W354-Y560 AromaticContact CZ2-CD1 3.44Å; W354-Y560 HydrophobicContact CZ2-CD1 3.44Å; W354-Y560 VanDerWaalsContact CZ2-CD1 3.44Å; W354-Y560 HydrophobicContact CZ2-CE1 4.07Å; W354-Y560 HydrophobicContact CZ2-CG 4.15Å; W354-Y560 AromaticContact CZ3-CD1 3.98Å; W354-Y560 HydrophobicContact CZ3-CD1 3.98Å; W354-Y560 AromaticContact CZ3-CE1 3.94Å; W354-Y560 HydrophobicContact CZ3-CE1 3.94Å; K356-Y560 HydrophobicContact CB-CE1 4.38Å; K356-Y560 HydrophobicContact CD-CE1 4.4Å; K356-Y560 WeakPolarHBondContact CD-OH 3.34Å; K356-Y560 HydrophobicContact CG-CE1 3.97Å; M549-Y560 VanDerWaalsContact CE-C 3.42Å; M549-Y560 WeakPolarHBondContact CE-O 3.43Å; L550-Y560 WeakPolarHBondContact CA-O 3.4Å; S551-Y560 PolarHBondContact N-O 2.91Å; S551-Y560 PolarHBondContact O-N 2.94Å; D556-Y560 WeakPolarHBondContact OD2-CE2 3.41Å; D556-Y560 PolarHBondContact OD2-OH 3.29Å; H558-Y560 HydrophobicContact CB-CD2 4.32Å; H558-Y560 HydrophobicContact CB-CE2 3.9Å; Y560-L569 HydrophobicContact CD1-CD2 3.78Å; Y560-L569 HydrophobicContact CD2-CD2 3.97Å; Y560-L569 HydrophobicContact CE1-CD2 3.71Å; Y560-L569 HydrophobicContact CE2-CD2 3.88Å; Y560-L569 HydrophobicContact CG-CD2 3.89Å
561	V	97.1	Very high	93.9	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.006	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	137.3	-171	171.2	0	0	0	0	110.6	W354 L547 M549 L550 L559 D563 V567 R568 Y570	W354-V561 PolarHBondContact NE1-O 2.89Å; L547-V561 HydrophobicContact CD1-CG1 3.52Å; M549-V561 WeakPolarHBondContact O-CA 3.31Å; L550-V561 HydrophobicContact CD1-CG2 3.64Å; L559-V561 HydrophobicContact CD2-CG2 4.32Å; L559-V561 HydrophobicContact CG-CG2 4.2Å; V561-D563 HydrophobicContact CG1-CB 3.99Å; V561-V567 CarbonylContact O-C 3.55Å; V561-V567 WeakPolarHBondContact O-CA 3.41Å; V561-R568 HydrophobicContact CB-CB 4.12Å; V561-R568 HydrophobicContact CG1-CB 4.37Å; V561-R568 PolarHBondContact N-O 2.9Å; V561-R568 PolarHBondContact O-N 3.3Å; V561-Y570 HydrophobicContact CB-CD2 4.29Å; V561-Y570 HydrophobicContact CB-CE2 4Å; V561-Y570 HydrophobicContact CG1-CE2 4.24Å; V561-Y570 HydrophobicContact CG2-CD2 3.69Å; V561-Y570 HydrophobicContact CG2-CE2 3.71Å
562	W	97.5	Very high	93.7	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	98.9	165.9	-168	-59.6	0	0	0	108.2	M347 S349 G352 W354 V368 E370 A548 M549 Q564 V567	M347-W562 HydrophobicContact CB-CH2 3.67Å; M347-W562 HydrophobicContact CB-CZ2 3.38Å; M347-W562 HydrophobicContact CE-CH2 3.78Å; M347-W562 HydrophobicContact CE-CZ3 4.28Å; M347-W562 HydrophobicContact CG-CH2 3.43Å; M347-W562 VanDerWaalsContact CG-CH2 3.43Å; M347-W562 HydrophobicContact CG-CZ2 3.52Å; M347-W562 HydrophobicContact CG-CZ3 3.97Å; M347-W562 HydrophobicContact SD-CH2 4.35Å; S349-W562 WeakPolarHBondContact O-CZ2 3.47Å; S349-W562 PolarHBondContact O-NE1 3.44Å; G352-W562 VanDerWaalsContact C-CE3 3.46Å; W354-W562 HydrophobicContact CB-CE3 4.22Å; W354-W562 HydrophobicContact CB-CZ3 4.26Å; V368-W562 HydrophobicContact CG1-CH2 4.21Å; V368-W562 HydrophobicContact CG1-CZ3 3.96Å; E370-W562 HydrophobicContact CG-CH2 4.39Å; A548-W562 HydrophobicContact CB-CB 4.21Å; A548-W562 HydrophobicContact CB-CG 4.13Å; A548-W562 PolarHBondContact N-O 2.91Å; M549-W562 HydrophobicContact CB-CB 3.67Å; M549-W562 PolarHBondContact N-O 3.25Å; M549-W562 PolarHBondContact O-N 3.46Å; W562-Q564 PolarHBondContact NE1-O 3.43Å; W562-V567 HydrophobicContact CD2-CG1 3.85Å; W562-V567 HydrophobicContact CE3-CG1 3.39Å; W562-V567 HydrophobicContact CG-CG1 4.42Å; W562-V567 HydrophobicContact CZ3-CG1 3.78Å
563	D	95.6	Very high	93.5	Very high	10 Å²	10	34.3 Å²	34.3	5%	0.053	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	107.7	-178.2	-176.2	-7.2	0	0	0	109	R541 L547 V561 S565 Y566	R541-D563 WeakPolarHBondContact CD-OD2 3.18Å; R541-D563 IonicContact CZ-OD1 3.95Å; R541-D563 IonicContact CZ-OD2 3.31Å; R541-D563 IonicContact NE-OD2 3.24Å; R541-D563 VanDerWaalsContact NH1-CG 3.32Å; R541-D563 IonicContact NH1-OD1 3.9Å; R541-D563 PolarHBondContact NH1-OD1 3.49Å; R541-D563 VanDerWaalsContact NH1-OD1 3.11Å; R541-D563 IonicContact NH1-OD2 3.65Å; R541-D563 PolarHBondContact NH1-OD2 3.29Å; L547-D563 HydrophobicContact CD1-CB 4.34Å; V561-D563 HydrophobicContact CG1-CB 3.99Å; D563-S565 PolarHBondContact O-N 3.31Å; D563-S565 VanDerWaalsContact O-N 3.09Å; D563-Y566 PolarHBondContact N-O 3.05Å; D563-Y566 WeakPolarHBondContact O-CB 3.46Å; D563-Y566 PolarHBondContact O-N 3.25Å
564	Q	92.3	Very high	93.4	Very high	78 Å²	78	34.2 Å²	34.2	36%	0.364	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.7	-107.8	-171.9	-59.9	158.7	57	0	0	110.4	T350 V546 W562	T350-Q564 CarbonylContact C-O 3.58Å; T350-Q564 VanDerWaalsContact CA-O 3.23Å; T350-Q564 WeakPolarHBondContact CA-O 3.19Å; V546-Q564 PolarHBondContact O-N 3.26Å; W562-Q564 PolarHBondContact NE1-O 3.43Å
565	S	93.9	Very high	93.3	Very high	22 Å²	22	37.1 Å²	37.1	15%	0.154	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.2	15.1	177.4	65.1	0	0	0	0	112.2	K346 M347 D563	K346-S565 CarbonylContact C-O 3.6Å; K346-S565 WeakPolarHBondContact CA-O 3.42Å; M347-S565 PolarHBondContact N-O 3.33Å; M347-S565 WeakPolarHBondContact O-CB 3.36Å; D563-S565 PolarHBondContact O-N 3.31Å; D563-S565 VanDerWaalsContact O-N 3.09Å
566	Y	95.3	Very high	93.1	Very high	77 Å²	77	35.1 Å²	35.1	30%	0.302	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	126.6	-174.7	-65.4	-86.3	0	0	0	111.1	I343 K346 D563	I343-Y566 HydrophobicContact CG2-CD1 3.9Å; K346-Y566 HydrophobicContact CB-CD1 4.13Å; K346-Y566 HydrophobicContact CB-CE1 3.97Å; K346-Y566 HydrophobicContact CD-CE1 4.06Å; K346-Y566 HydrophobicContact CG-CD1 4.24Å; K346-Y566 HydrophobicContact CG-CE1 3.89Å; D563-Y566 PolarHBondContact N-O 3.05Å; D563-Y566 WeakPolarHBondContact O-CB 3.46Å; D563-Y566 PolarHBondContact O-N 3.25Å
567	V	95.7	Very high	92.6	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	127.2	169.1	-69.4	0	0	0	0	109.5	V344 A345 M347 W354 F386 V561 W562	V344-V567 HydrophobicContact CB-CG2 4.11Å; V344-V567 PolarHBondContact N-O 3.03Å; A345-V567 HydrophobicContact CB-CG2 3.69Å; A345-V567 WeakPolarHBondContact O-CG2 3.3Å; A345-V567 PolarHBondContact O-N 3.44Å; M347-V567 HydrophobicContact CG-CG1 3.82Å; M347-V567 HydrophobicContact CG-CG2 4.38Å; M347-V567 HydrophobicContact SD-CG1 4.34Å; M347-V567 HydrophobicContact SD-CG2 4.24Å; W354-V567 HydrophobicContact CB-CG1 4.09Å; W354-V567 VanDerWaalsContact CD1-CG1 3.48Å; W354-V567 HydrophobicContact CD2-CB 3.91Å; W354-V567 HydrophobicContact CD2-CG1 4.07Å; W354-V567 HydrophobicContact CG-CB 4Å; W354-V567 HydrophobicContact CG-CG1 3.61Å; W354-V567 HydrophobicContact CZ2-CB 4.37Å; F386-V567 HydrophobicContact CE1-CG2 3.91Å; F386-V567 HydrophobicContact CZ-CG2 3.94Å; V561-V567 CarbonylContact O-C 3.55Å; V561-V567 WeakPolarHBondContact O-CA 3.41Å; W562-V567 HydrophobicContact CD2-CG1 3.85Å; W562-V567 HydrophobicContact CE3-CG1 3.39Å; W562-V567 HydrophobicContact CG-CG1 4.42Å; W562-V567 HydrophobicContact CZ3-CG1 3.78Å
568	R	95.2	Very high	91.3	Very high	55 Å²	55	38.4 Å²	38.4	21%	0.208	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	149.2	-170.7	-63.6	174.5	179.4	-106.5	-0	111.2	R342 I343 W354 V561 Y570	R342-R568 CarbonylContact O-C 3.51Å; R342-R568 VanDerWaalsContact O-CA 3.24Å; R342-R568 WeakPolarHBondContact O-CA 3.43Å; I343-R568 HydrophobicContact CG1-CG 4.26Å; W354-R568 WeakPolarHBondContact CZ2-O 3.44Å; V561-R568 HydrophobicContact CB-CB 4.12Å; V561-R568 HydrophobicContact CG1-CB 4.37Å; V561-R568 PolarHBondContact N-O 2.9Å; V561-R568 PolarHBondContact O-N 3.3Å; R568-Y570 HydrophobicContact CB-CE2 4.08Å
569	L	94.6	Very high	91.2	Very high	12 Å²	12	38 Å²	38	6%	0.063	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	138.6	169.4	-71.1	168.9	0	0	0	109.7	P341 R342 V344 W354 H558 L559 Y560	P341-L569 CarbonylContact C-O 3.51Å; P341-L569 WeakPolarHBondContact CA-O 3.46Å; R342-L569 PolarHBondContact N-O 3.47Å; R342-L569 PolarHBondContact O-N 3.07Å; V344-L569 HydrophobicContact CG2-CD1 3.82Å; V344-L569 HydrophobicContact CG2-CG 3.96Å; W354-L569 HydrophobicContact CH2-CD1 3.97Å; W354-L569 HydrophobicContact CH2-CD2 3.52Å; W354-L569 HydrophobicContact CH2-CG 3.55Å; W354-L569 HydrophobicContact CZ2-CD2 3.61Å; W354-L569 HydrophobicContact CZ2-CG 3.78Å; H558-L569 HydrophobicContact CB-CD2 4.12Å; L559-L569 WeakPolarHBondContact O-CA 3.43Å; Y560-L569 HydrophobicContact CD1-CD2 3.78Å; Y560-L569 HydrophobicContact CD2-CD2 3.97Å; Y560-L569 HydrophobicContact CE1-CD2 3.71Å; Y560-L569 HydrophobicContact CE2-CD2 3.88Å; Y560-L569 HydrophobicContact CG-CD2 3.89Å
570	Y	94.6	Very high	91	Very high	14 Å²	14	39.9 Å²	39.9	6%	0.055	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	140.9	166.3	-62.9	-106.2	0	0	0	108.7	L338 P341 H558 L559 V561 R568	L338-Y570 HydrophobicContact CB-CD1 4.01Å; L338-Y570 HydrophobicContact CB-CG 4.49Å; L338-Y570 HydrophobicContact CD1-CD1 4.45Å; P341-Y570 HydrophobicContact CB-CD1 3.94Å; P341-Y570 HydrophobicContact CB-CE1 3.61Å; H558-Y570 CarbonylContact C-O 3.47Å; H558-Y570 VanDerWaalsContact CA-O 3.23Å; H558-Y570 WeakPolarHBondContact CA-O 3.42Å; L559-Y570 PolarHBondContact N-O 3.12Å; L559-Y570 PolarHBondContact O-N 3.35Å; V561-Y570 HydrophobicContact CB-CD2 4.29Å; V561-Y570 HydrophobicContact CB-CE2 4Å; V561-Y570 HydrophobicContact CG1-CE2 4.24Å; V561-Y570 HydrophobicContact CG2-CD2 3.69Å; V561-Y570 HydrophobicContact CG2-CE2 3.71Å; R568-Y570 HydrophobicContact CB-CE2 4.08Å
571	V	93.4	Very high	90.7	Very high	42 Å²	42	41.6 Å²	41.6	26%	0.255	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	131	169.8	179.9	0	0	0	0	107.9	L338 I339 N340	L338-V571 WeakPolarHBondContact CA-O 3.42Å; I339-V571 HydrophobicContact CD1-CG1 4.32Å; I339-V571 HydrophobicContact CG1-CB 3.78Å; I339-V571 HydrophobicContact CG1-CG1 4.06Å; I339-V571 PolarHBondContact N-O 3.39Å; I339-V571 PolarHBondContact O-N 3.49Å; N340-V571 HydrophobicContact CB-CG2 4.21Å
572	V	93.6	Very high	90.3	Very high	6 Å²	6	43.9 Å²	43.9	4%	0.036	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	126.3	176.9	-178.9	0	0	0	0	109.3	I335 L338 Y552 R557 L559 Y574	I335-V572 HydrophobicContact CB-CG1 4.2Å; I335-V572 HydrophobicContact CD1-CG1 3.58Å; I335-V572 HydrophobicContact CG1-CG1 3.49Å; I335-V572 VanDerWaalsContact CG1-CG1 3.49Å; I335-V572 HydrophobicContact CG2-CG1 3.83Å; L338-V572 HydrophobicContact CD2-CB 4.44Å; L338-V572 HydrophobicContact CD2-CG2 3.92Å; Y552-V572 HydrophobicContact CD2-CG2 4.09Å; Y552-V572 HydrophobicContact CE2-CG2 4.11Å; R557-V572 WeakPolarHBondContact O-CB 3.4Å; R557-V572 WeakPolarHBondContact O-CG2 3.47Å; R557-V572 PolarHBondContact O-N 3.27Å; L559-V572 HydrophobicContact CB-CG2 4.38Å; V572-Y574 HydrophobicContact CB-CE2 4.31Å; V572-Y574 HydrophobicContact CG1-CD2 4.4Å; V572-Y574 HydrophobicContact CG1-CE1 4.01Å; V572-Y574 HydrophobicContact CG1-CE2 3.8Å
573	H	91.9	Very high	89.8	Confident	48 Å²	48	46.7 Å²	46.7	22%	0.222	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	124.3	174.9	-172.1	-80.3	0	0	0	109.9	K336 S337 I339	K336-H573 PolarHBondContact N-O 2.75Å; S337-H573 PolarHBondContact N-O 3.11Å; S337-H573 PolarHBondContact O-N 3.16Å; I339-H573 HydrophobicContact CD1-CB 4.39Å
574	Y	91.3	Very high	89.4	Confident	2 Å²	2	49.1 Å²	49.1	1%	0.008	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	161.8	-178.1	-65	-82.8	0	0	0	111.8	C333 L334 I335 Y552 R557 V572 S576 D577	C333-Y574 HydrophobicContact CB-CD1 4.35Å; C333-Y574 HydrophobicContact CB-CE1 4.46Å; C333-Y574 VanDerWaalsContact SG-CD1 3.53Å; C333-Y574 WeakPolarHBondContact SG-CE1 3.4Å; L334-Y574 CarbonylContact O-C 3.55Å; L334-Y574 WeakPolarHBondContact O-CA 3.25Å; I335-Y574 HydrophobicContact CG1-CD1 4.14Å; I335-Y574 HydrophobicContact CG1-CE1 3.74Å; Y552-Y574 WeakPolarHBondContact CE2-OH 3.49Å; Y552-Y574 VanDerWaalsContact CZ-OH 3.26Å; Y552-Y574 PolarHBondContact OH-OH 2.97Å; R557-Y574 HydrophobicContact CB-CE2 4.5Å; R557-Y574 HydrophobicContact CG-CE2 4.34Å; V572-Y574 HydrophobicContact CB-CE2 4.31Å; V572-Y574 HydrophobicContact CG1-CD2 4.4Å; V572-Y574 HydrophobicContact CG1-CE1 4.01Å; V572-Y574 HydrophobicContact CG1-CE2 3.8Å; Y574-S576 WeakPolarHBondContact CB-OG 2.98Å; Y574-S576 PolarHBondContact O-N 3.46Å; Y574-D577 PolarHBondContact N-OD2 3.42Å; Y574-D577 PolarHBondContact O-N 3.09Å
575	I	87.8	Confident	89.2	Confident	80 Å²	80	47.1 Å²	47.1	41%	0.41	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-66.7	-29.6	173	-65.1	177.1	0	0	0	111	L334 K336 D577	L334-I575 HydrophobicContact CB-CD1 3.84Å; L334-I575 HydrophobicContact CB-CG1 4.39Å; L334-I575 WeakPolarHBondContact O-CG1 3.4Å; L334-I575 PolarHBondContact O-N 2.93Å; K336-I575 HydrophobicContact CB-CG1 3.83Å; K336-I575 HydrophobicContact CG-CG1 4.38Å; I575-D577 VanDerWaalsContact C-N 3.25Å; I575-D577 PolarHBondContact O-N 3.24Å
576	S	81.9	Confident	88.9	Confident	47 Å²	47	49 Å²	49	33%	0.329	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-72	-14	178.2	57.2	0	0	0	0	115	E332 Y574 E578	E332-S576 WeakPolarHBondContact O-CB 3.32Å; E332-S576 PolarHBondContact O-OG 2.92Å; Y574-S576 WeakPolarHBondContact CB-OG 2.98Å; Y574-S576 PolarHBondContact O-N 3.46Å; S576-E578 PolarHBondContact O-N 3.47Å
577	D	77.3	Confident	88.3	Confident	76 Å²	76	46.7 Å²	46.7	41%	0.406	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-77.4	-4.1	-177.8	-61.4	-27.9	0	0	0	111.6	Y574 I575	Y574-D577 PolarHBondContact N-OD2 3.42Å; Y574-D577 PolarHBondContact O-N 3.09Å; I575-D577 VanDerWaalsContact C-N 3.25Å; I575-D577 PolarHBondContact O-N 3.24Å
578	E	62.8	Low	87.7	Confident	178 Å²	178	50.9 Å²	50.9	83%	0.832	26%	0.257	S	S	*	.			trans	-101.6	0	171	-60.3	-171.3	151.4	0	0	111.6	K336 S576	K336-E578 IonicContact NZ-OE1 2.89Å; K336-E578 PolarHBondContact NZ-OE1 3.31Å; K336-E578 IonicContact NZ-OE2 2.92Å; K336-E578 PolarHBondContact NZ-OE2 3.38Å; S576-E578 PolarHBondContact O-N 3.47Å

Retrieved 578 of 578 residues in 315.5 ms (Link to these results)

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