A0A087XWI9_POEFO Loading...

chymotrypsin

AlphaFold DB , UniProt , Accession A0A087XWI9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 278 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.4	Very low	40.4	Very low	233 Å²	233	137 Å²	137	100%	1.148	83%	0.825	S	S	*	*				0	112.7	0	-77.7	179.5	170.5	0	0	105.6
2	Y	37.3	Very low	40.7	Very low	205 Å²	205	140.9 Å²	140.9	80%	0.804	83%	0.827	S	S	*	*			cis	-154.5	150.4	32.2	-118.5	-97.4	0	0	0	110.4
3	K	39.3	Very low	41	Very low	182 Å²	182	142.4 Å²	142.4	79%	0.791	83%	0.829	S	S	*	*			trans	1.8	128.4	162.7	-72.4	172.6	172.1	176.4	0	123.7
4	S	40.8	Very low	41.7	Very low	109 Å²	109	150.1 Å²	150.1	76%	0.762	84%	0.837	S	S	*	*				34.1	124.1	111.6	-179.6	0	0	0	0	121.2
5	S	40.2	Very low	41.8	Very low	113 Å²	113	146.6 Å²	146.6	79%	0.79	84%	0.836	S	S	*	*				168.3	138.7	106.5	55.4	0	0	0	0	112.2
6	G	37.4	Very low	42.1	Very low	73 Å²	73	147.9 Å²	147.9	75%	0.753	84%	0.835	S	S	*	*			trans	-70.5	-154.6	179.1	0	0	0	0	0	115
7	P	55.2	Low	42.2	Very low	118 Å²	118	144.9 Å²	144.9	77%	0.766	83%	0.833	S	S	*	*			cis	-144.7	-169.8	9.8	34.2	-8.8	0	0	0	116.5
8	K	38.6	Very low	42.4	Very low	207 Å²	207	145.6 Å²	145.6	90%	0.9	83%	0.825	S	S	*	*			trans	104.4	134.7	147.2	-71.9	178.3	179.6	-178.3	0	121.8
9	G	36.8	Very low	42.6	Very low	72 Å²	72	145.7 Å²	145.7	74%	0.742	82%	0.822	S	S	*	*			trans	139.3	80.7	159.8	0	0	0	0	0	112.2
10	S	37.3	Very low	42.9	Very low	119 Å²	119	149.2 Å²	149.2	83%	0.832	82%	0.822	S	S	*	*				54.1	70.1	85.7	179.5	0	0	0	0	115
11	G	39.9	Very low	43.5	Very low	76 Å²	76	148.9 Å²	148.9	78%	0.784	82%	0.818	S	S	*	*			trans	-91.9	115.9	162.5	0	0	0	0	0	110.7
12	H	43.9	Very low	44.1	Very low	184 Å²	184	145 Å²	145	85%	0.852	80%	0.801	S	S	*	*			trans	-84.5	108.2	163.1	-106.7	73.7	0	0	0	107.1
13	D	44.6	Very low	45	Very low	160 Å²	160	139.4 Å²	139.4	86%	0.856	79%	0.792	S	S	*	*			trans	-137.8	139	164.5	-98	-36.3	0	0	0	111.2
14	R	51.3	Low	45.4	Very low	250 Å²	250	136.2 Å²	136.2	94%	0.943	79%	0.791	S	S	*	*			trans	-63.1	129.1	-166.1	-67.2	164.2	158.7	-172.4	-6.2	111.9
15	A	42.5	Very low	46.2	Very low	98 Å²	98	137.5 Å²	137.5	81%	0.81	79%	0.788	S	S	*	*			trans	-124	123.7	161.8	0	0	0	0	0	109.3	A17	A15-A17 PolarHBondContact O-N 3.49Å
16	M	47.9	Very low	46.6	Very low	167 Å²	167	135.9 Å²	135.9	82%	0.823	78%	0.782	S	S	*	*			trans	-56.2	130.6	-178.5	-65.6	-139.8	-123.2	0	0	111.7	F18	M16-F18 VanDerWaalsContact C-N 3.34Å; M16-F18 HydrophobicContact CB-CD2 4.33Å; M16-F18 PolarHBondContact O-N 2.96Å
17	A	43.6	Very low	47.1	Very low	97 Å²	97	141.4 Å²	141.4	80%	0.802	79%	0.786	S	S	*	*			trans	-68.9	91.9	165.9	0	0	0	0	0	109.1	A15 L19	A15-A17 PolarHBondContact O-N 3.49Å; A17-L19 PolarHBondContact O-N 3.01Å
18	F	45.1	Very low	46.9	Very low	157 Å²	157	141.8 Å²	141.8	69%	0.689	79%	0.786	S	S	*	*			trans	-74.7	99.1	163.7	-99.4	-91.8	0	0	0	108.3	M16 W20	M16-F18 VanDerWaalsContact C-N 3.34Å; M16-F18 HydrophobicContact CB-CD2 4.33Å; M16-F18 PolarHBondContact O-N 2.96Å; F18-W20 VanDerWaalsContact C-N 3.35Å; F18-W20 PolarHBondContact O-N 3.22Å
19	L	46.2	Very low	47.2	Very low	148 Å²	148	134.9 Å²	134.9	78%	0.775	77%	0.773	S	S	*	*			trans	-65.5	95.2	163.3	-92.8	121	0	0	0	108.7	A17 I21	A17-L19 PolarHBondContact O-N 3.01Å; L19-I21 VanDerWaalsContact C-N 3.35Å; L19-I21 PolarHBondContact O-N 2.87Å; L19-I21 VanDerWaalsContact O-N 3.15Å
20	W	48.7	Very low	47.9	Very low	215 Å²	215	134 Å²	134	81%	0.814	76%	0.759	S	S	*	*			trans	-76.8	89.6	162.1	-78.3	85.6	0	0	0	108.3	F18 L22	F18-W20 VanDerWaalsContact C-N 3.35Å; F18-W20 PolarHBondContact O-N 3.22Å; W20-L22 VanDerWaalsContact C-N 3.3Å; W20-L22 PolarHBondContact O-N 3.02Å
21	I	56	Low	48.6	Very low	144 Å²	144	133 Å²	133	74%	0.738	76%	0.758	S	S	*	*			trans	-70.6	96	162.4	-60.1	175.6	0	0	0	105.9	L19 S23	L19-I21 VanDerWaalsContact C-N 3.35Å; L19-I21 PolarHBondContact O-N 2.87Å; L19-I21 VanDerWaalsContact O-N 3.15Å; I21-S23 PolarHBondContact O-N 3.15Å
22	L	54	Low	49.8	Very low	150 Å²	150	135.7 Å²	135.7	79%	0.785	75%	0.745	S	S	*	*			trans	-61.1	92	162.3	-94.5	139.3	0	0	0	107.3	W20 C24	W20-L22 VanDerWaalsContact C-N 3.3Å; W20-L22 PolarHBondContact O-N 3.02Å; L22-C24 PolarHBondContact O-N 2.86Å
23	S	55.8	Low	51.9	Low	88 Å²	88	128.7 Å²	128.7	62%	0.615	72%	0.723	S	S	*	*			trans	-64.2	92.5	161.7	-179.6	0	0	0	0	107	I21 L25	I21-S23 PolarHBondContact O-N 3.15Å; S23-L25 PolarHBondContact O-N 2.91Å
24	C	48.5	Very low	54.4	Low	115 Å²	115	123.5 Å²	123.5	78%	0.777	70%	0.699	S	S	*	*			trans	-66	82.2	157.2	-79.5	0	0	0	0	106.7	L22 A26	L22-C24 PolarHBondContact O-N 2.86Å; C24-A26 PolarHBondContact O-N 2.79Å
25	L	55.8	Low	56.6	Low	136 Å²	136	111.6 Å²	111.6	71%	0.712	65%	0.654	S	S	*	*			trans	-61.1	84.1	152.4	-84.8	152.4	0	0	0	105.8	S23 F27	S23-L25 PolarHBondContact O-N 2.91Å; L25-F27 PolarHBondContact O-N 2.79Å
26	A	50.6	Low	59.2	Low	80 Å²	80	110.6 Å²	110.6	66%	0.661	64%	0.638	S	S	*	*			trans	-61.6	91.9	156.9	0	0	0	0	0	104.9	C24 V28	C24-A26 PolarHBondContact O-N 2.79Å; A26-V28 PolarHBondContact O-N 2.83Å
27	F	46.5	Very low	61.6	Low	189 Å²	189	103.6 Å²	103.6	83%	0.829	61%	0.605	S	S	*	*			trans	-58.2	93	153.1	-95.4	-88.8	0	0	0	104.5	L25 G29	L25-F27 PolarHBondContact O-N 2.79Å; F27-G29 PolarHBondContact O-N 2.77Å
28	V	50.7	Low	64.1	Low	126 Å²	126	102.4 Å²	102.4	76%	0.764	60%	0.595	S	S	*	*			trans	-66.4	80.2	157.3	-176.7	0	0	0	0	103.5	A26 A30	A26-V28 PolarHBondContact O-N 2.83Å; V28-A30 PolarHBondContact O-N 2.83Å
29	G	45	Very low	66.6	Low	62 Å²	62	97 Å²	97	64%	0.639	57%	0.573	S	S	*	*			trans	-58.2	102.4	160.3	0	0	0	0	0	104.1	F27 A31	F27-G29 PolarHBondContact O-N 2.77Å; G29-A31 VanDerWaalsContact C-N 3.26Å; G29-A31 PolarHBondContact O-N 2.89Å
30	A	52.1	Low	69	Low	54 Å²	54	95 Å²	95	45%	0.446	57%	0.567	S	S	.	*			trans	-56.7	103.7	166.4	0	0	0	0	0	104.7	V28 Y32	V28-A30 PolarHBondContact O-N 2.83Å; A30-Y32 HydrophobicContact CB-CE1 4.36Å; A30-Y32 WeakPolarHBondContact O-CD2 3.34Å; A30-Y32 PolarHBondContact O-N 2.84Å
31	A	51.9	Low	71.3	Confident	98 Å²	98	85.4 Å²	85.4	81%	0.81	53%	0.532	S	S	*	.			trans	-60.6	99.8	160.7	0	0	0	0	0	103.6	G29 G33	G29-A31 VanDerWaalsContact C-N 3.26Å; G29-A31 PolarHBondContact O-N 2.89Å; A31-G33 PolarHBondContact O-N 2.74Å
32	Y	65.4	Low	73.1	Confident	131 Å²	131	82.8 Å²	82.8	51%	0.514	52%	0.523	S	S	.	.			trans	-64.6	89.5	174.4	-67.2	-77.7	0	0	0	105.8	A30 L147	A30-Y32 HydrophobicContact CB-CE1 4.36Å; A30-Y32 WeakPolarHBondContact O-CD2 3.34Å; A30-Y32 PolarHBondContact O-N 2.84Å; Y32-L147 HydrophobicContact CD2-CB 4.34Å; Y32-L147 HydrophobicContact CG-CB 4.41Å
33	G	87.4	Confident	74.8	Confident	37 Å²	37	76.9 Å²	76.9	38%	0.381	49%	0.492	S	S	.	.			trans	-63.1	172	172	0	0	0	0	0	109.9	A31	A31-G33 PolarHBondContact O-N 2.74Å
34	C	97.3	Very high	75.9	Confident	51 Å²	51	77 Å²	77	35%	0.345	49%	0.489	S	S	.	.	S	Bend	trans	-86.1	157.1	172.4	63.8	0	0	0	0	110.7	T36 P153 C155	C34-T36 PolarHBondContact O-N 3.34Å; C34-T36 PolarHBondContact O-OG1 3.15Å; C34-P153 CarbonylContact C-O 3.57Å; C34-P153 WeakPolarHBondContact CA-O 3.25Å; C34-P153 HydrophobicContact CB-CG 4.45Å; C34-C155 HydrophobicContact CB-CB 3.92Å; C34-C155 WeakPolarHBondContact CB-SG 3.31Å; C34-C155 PolarHBondContact O-SG 2.79Å; C34-C155 WeakPolarHBondContact SG-CA 3.21Å; C34-C155 WeakPolarHBondContact SG-CB 3.37Å; C34-C155 CovalentContact SG-SG 2.04Å; C34-C155 PolarHBondContact SG-SG 2.91Å
35	G	97.9	Very high	76.5	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	46%	0.456	C	S	.	.	S	Bend	trans	66.2	12.8	164.9	0	0	0	0	0	116.1	P153 W240	G35-P153 PolarHBondContact N-O 3.33Å; G35-W240 WeakPolarHBondContact CA-O 3.45Å; G35-W240 PolarHBondContact O-N 2.82Å
36	T	97.5	Very high	76.7	Confident	77 Å²	77	70 Å²	70	47%	0.472	44%	0.44	S	S	.	.			trans	-123.3	84.4	-176.5	41.6	0	0	0	0	109.2	C34 A239	C34-T36 PolarHBondContact O-N 3.34Å; C34-T36 PolarHBondContact O-OG1 3.15Å; T36-A239 HydrophobicContact CG2-CB 4.33Å
37	P	97.3	Very high	76.4	Confident	20 Å²	20	70.5 Å²	70.5	13%	0.13	44%	0.444	C	S	.	.			trans	-68.2	138.2	-173.6	30.4	-36	0	0	0	110.7	I39 S59 P61 W62	P37-I39 WeakPolarHBondContact CB-O 3.42Å; P37-I39 PolarHBondContact O-N 3.01Å; P37-S59 WeakPolarHBondContact CB-O 3.36Å; P37-P61 HydrophobicContact CB-CG 3.78Å; P37-W62 HydrophobicContact CB-CZ3 4.39Å; P37-W62 HydrophobicContact CG-CH2 4.37Å
38	A	97.2	Very high	76.4	Confident	72 Å²	72	72.2 Å²	72.2	60%	0.595	45%	0.445	S	S	*	.	S	Bend	trans	-64.8	-28.5	176.7	0	0	0	0	0	112.2	M149	A38-M149 HydrophobicContact CB-CB 3.79Å
39	I	97.6	Very high	76.3	Confident	43 Å²	43	68.7 Å²	68.7	22%	0.221	42%	0.422	C	S	.	.	S	Bend	trans	-108	113.7	171.3	-63.2	162.1	0	0	0	107.3	P37 V56 H58 S59 M149	P37-I39 WeakPolarHBondContact CB-O 3.42Å; P37-I39 PolarHBondContact O-N 3.01Å; I39-V56 HydrophobicContact CG2-CG1 3.75Å; I39-H58 HydrophobicContact CD1-CB 3.96Å; I39-S59 VanDerWaalsContact O-CA 3.31Å; I39-S59 WeakPolarHBondContact O-CA 3.48Å; I39-S59 WeakPolarHBondContact O-CB 3.08Å; I39-M149 HydrophobicContact CD1-CE 3.93Å; I39-M149 HydrophobicContact CG1-CE 4.19Å
40	T	96.4	Very high	76.7	Confident	107 Å²	107	69.8 Å²	69.8	66%	0.656	42%	0.416	S	S	*	.			trans	-69.1	131.6	-178.7	-50	0	0	0	0	110.9
41	P	96.2	Very high	77.4	Confident	13 Å²	13	70.1 Å²	70.1	8%	0.084	41%	0.41	C	S	.	.			trans	-67.2	140.8	174.2	28	-34.6	0	0	0	110.6	I43 W60 W240	P41-I43 HydrophobicContact CB-CD1 4.45Å; P41-I43 HydrophobicContact CB-CG1 4.29Å; P41-I43 HydrophobicContact CG-CD1 4.37Å; P41-W60 HydrophobicContact CB-CH2 4Å; P41-W60 HydrophobicContact CB-CZ2 3.49Å; P41-W60 VanDerWaalsContact CB-CZ2 3.49Å; P41-W60 HydrophobicContact CG-CH2 3.73Å; P41-W60 HydrophobicContact CG-CZ2 3.78Å; P41-W60 HydrophobicContact CG-CZ3 4.24Å; P41-W240 HydrophobicContact CG-CZ2 4.16Å
42	V	94.2	Very high	78.5	Confident	90 Å²	90	66.3 Å²	66.3	55%	0.545	38%	0.38	S	S	.	.			trans	-101.6	110.4	169.6	177.9	0	0	0	0	107.2	T44 V56 Q190	V42-T44 HydrophobicContact CG1-CG2 4.03Å; V42-V56 HydrophobicContact CB-CG2 3.83Å; V42-V56 HydrophobicContact CG2-CG2 3.9Å; V42-Q190 PolarHBondContact O-NE2 2.89Å
43	I	89.6	Confident	79.6	Confident	26 Å²	26	61.5 Å²	61.5	13%	0.133	36%	0.362	C	S	.	.			trans	-109	102.4	-176.3	-57.3	154.1	0	0	0	107.9	P41 Y46 E53 W60 V170 A192 W240	P41-I43 HydrophobicContact CB-CD1 4.45Å; P41-I43 HydrophobicContact CB-CG1 4.29Å; P41-I43 HydrophobicContact CG-CD1 4.37Å; I43-Y46 HydrophobicContact CB-CE2 4.03Å; I43-Y46 HydrophobicContact CG2-CD2 4.19Å; I43-Y46 HydrophobicContact CG2-CE2 3.85Å; I43-E53 WeakPolarHBondContact CA-OE1 3.19Å; I43-W60 HydrophobicContact CD1-CH2 4.23Å; I43-W60 HydrophobicContact CD1-CZ2 4.2Å; I43-W60 HydrophobicContact CG1-CZ2 4.34Å; I43-V170 HydrophobicContact CD1-CG2 3.72Å; I43-V170 HydrophobicContact CG1-CG2 4.43Å; I43-A192 HydrophobicContact CG2-CB 3.82Å; I43-W240 HydrophobicContact CD1-CH2 3.69Å; I43-W240 HydrophobicContact CD1-CZ2 3.84Å
44	T	78.4	Confident	79.9	Confident	89 Å²	89	64.4 Å²	64.4	55%	0.546	37%	0.366	S	S	.	.			trans	-89.9	-15.6	-178.9	81.3	0	0	0	0	111.9	V42 Y46 I49 E53	V42-T44 HydrophobicContact CG1-CG2 4.03Å; T44-Y46 VanDerWaalsContact C-N 3.33Å; T44-Y46 PolarHBondContact O-N 3.45Å; T44-Y46 VanDerWaalsContact O-N 3.17Å; T44-I49 WeakPolarHBondContact OG1-CD1 3.07Å; T44-E53 WeakPolarHBondContact CB-OE2 3.48Å; T44-E53 PolarHBondContact N-OE1 3.09Å; T44-E53 PolarHBondContact N-OE2 2.63Å; T44-E53 PolarHBondContact OG1-OE2 3.26Å
45	G	62	Low	79.8	Confident	9 Å²	9	62.1 Å²	62.1	9%	0.093	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-75.9	7.6	-171.1	0	0	0	0	0	118.8	A47 E53	G45-A47 PolarHBondContact O-N 3.49Å; G45-E53 PolarHBondContact N-OE1 2.79Å
46	Y	60.3	Low	79.8	Confident	97 Å²	97	64.4 Å²	64.4	38%	0.38	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-63.6	-8.3	178.1	-71.9	-58.8	0	0	0	114.4	I43 T44 K168 A192	I43-Y46 HydrophobicContact CB-CE2 4.03Å; I43-Y46 HydrophobicContact CG2-CD2 4.19Å; I43-Y46 HydrophobicContact CG2-CE2 3.85Å; T44-Y46 VanDerWaalsContact C-N 3.33Å; T44-Y46 PolarHBondContact O-N 3.45Å; T44-Y46 VanDerWaalsContact O-N 3.17Å; Y46-K168 HydrophobicContact CD1-CB 4.14Å; Y46-K168 HydrophobicContact CD1-CD 3.32Å; Y46-K168 HydrophobicContact CD1-CG 4.37Å; Y46-K168 HydrophobicContact CE1-CB 3.77Å; Y46-K168 HydrophobicContact CE1-CD 3.82Å; Y46-K168 HydrophobicContact CE1-CG 4.46Å; Y46-K168 HydrophobicContact CG-CD 4.29Å; Y46-K168 PolarHBondContact O-NZ 2.93Å; Y46-A192 HydrophobicContact CD1-CB 3.92Å; Y46-A192 HydrophobicContact CE1-CB 4.05Å
47	A	43.3	Very low	79.9	Confident	90 Å²	90	63.3 Å²	63.3	74%	0.744	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-119	24.1	-172.4	0	0	0	0	0	116.1	G45	G45-A47 PolarHBondContact O-N 3.49Å
48	R	47.3	Very low	79.9	Confident	224 Å²	224	63.5 Å²	63.5	85%	0.845	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.4	72.8	-178.3	-58.1	175.6	166.7	170.1	-3.7	114.8
49	I	47.8	Very low	79.9	Confident	53 Å²	53	60.1 Å²	60.1	27%	0.272	33%	0.33	S	S	.	.			trans	-89.8	131.4	158.7	-67.8	179.3	0	0	0	108.8	T44 G52 E53	T44-I49 WeakPolarHBondContact OG1-CD1 3.07Å; I49-G52 WeakPolarHBondContact CG2-O 3.29Å; I49-E53 HydrophobicContact CD1-CB 4.24Å; I49-E53 WeakPolarHBondContact CD1-OE2 3.48Å
50	V	54.3	Low	80	Confident	85 Å²	85	58.2 Å²	58.2	52%	0.515	32%	0.32	S	S	.	.	S	Bend	trans	-94.6	122.4	174.6	-173.2	0	0	0	0	108.9	G220 T255	V50-G220 WeakPolarHBondContact CA-O 3.46Å; V50-T255 HydrophobicContact CG1-CG2 4.05Å
51	N	66.2	Low	80.1	Confident	61 Å²	61	53.2 Å²	53.2	33%	0.326	29%	0.289	S	S	.	.	S	Bend	trans	78.8	23.7	-180	-48.2	-47.3	0	0	0	117.5	T177	N51-T177 WeakPolarHBondContact CB-O 3.41Å
52	G	75.4	Confident	80.2	Confident	18 Å²	18	52.6 Å²	52.6	19%	0.186	29%	0.285	C	S	.	.			trans	72.2	-179.3	177.7	0	0	0	0	0	114	I49 Q190	I49-G52 WeakPolarHBondContact CG2-O 3.29Å; G52-Q190 CarbonylContact C-O 3.51Å; G52-Q190 VanDerWaalsContact CA-O 3.28Å; G52-Q190 WeakPolarHBondContact CA-O 3.35Å
53	E	88.4	Confident	80.4	Confident	29 Å²	29	48.5 Å²	48.5	14%	0.136	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	159.1	177	64.4	-172.3	160.1	0	0	109.8	I43 T44 G45 I49 A55 Q189 Q190	I43-E53 WeakPolarHBondContact CA-OE1 3.19Å; T44-E53 WeakPolarHBondContact CB-OE2 3.48Å; T44-E53 PolarHBondContact N-OE1 3.09Å; T44-E53 PolarHBondContact N-OE2 2.63Å; T44-E53 PolarHBondContact OG1-OE2 3.26Å; G45-E53 PolarHBondContact N-OE1 2.79Å; I49-E53 HydrophobicContact CD1-CB 4.24Å; I49-E53 WeakPolarHBondContact CD1-OE2 3.48Å; E53-A55 PolarHBondContact O-N 2.87Å; E53-Q189 CarbonylContact O-C 3.49Å; E53-Q189 WeakPolarHBondContact O-CA 3.18Å; E53-Q190 HydrophobicContact CG-CG 3.62Å; E53-Q190 PolarHBondContact N-O 2.88Å; E53-Q190 PolarHBondContact O-N 3.12Å; E53-Q190 PolarHBondContact OE1-NE2 2.68Å
54	E	93.5	Very high	80.9	Confident	98 Å²	98	47.3 Å²	47.3	46%	0.458	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	134.4	171	-167.6	-169.8	154.8	0	0	109.9	H104 L187	E54-H104 IonicContact OE1-CE1 3.54Å; E54-H104 IonicContact OE1-NE2 3.7Å; E54-H104 PolarHBondContact OE1-NE2 3.22Å; E54-L187 HydrophobicContact CG-CB 4.03Å; E54-L187 HydrophobicContact CG-CD1 4.29Å; E54-L187 WeakPolarHBondContact OE2-CD1 3.37Å
55	A	96	Very high	81.8	Confident	3 Å²	3	43 Å²	43	3%	0.025	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-72.6	152.5	172	0	0	0	0	0	110.9	E53 H104 L188 Q190	E53-A55 PolarHBondContact O-N 2.87Å; A55-H104 PolarHBondContact O-CE1 3.41Å; A55-L188 HydrophobicContact CB-CB 4.44Å; A55-L188 HydrophobicContact CB-CD2 4.24Å; A55-L188 HydrophobicContact CB-CG 4.15Å; A55-L188 PolarHBondContact N-O 2.82Å; A55-Q190 HydrophobicContact CB-CB 4.28Å; A55-Q190 HydrophobicContact CB-CG 4.2Å
56	V	97.6	Very high	83.6	Confident	48 Å²	48	42.6 Å²	42.6	29%	0.291	22%	0.223	S	C	.	.	P	Polyproline II helix	trans	-62.2	131.2	165	176.1	0	0	0	0	107.8	I39 V42 H58 S59	I39-V56 HydrophobicContact CG2-CG1 3.75Å; V42-V56 HydrophobicContact CB-CG2 3.83Å; V42-V56 HydrophobicContact CG2-CG2 3.9Å; V56-H58 PolarHBondContact O-N 3.36Å; V56-S59 VanDerWaalsContact O-CB 3.25Å; V56-S59 WeakPolarHBondContact O-CB 3.35Å; V56-S59 PolarHBondContact O-N 3.04Å; V56-S59 PolarHBondContact O-OG 3.48Å
57	P	98.1	Very high	85.4	Confident	55 Å²	55	38.8 Å²	38.8	36%	0.357	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.6	127.6	-178	-29.3	33.3	0	0	0	112.7	S59 H104	P57-S59 PolarHBondContact O-N 3.09Å; P57-H104 HydrophobicContact CB-CB 4.35Å
58	H	97.8	Very high	88	Confident	24 Å²	24	36.3 Å²	36.3	11%	0.111	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.2	14	179.7	-38.8	-64.8	0	0	0	116.3	I39 V56 W60 G102 E111 R150	I39-H58 HydrophobicContact CD1-CB 3.96Å; V56-H58 PolarHBondContact O-N 3.36Å; H58-W60 PolarHBondContact O-N 3.2Å; H58-G102 PolarHBondContact CE1-O 3.24Å; H58-G102 VanDerWaalsContact CE1-O 3.27Å; H58-G102 PolarHBondContact ND1-O 2.04Å; H58-G102 VanDerWaalsContact ND1-O 3.14Å; H58-E111 IonicContact CE1-OE1 3.68Å; H58-E111 PolarHBondContact CE1-OE1 3.35Å; H58-E111 IonicContact ND1-OE1 2.88Å; H58-E111 IonicContact NE2-OE1 3.57Å; H58-R150 HydrophobicContact CB-CB 3.92Å; H58-R150 HydrophobicContact CB-CG 3.87Å
59	S	98.4	Very high	90.2	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.174	C	C	.	.	S	Bend	trans	-73.6	-11.1	177	61.6	0	0	0	0	114.7	P37 I39 V56 P57 P61	P37-S59 WeakPolarHBondContact CB-O 3.36Å; I39-S59 VanDerWaalsContact O-CA 3.31Å; I39-S59 WeakPolarHBondContact O-CA 3.48Å; I39-S59 WeakPolarHBondContact O-CB 3.08Å; V56-S59 VanDerWaalsContact O-CB 3.25Å; V56-S59 WeakPolarHBondContact O-CB 3.35Å; V56-S59 PolarHBondContact O-N 3.04Å; V56-S59 PolarHBondContact O-OG 3.48Å; P57-S59 PolarHBondContact O-N 3.09Å; S59-P61 VanDerWaalsContact O-CD 3.27Å; S59-P61 WeakPolarHBondContact O-CD 3.41Å
60	W	98.6	Very high	92.5	Very high	4 Å²	4	35.2 Å²	35.2	2%	0.015	19%	0.186	C	C	.	.	S	Bend	trans	-115.8	68.4	171.8	-58.2	110	0	0	0	110.5	P41 I43 H58 W62 Q63 V170 L188 V233 W240	P41-W60 HydrophobicContact CB-CH2 4Å; P41-W60 HydrophobicContact CB-CZ2 3.49Å; P41-W60 VanDerWaalsContact CB-CZ2 3.49Å; P41-W60 HydrophobicContact CG-CH2 3.73Å; P41-W60 HydrophobicContact CG-CZ2 3.78Å; P41-W60 HydrophobicContact CG-CZ3 4.24Å; I43-W60 HydrophobicContact CD1-CH2 4.23Å; I43-W60 HydrophobicContact CD1-CZ2 4.2Å; I43-W60 HydrophobicContact CG1-CZ2 4.34Å; H58-W60 PolarHBondContact O-N 3.2Å; W60-W62 AromaticContact CE3-CE2 3.9Å; W60-W62 HydrophobicContact CE3-CH2 4.15Å; W60-W62 AromaticContact CE3-CZ2 3.37Å; W60-W62 HydrophobicContact CE3-CZ2 3.37Å; W60-W62 HydrophobicContact CZ3-CH2 4.34Å; W60-W62 AromaticContact CZ3-CZ2 3.66Å; W60-W62 HydrophobicContact CZ3-CZ2 3.66Å; W60-W62 PolarHBondContact O-N 3.25Å; W60-Q63 HydrophobicContact CB-CB 4.2Å; W60-Q63 WeakPolarHBondContact O-CB 3.42Å; W60-Q63 PolarHBondContact O-N 3.03Å; W60-V170 HydrophobicContact CH2-CB 3.98Å; W60-V170 HydrophobicContact CH2-CG1 3.87Å; W60-V170 HydrophobicContact CH2-CG2 4.18Å; W60-V170 HydrophobicContact CZ2-CB 4.2Å; W60-V170 HydrophobicContact CZ2-CG1 3.58Å; W60-V170 HydrophobicContact CZ2-CG2 4.45Å; W60-L188 HydrophobicContact CB-CD2 4.24Å; W60-V233 HydrophobicContact CE3-CG2 4.37Å; W60-V233 HydrophobicContact CH2-CG2 4.35Å; W60-V233 HydrophobicContact CZ3-CG2 3.77Å; W60-W240 HydrophobicContact CH2-CD2 4.06Å; W60-W240 AromaticContact CH2-CE2 3.82Å; W60-W240 HydrophobicContact CH2-CE3 4.17Å; W60-W240 AromaticContact CH2-CH2 3.84Å; W60-W240 HydrophobicContact CH2-CH2 3.84Å; W60-W240 AromaticContact CH2-CZ2 3.72Å; W60-W240 HydrophobicContact CH2-CZ2 3.72Å; W60-W240 HydrophobicContact CH2-CZ3 4.06Å; W60-W240 AromaticContact CZ3-CD2 3.72Å; W60-W240 HydrophobicContact CZ3-CD2 3.72Å; W60-W240 AromaticContact CZ3-CE2 3.81Å; W60-W240 HydrophobicContact CZ3-CE3 4.02Å; W60-W240 HydrophobicContact CZ3-CG 4.11Å; W60-W240 HydrophobicContact CZ3-CH2 4.47Å; W60-W240 HydrophobicContact CZ3-CZ2 4.21Å; W60-W240 HydrophobicContact CZ3-CZ3 4.38Å
61	P	98.6	Very high	94.4	Very high	1 Å²	1	32.4 Å²	32.4	1%	0.006	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-8.6	-166.2	30.9	-39.7	0	0	0	114.8	P37 S59 R150 V151 S152	P37-P61 HydrophobicContact CB-CG 3.78Å; S59-P61 VanDerWaalsContact O-CD 3.27Å; S59-P61 WeakPolarHBondContact O-CD 3.41Å; P61-R150 WeakPolarHBondContact CA-O 3.33Å; P61-R150 WeakPolarHBondContact CB-O 3.41Å; P61-V151 WeakPolarHBondContact O-CA 3.46Å; P61-S152 CarbonylContact C-O 3.55Å; P61-S152 VanDerWaalsContact C-O 3.31Å; P61-S152 WeakPolarHBondContact CB-OG 3.33Å; P61-S152 WeakPolarHBondContact CG-OG 3.43Å; P61-S152 PolarHBondContact O-N 2.96Å; P61-S152 VanDerWaalsContact O-N 3.12Å
62	W	98.9	Very high	95.8	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-13.6	170.7	45.7	82.4	0	0	0	113.1	P37 W60 V64 S78 L79 S152 V154 V233 W240	P37-W62 HydrophobicContact CB-CZ3 4.39Å; P37-W62 HydrophobicContact CG-CH2 4.37Å; W60-W62 AromaticContact CE3-CE2 3.9Å; W60-W62 HydrophobicContact CE3-CH2 4.15Å; W60-W62 AromaticContact CE3-CZ2 3.37Å; W60-W62 HydrophobicContact CE3-CZ2 3.37Å; W60-W62 HydrophobicContact CZ3-CH2 4.34Å; W60-W62 AromaticContact CZ3-CZ2 3.66Å; W60-W62 HydrophobicContact CZ3-CZ2 3.66Å; W60-W62 PolarHBondContact O-N 3.25Å; W62-V64 PolarHBondContact O-N 2.92Å; W62-S78 CarbonylContact O-C 3.55Å; W62-S78 VanDerWaalsContact O-CA 3.28Å; W62-S78 WeakPolarHBondContact O-CA 3.31Å; W62-L79 HydrophobicContact CB-CB 4.35Å; W62-L79 PolarHBondContact O-N 2.82Å; W62-S152 VanDerWaalsContact CA-O 3.22Å; W62-S152 WeakPolarHBondContact CA-O 3.41Å; W62-S152 WeakPolarHBondContact CB-O 3.32Å; W62-S152 PolarHBondContact N-O 2.93Å; W62-S152 VanDerWaalsContact N-O 3.16Å; W62-V154 HydrophobicContact CB-CB 3.86Å; W62-V154 HydrophobicContact CB-CG1 4.45Å; W62-V154 HydrophobicContact CD2-CB 3.66Å; W62-V154 HydrophobicContact CD2-CG2 3.95Å; W62-V154 HydrophobicContact CE3-CB 4.11Å; W62-V154 HydrophobicContact CE3-CG2 4.44Å; W62-V154 HydrophobicContact CG-CB 3.55Å; W62-V154 HydrophobicContact CG-CG1 4.44Å; W62-V154 HydrophobicContact CG-CG2 4.18Å; W62-V154 HydrophobicContact CZ2-CG2 4.28Å; W62-V233 HydrophobicContact CZ2-CG1 4.49Å; W62-W240 HydrophobicContact CH2-CB 3.37Å; W62-W240 AromaticContact CH2-CD1 3.67Å; W62-W240 AromaticContact CH2-CG 3.65Å; W62-W240 HydrophobicContact CH2-CG 3.65Å; W62-W240 HydrophobicContact CZ2-CB 3.5Å; W62-W240 VanDerWaalsContact CZ2-CB 3.5Å; W62-W240 AromaticContact CZ2-CG 3.85Å; W62-W240 HydrophobicContact CZ2-CG 3.85Å; W62-W240 HydrophobicContact CZ3-CB 4.38Å
63	Q	98.9	Very high	96.7	Very high	5 Å²	5	35.5 Å²	35.5	2%	0.023	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	128.2	-179.9	179.3	68.2	58.3	0	0	109.7	W60 S172 W174 L188	W60-Q63 HydrophobicContact CB-CB 4.2Å; W60-Q63 WeakPolarHBondContact O-CB 3.42Å; W60-Q63 PolarHBondContact O-N 3.03Å; Q63-S172 PolarHBondContact OE1-O 3.21Å; Q63-S172 PolarHBondContact OE1-OG 2.98Å; Q63-W174 HydrophobicContact CG-CE3 4.48Å; Q63-W174 HydrophobicContact CG-CH2 3.63Å; Q63-W174 HydrophobicContact CG-CZ3 3.5Å; Q63-L188 HydrophobicContact CB-CD2 4.37Å; Q63-L188 HydrophobicContact CG-CD1 3.85Å; Q63-L188 HydrophobicContact CG-CD2 4.12Å
64	V	98.8	Very high	97.1	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	142.9	175.8	171	0	0	0	0	109.4	W62 L66 G76 G77 V85 V99 V100 L101	W62-V64 PolarHBondContact O-N 2.92Å; V64-L66 HydrophobicContact CG1-CD2 3.64Å; V64-L66 HydrophobicContact CG1-CG 4.2Å; V64-G76 CarbonylContact O-C 3.54Å; V64-G76 VanDerWaalsContact O-CA 3.31Å; V64-G76 WeakPolarHBondContact O-CA 3.27Å; V64-G77 PolarHBondContact N-O 3.44Å; V64-G77 PolarHBondContact O-N 2.79Å; V64-G77 VanDerWaalsContact O-N 3.09Å; V64-V85 HydrophobicContact CB-CG1 4.33Å; V64-V85 HydrophobicContact CG1-CG1 4.26Å; V64-V85 HydrophobicContact CG2-CG1 4.03Å; V64-V85 HydrophobicContact CG2-CG2 3.94Å; V64-V99 HydrophobicContact CG1-CG1 3.56Å; V64-V99 HydrophobicContact CG2-CG1 4.39Å; V64-V100 WeakPolarHBondContact CA-O 3.4Å; V64-L101 HydrophobicContact CG2-CD2 3.47Å; V64-L101 VanDerWaalsContact CG2-CD2 3.47Å; V64-L101 HydrophobicContact CG2-CG 4.23Å
65	S	98.7	Very high	97.3	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	115	167.3	177	0	0	0	0	107.5	Q67 H73 V100 E103	S65-Q67 PolarHBondContact OG-NE2 2.85Å; S65-H73 PolarHBondContact OG-ND1 3.18Å; S65-V100 PolarHBondContact N-O 2.86Å; S65-V100 WeakPolarHBondContact O-CB 3.43Å; S65-V100 PolarHBondContact O-N 3.06Å; S65-E103 WeakPolarHBondContact CB-OE2 3.44Å; S65-E103 PolarHBondContact OG-OE2 2.94Å
66	L	98.7	Very high	97.4	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	118.5	173.2	-59.5	-180	0	0	0	108.2	V64 H73 F74 C75 G76 T87 I93 V99 I139	V64-L66 HydrophobicContact CG1-CD2 3.64Å; V64-L66 HydrophobicContact CG1-CG 4.2Å; L66-H73 WeakPolarHBondContact O-CA 3.29Å; L66-F74 HydrophobicContact CB-CE1 4.23Å; L66-F74 HydrophobicContact CB-CE2 4.21Å; L66-F74 HydrophobicContact CB-CZ 3.92Å; L66-F74 WeakPolarHBondContact O-CD1 3.02Å; L66-F74 PolarHBondContact O-N 3.41Å; L66-C75 WeakPolarHBondContact CA-O 3.46Å; L66-C75 HydrophobicContact CB-CB 4.2Å; L66-C75 WeakPolarHBondContact CB-O 3.05Å; L66-C75 HydrophobicContact CD1-CB 4.04Å; L66-C75 PolarHBondContact N-O 3.03Å; L66-C75 PolarHBondContact O-N 2.95Å; L66-G76 WeakPolarHBondContact CD1-O 3.37Å; L66-T87 HydrophobicContact CD1-CG2 3.93Å; L66-T87 WeakPolarHBondContact CD1-OG1 3.47Å; L66-I93 HydrophobicContact CB-CD1 4.42Å; L66-I93 HydrophobicContact CD1-CD1 4.34Å; L66-I93 HydrophobicContact CD2-CD1 4.14Å; L66-V99 HydrophobicContact CD2-CG1 4.47Å; L66-V99 HydrophobicContact CD2-CG2 4.11Å; L66-I139 HydrophobicContact CD1-CD1 4.26Å; L66-I139 HydrophobicContact CD2-CD1 3.94Å
67	Q	98.1	Very high	97.5	Very high	17 Å²	17	29.8 Å²	29.8	8%	0.079	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	147.4	-176.5	-55.6	175.4	2.2	0	0	110.1	S65 G71 F72 H73 F74 D97 R98 V100 E103	S65-Q67 PolarHBondContact OG-NE2 2.85Å; Q67-G71 PolarHBondContact OE1-O 2.89Å; Q67-F72 CarbonylContact C-O 3.58Å; Q67-F72 WeakPolarHBondContact CA-O 3.23Å; Q67-H73 HydrophobicContact CG-CB 4.19Å; Q67-F74 VanDerWaalsContact C-CE1 3.43Å; Q67-D97 CarbonylContact O-C 3.59Å; Q67-D97 WeakPolarHBondContact O-CA 3.37Å; Q67-D97 WeakPolarHBondContact O-CB 3.41Å; Q67-R98 HydrophobicContact CB-CB 4.23Å; Q67-R98 PolarHBondContact N-O 3.29Å; Q67-R98 PolarHBondContact O-N 2.84Å; Q67-V100 HydrophobicContact CG-CG2 4.12Å; Q67-E103 PolarHBondContact NE2-OE1 2.85Å; Q67-E103 PolarHBondContact NE2-OE2 2.84Å
68	D	97.1	Very high	97.5	Very high	38 Å²	38	27.1 Å²	27.1	20%	0.203	13%	0.133	C	C	.	.			trans	-71.4	-178.6	172	73.3	10.9	0	0	0	111.3	T70 G71 F72 F74	D68-T70 PolarHBondContact O-N 3.16Å; D68-T70 VanDerWaalsContact O-N 3.08Å; D68-T70 VanDerWaalsContact OD1-CA 3.3Å; D68-T70 WeakPolarHBondContact OD1-CA 3.33Å; D68-T70 WeakPolarHBondContact OD1-CB 3.22Å; D68-T70 PolarHBondContact OD1-N 3.05Å; D68-T70 PolarHBondContact OD1-OG1 3.24Å; D68-T70 PolarHBondContact OD2-OG1 2.86Å; D68-G71 PolarHBondContact O-N 3.04Å; D68-G71 PolarHBondContact OD1-N 2.62Å; D68-G71 VanDerWaalsContact OD1-N 3.15Å; D68-F72 PolarHBondContact N-O 3.36Å; D68-F72 PolarHBondContact OD1-N 3.35Å; D68-F74 HydrophobicContact CB-CD1 4.38Å; D68-F74 HydrophobicContact CB-CE1 4.48Å
69	Y	94.8	Very high	97.6	Very high	167 Å²	167	26 Å²	26	66%	0.655	13%	0.128	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-19.5	179.5	72.6	-87.5	0	0	0	113.9	R98	Y69-R98 PolarHBondContact O-NH2 2.84Å
70	T	95.4	Very high	97.6	Very high	86 Å²	86	26.8 Å²	26.8	53%	0.528	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-12.3	176.4	75.8	0	0	0	0	113	D68 F72	D68-T70 PolarHBondContact O-N 3.16Å; D68-T70 VanDerWaalsContact O-N 3.08Å; D68-T70 VanDerWaalsContact OD1-CA 3.3Å; D68-T70 WeakPolarHBondContact OD1-CA 3.33Å; D68-T70 WeakPolarHBondContact OD1-CB 3.22Å; D68-T70 PolarHBondContact OD1-N 3.05Å; D68-T70 PolarHBondContact OD1-OG1 3.24Å; D68-T70 PolarHBondContact OD2-OG1 2.86Å; T70-F72 PolarHBondContact OG1-N 3.12Å
71	G	94.5	Very high	97.6	Very high	26 Å²	26	28.3 Å²	28.3	27%	0.268	14%	0.141	S	C	.	.	S	Bend	trans	91.1	9.4	-171.9	0	0	0	0	0	113.3	Q67 D68 H73	Q67-G71 PolarHBondContact OE1-O 2.89Å; D68-G71 PolarHBondContact O-N 3.04Å; D68-G71 PolarHBondContact OD1-N 2.62Å; D68-G71 VanDerWaalsContact OD1-N 3.15Å; G71-H73 PolarHBondContact O-N 2.75Å
72	F	94.8	Very high	97.6	Very high	131 Å²	131	32.1 Å²	32.1	58%	0.575	16%	0.158	S	C	*	.			trans	-76.3	116.6	175.7	176.5	-95.6	0	0	0	110.2	Q67 D68 T70 F74	Q67-F72 CarbonylContact C-O 3.58Å; Q67-F72 WeakPolarHBondContact CA-O 3.23Å; D68-F72 PolarHBondContact N-O 3.36Å; D68-F72 PolarHBondContact OD1-N 3.35Å; T70-F72 PolarHBondContact OG1-N 3.12Å; F72-F74 HydrophobicContact CD1-CB 4.26Å; F72-F74 HydrophobicContact CE1-CB 4.14Å; F72-F74 PolarHBondContact O-N 2.8Å
73	H	95.9	Very high	97.6	Very high	13 Å²	13	34.3 Å²	34.3	6%	0.06	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.8	125.9	174	173	99.3	0	0	0	111.4	S65 L66 Q67 G71 C75 R106 W174 G226	S65-H73 PolarHBondContact OG-ND1 3.18Å; L66-H73 WeakPolarHBondContact O-CA 3.29Å; Q67-H73 HydrophobicContact CG-CB 4.19Å; G71-H73 PolarHBondContact O-N 2.75Å; H73-C75 PolarHBondContact CE1-O 3.17Å; H73-R106 PolarHBondContact CD2-NH1 2.98Å; H73-W174 AromaticContact CE1-CE3 3.85Å; H73-G226 PolarHBondContact NE2-O 3.15Å
74	F	95.9	Very high	97.6	Very high	51 Å²	51	34.5 Å²	34.5	22%	0.224	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	-22	179.7	65.8	-95	0	0	0	114	L66 Q67 D68 F72 C91 I93 D97	L66-F74 HydrophobicContact CB-CE1 4.23Å; L66-F74 HydrophobicContact CB-CE2 4.21Å; L66-F74 HydrophobicContact CB-CZ 3.92Å; L66-F74 WeakPolarHBondContact O-CD1 3.02Å; L66-F74 PolarHBondContact O-N 3.41Å; Q67-F74 VanDerWaalsContact C-CE1 3.43Å; D68-F74 HydrophobicContact CB-CD1 4.38Å; D68-F74 HydrophobicContact CB-CE1 4.48Å; F72-F74 HydrophobicContact CD1-CB 4.26Å; F72-F74 HydrophobicContact CE1-CB 4.14Å; F72-F74 PolarHBondContact O-N 2.8Å; F74-C91 HydrophobicContact CE2-CB 4.28Å; F74-C91 VanDerWaalsContact CE2-O 3.31Å; F74-C91 WeakPolarHBondContact CE2-O 3.46Å; F74-I93 HydrophobicContact CZ-CD1 3.84Å; F74-D97 HydrophobicContact CE1-CB 4.49Å
75	C	98.1	Very high	97.6	Very high	5 Å²	5	34.5 Å²	34.5	3%	0.034	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	162.8	177.8	-88.3	0	0	0	0	111.8	L66 H73 C91 S228	L66-C75 WeakPolarHBondContact CA-O 3.46Å; L66-C75 HydrophobicContact CB-CB 4.2Å; L66-C75 WeakPolarHBondContact CB-O 3.05Å; L66-C75 HydrophobicContact CD1-CB 4.04Å; L66-C75 PolarHBondContact N-O 3.03Å; L66-C75 PolarHBondContact O-N 2.95Å; H73-C75 PolarHBondContact CE1-O 3.17Å; C75-C91 HydrophobicContact CB-CB 3.77Å; C75-C91 WeakPolarHBondContact CB-SG 3.37Å; C75-C91 WeakPolarHBondContact SG-CB 3.31Å; C75-C91 CovalentContact SG-SG 2.04Å; C75-C91 PolarHBondContact SG-SG 3.05Å; C75-S228 CarbonylContact C-O 3.6Å; C75-S228 WeakPolarHBondContact CA-O 3.5Å; C75-S228 VanDerWaalsContact CB-O 3.29Å; C75-S228 WeakPolarHBondContact CB-O 3.39Å; C75-S228 VanDerWaalsContact SG-CB 3.59Å; C75-S228 PolarHBondContact SG-O 3.25Å
76	G	98.6	Very high	97.6	Very high	2 Å²	2	34.6 Å²	34.6	2%	0.021	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	177.4	164.5	0	0	0	0	0	113.7	V64 L66 T87 S228 G229	V64-G76 CarbonylContact O-C 3.54Å; V64-G76 VanDerWaalsContact O-CA 3.31Å; V64-G76 WeakPolarHBondContact O-CA 3.27Å; L66-G76 WeakPolarHBondContact CD1-O 3.37Å; G76-T87 PolarHBondContact O-OG1 3.1Å; G76-S228 PolarHBondContact N-O 3.08Å; G76-G229 CarbonylContact C-O 3.52Å; G76-G229 CarbonylContact O-C 3.53Å
77	G	98.8	Very high	97.6	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.9	178.5	170.9	0	0	0	0	0	110.7	V64 V86 G229	V64-G77 PolarHBondContact N-O 3.44Å; V64-G77 PolarHBondContact O-N 2.79Å; V64-G77 VanDerWaalsContact O-N 3.09Å; G77-V86 CarbonylContact C-O 3.55Å; G77-V86 VanDerWaalsContact CA-O 3.3Å; G77-V86 WeakPolarHBondContact CA-O 3.28Å; G77-G229 VanDerWaalsContact CA-O 3.31Å; G77-G229 WeakPolarHBondContact CA-O 3.44Å
78	S	98.9	Very high	97.7	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	128	173.1	-58.6	0	0	0	0	111.3	W62 I80 V85 V86 P231	W62-S78 CarbonylContact O-C 3.55Å; W62-S78 VanDerWaalsContact O-CA 3.28Å; W62-S78 WeakPolarHBondContact O-CA 3.31Å; S78-I80 PolarHBondContact O-N 2.88Å; S78-V85 CarbonylContact O-C 3.31Å; S78-V85 VanDerWaalsContact O-CA 3.29Å; S78-V85 WeakPolarHBondContact O-CA 3.39Å; S78-V86 PolarHBondContact N-O 2.83Å; S78-V86 PolarHBondContact O-N 2.85Å; S78-P231 WeakPolarHBondContact OG-CB 3.32Å
79	L	98.9	Very high	97.8	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	124.8	168.4	-168.6	74.3	0	0	0	109.2	W62 N81 V85 L101 L141 A145 L147 V151 P153 V154	W62-L79 HydrophobicContact CB-CB 4.35Å; W62-L79 PolarHBondContact O-N 2.82Å; L79-N81 WeakPolarHBondContact CD1-O 3.37Å; L79-N81 VanDerWaalsContact CG-O 3.29Å; L79-N81 WeakPolarHBondContact CG-O 3.45Å; L79-V85 HydrophobicContact CD1-CG2 3.83Å; L79-L101 HydrophobicContact CB-CD2 4Å; L79-L101 HydrophobicContact CD1-CD2 3.97Å; L79-L101 HydrophobicContact CD2-CD2 4.14Å; L79-L101 HydrophobicContact CG-CD2 4.26Å; L79-L141 HydrophobicContact CD1-CD1 4.22Å; L79-A145 HydrophobicContact CD1-CB 4.33Å; L79-A145 HydrophobicContact CD2-CB 4.42Å; L79-L147 HydrophobicContact CD2-CD2 3.94Å; L79-V151 HydrophobicContact CD2-CG1 3.86Å; L79-P153 CarbonylContact O-C 3.54Å; L79-P153 VanDerWaalsContact O-CA 3.23Å; L79-P153 WeakPolarHBondContact O-CA 3.35Å; L79-V154 PolarHBondContact O-N 2.8Å
80	I	98.8	Very high	97.9	Very high	16 Å²	16	26.6 Å²	26.6	8%	0.082	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	-18.6	-178.4	57.5	166.3	0	0	0	112.7	S78 W84 V86 L138 P153 V154 L156 V271 I275	S78-I80 PolarHBondContact O-N 2.88Å; I80-W84 HydrophobicContact CD1-CB 3.9Å; I80-W84 HydrophobicContact CG1-CB 3.68Å; I80-W84 VanDerWaalsContact CG1-O 3.24Å; I80-W84 WeakPolarHBondContact CG1-O 3.2Å; I80-W84 PolarHBondContact N-O 3.43Å; I80-V86 HydrophobicContact CG2-CB 4.2Å; I80-V86 HydrophobicContact CG2-CG1 3.6Å; I80-L138 HydrophobicContact CD1-CD2 3.77Å; I80-P153 VanDerWaalsContact C-CB 3.42Å; I80-P153 WeakPolarHBondContact O-CB 3.28Å; I80-V154 HydrophobicContact CG2-CG1 4.06Å; I80-L156 HydrophobicContact CB-CD1 4.27Å; I80-L156 HydrophobicContact CB-CD2 4.49Å; I80-L156 HydrophobicContact CB-CG 4.35Å; I80-L156 HydrophobicContact CD1-CD1 4.12Å; I80-L156 HydrophobicContact CG2-CD1 4.33Å; I80-L156 HydrophobicContact CG2-CD2 3.72Å; I80-L156 HydrophobicContact CG2-CG 4.09Å; I80-V271 HydrophobicContact CD1-CG1 4.28Å; I80-I275 HydrophobicContact CD1-CD1 3.76Å
81	N	98.6	Very high	98	Very high	37 Å²	37	22.8 Å²	22.8	20%	0.198	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.6	179.2	161	59.6	56.2	0	0	0	107.4	L79 N83 W84	L79-N81 WeakPolarHBondContact CD1-O 3.37Å; L79-N81 VanDerWaalsContact CG-O 3.29Å; L79-N81 WeakPolarHBondContact CG-O 3.45Å; N81-N83 PolarHBondContact O-N 3.02Å; N81-N83 WeakPolarHBondContact OD1-CA 3.48Å; N81-N83 PolarHBondContact OD1-N 2.86Å; N81-W84 PolarHBondContact O-N 3.3Å; N81-W84 WeakPolarHBondContact OD1-CB 3.39Å; N81-W84 PolarHBondContact OD1-N 2.92Å
82	E	98.6	Very high	98.1	Very high	80 Å²	80	25.3 Å²	25.3	37%	0.374	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-18.2	-176.4	69.8	-78.6	-175.1	0	0	114.6	P144 A145 L147	E82-P144 HydrophobicContact CB-CB 4.37Å; E82-P144 HydrophobicContact CG-CB 4.05Å; E82-P144 CarbonylContact O-C 3.53Å; E82-P144 VanDerWaalsContact O-CA 3.28Å; E82-P144 WeakPolarHBondContact O-CA 3.32Å; E82-A145 PolarHBondContact O-N 2.87Å; E82-L147 HydrophobicContact CB-CD1 4.37Å; E82-L147 HydrophobicContact CB-CD2 4.06Å; E82-L147 HydrophobicContact CB-CG 4.14Å
83	N	98.8	Very high	98.3	Very high	47 Å²	47	19.8 Å²	19.8	25%	0.251	10%	0.102	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.2	-11.9	-178	-63.9	-72	0	0	0	113.9	N81 K140 L141 P144	N81-N83 PolarHBondContact O-N 3.02Å; N81-N83 WeakPolarHBondContact OD1-CA 3.48Å; N81-N83 PolarHBondContact OD1-N 2.86Å; N83-K140 WeakPolarHBondContact O-CA 3.31Å; N83-L141 PolarHBondContact O-N 2.75Å; N83-P144 WeakPolarHBondContact OD1-CG 3.27Å
84	W	98.9	Very high	98.2	Very high	9 Å²	9	27.6 Å²	27.6	3%	0.034	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	132.8	-164.4	-69.3	95.2	0	0	0	112.8	I80 N81 F122 L138 I139 K140 T274 I275 N278	I80-W84 HydrophobicContact CD1-CB 3.9Å; I80-W84 HydrophobicContact CG1-CB 3.68Å; I80-W84 VanDerWaalsContact CG1-O 3.24Å; I80-W84 WeakPolarHBondContact CG1-O 3.2Å; I80-W84 PolarHBondContact N-O 3.43Å; N81-W84 PolarHBondContact O-N 3.3Å; N81-W84 WeakPolarHBondContact OD1-CB 3.39Å; N81-W84 PolarHBondContact OD1-N 2.92Å; W84-F122 AromaticContact CH2-CD2 3.92Å; W84-F122 HydrophobicContact CH2-CD2 3.92Å; W84-F122 AromaticContact CH2-CE2 3.45Å; W84-F122 HydrophobicContact CH2-CE2 3.45Å; W84-F122 VanDerWaalsContact CH2-CE2 3.45Å; W84-F122 AromaticContact CH2-CZ 3.94Å; W84-F122 HydrophobicContact CH2-CZ 3.94Å; W84-F122 AromaticContact CZ3-CD2 3.62Å; W84-F122 HydrophobicContact CZ3-CD2 3.62Å; W84-F122 AromaticContact CZ3-CE2 3.58Å; W84-F122 HydrophobicContact CZ3-CE2 3.58Å; W84-F122 HydrophobicContact CZ3-CZ 4.47Å; W84-L138 HydrophobicContact CE3-CB 3.92Å; W84-L138 HydrophobicContact CE3-CD1 4.43Å; W84-L138 HydrophobicContact CZ3-CB 3.81Å; W84-L138 HydrophobicContact CZ3-CD1 4.32Å; W84-I139 WeakPolarHBondContact CA-O 3.37Å; W84-K140 HydrophobicContact CD2-CB 4.21Å; W84-K140 HydrophobicContact CD2-CG 4.33Å; W84-K140 HydrophobicContact CE3-CB 3.9Å; W84-K140 HydrophobicContact CH2-CB 3.78Å; W84-K140 HydrophobicContact CH2-CD 4.05Å; W84-K140 HydrophobicContact CH2-CG 4.19Å; W84-K140 HydrophobicContact CZ2-CB 4.04Å; W84-K140 HydrophobicContact CZ2-CD 3.69Å; W84-K140 HydrophobicContact CZ2-CG 3.94Å; W84-K140 HydrophobicContact CZ3-CB 3.69Å; W84-K140 HydrophobicContact CZ3-CG 4.46Å; W84-T274 HydrophobicContact CH2-CG2 4.35Å; W84-T274 HydrophobicContact CZ3-CG2 4.48Å; W84-I275 HydrophobicContact CD2-CG1 3.99Å; W84-I275 HydrophobicContact CE3-CG1 4.38Å; W84-I275 HydrophobicContact CG-CD1 4.44Å; W84-I275 HydrophobicContact CG-CG1 4.27Å; W84-I275 HydrophobicContact CZ2-CG1 4.25Å; W84-N278 HydrophobicContact CH2-CB 4.02Å; W84-N278 HydrophobicContact CZ2-CB 4.02Å; W84-N278 WeakPolarHBondContact CZ2-OXT 3.2Å
85	V	98.9	Very high	98.1	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	140.4	170.3	171.8	0	0	0	0	109	V64 S78 L79 V99 L138 I139 L141	V64-V85 HydrophobicContact CB-CG1 4.33Å; V64-V85 HydrophobicContact CG1-CG1 4.26Å; V64-V85 HydrophobicContact CG2-CG1 4.03Å; V64-V85 HydrophobicContact CG2-CG2 3.94Å; S78-V85 CarbonylContact O-C 3.31Å; S78-V85 VanDerWaalsContact O-CA 3.29Å; S78-V85 WeakPolarHBondContact O-CA 3.39Å; L79-V85 HydrophobicContact CD1-CG2 3.83Å; V85-V99 HydrophobicContact CG2-CG1 3.9Å; V85-L138 CarbonylContact O-C 3.52Å; V85-L138 WeakPolarHBondContact O-CA 3.47Å; V85-I139 HydrophobicContact CB-CB 4.27Å; V85-I139 HydrophobicContact CG1-CD1 4.27Å; V85-I139 PolarHBondContact N-O 2.95Å; V85-I139 PolarHBondContact O-N 3.21Å; V85-L141 HydrophobicContact CG2-CD1 4.49Å; V85-L141 HydrophobicContact CG2-CD2 4.04Å
86	V	98.9	Very high	97.9	Very high	2 Å²	2	31.9 Å²	31.9	1%	0.012	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	141.2	169.3	69.7	0	0	0	0	110.1	G77 S78 I80 I136 T137 L138 L242 I245	G77-V86 CarbonylContact C-O 3.55Å; G77-V86 VanDerWaalsContact CA-O 3.3Å; G77-V86 WeakPolarHBondContact CA-O 3.28Å; S78-V86 PolarHBondContact N-O 2.83Å; S78-V86 PolarHBondContact O-N 2.85Å; I80-V86 HydrophobicContact CG2-CB 4.2Å; I80-V86 HydrophobicContact CG2-CG1 3.6Å; V86-I136 HydrophobicContact CG2-CD1 3.75Å; V86-I136 HydrophobicContact CG2-CG1 3.68Å; V86-T137 WeakPolarHBondContact CA-O 3.49Å; V86-L138 HydrophobicContact CB-CD2 3.82Å; V86-L138 HydrophobicContact CG2-CD2 3.89Å; V86-L242 HydrophobicContact CG1-CD2 3.49Å; V86-L242 VanDerWaalsContact CG1-CD2 3.49Å; V86-I245 HydrophobicContact CG2-CD1 3.57Å
87	T	98.9	Very high	97.9	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	-177.1	177.3	-172.6	0	0	0	0	109.7	L66 G76 I136 T137 I139 G229	L66-T87 HydrophobicContact CD1-CG2 3.93Å; L66-T87 WeakPolarHBondContact CD1-OG1 3.47Å; G76-T87 PolarHBondContact O-OG1 3.1Å; T87-I136 CarbonylContact O-C 3.39Å; T87-I136 WeakPolarHBondContact O-CA 3.09Å; T87-T137 HydrophobicContact CG2-CG2 4.3Å; T87-T137 PolarHBondContact N-O 2.89Å; T87-T137 PolarHBondContact O-N 3.04Å; T87-I139 HydrophobicContact CG2-CD1 3.89Å; T87-I139 HydrophobicContact CG2-CG1 4.4Å; T87-G229 WeakPolarHBondContact OG1-CA 3.38Å
88	A	98.8	Very high	97.9	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.195	C	C	.	.			trans	-79.4	151.6	176.9	0	0	0	0	0	111.9	C91 I245	A88-C91 PolarHBondContact O-N 2.97Å; A88-I245 HydrophobicContact CB-CG2 4.23Å
89	A	98.8	Very high	97.9	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-69.3	-34.2	175.7	0	0	0	0	0	113.1	C91 T92 R123 Y127 D135 T137	A89-C91 PolarHBondContact O-N 3.48Å; A89-T92 PolarHBondContact O-N 3.46Å; A89-R123 HydrophobicContact CB-CG 3.71Å; A89-Y127 HydrophobicContact CB-CD1 3.81Å; A89-Y127 HydrophobicContact CB-CD2 3.5Å; A89-Y127 HydrophobicContact CB-CE1 4.19Å; A89-Y127 HydrophobicContact CB-CE2 3.92Å; A89-Y127 HydrophobicContact CB-CG 3.44Å; A89-Y127 VanDerWaalsContact CB-CG 3.44Å; A89-D135 VanDerWaalsContact CA-OD1 3.31Å; A89-D135 WeakPolarHBondContact CA-OD1 3.3Å; A89-D135 WeakPolarHBondContact CB-OD1 3.08Å; A89-D135 PolarHBondContact N-OD1 3.2Å; A89-T137 VanDerWaalsContact CA-OG1 3.27Å; A89-T137 WeakPolarHBondContact CA-OG1 3.5Å
90	H	98.3	Very high	97.9	Very high	54 Å²	54	37.1 Å²	37.1	25%	0.25	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-70.7	-12.3	179.4	77.3	-98.4	0	0	0	113.8	T92 Y127 D135 S228 S247	H90-T92 VanDerWaalsContact C-N 3.25Å; H90-T92 PolarHBondContact O-N 3.45Å; H90-Y127 WeakPolarHBondContact CB-OH 3.44Å; H90-D135 IonicContact CE1-OD2 3.84Å; H90-D135 PolarHBondContact CE1-OD2 2.03Å; H90-D135 IonicContact CG-OD1 3.31Å; H90-D135 IonicContact CG-OD2 3.31Å; H90-D135 PolarHBondContact N-OD1 3.34Å; H90-D135 IonicContact ND1-OD1 2.63Å; H90-D135 PolarHBondContact ND1-OD1 3.06Å; H90-D135 IonicContact ND1-OD2 3.24Å; H90-D135 PolarHBondContact ND1-OD2 2.87Å; H90-S228 PolarHBondContact CE1-OG 3.18Å; H90-S228 WeakPolarHBondContact NE2-CB 3.45Å; H90-S228 PolarHBondContact NE2-OG 2.98Å; H90-S247 PolarHBondContact CE1-O 3.06Å
91	C	98.1	Very high	97.9	Very high	5 Å²	5	36.4 Å²	36.4	3%	0.034	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-68.6	-21	175.4	-72.8	0	0	0	0	113.3	F74 C75 A88 A89 I93	F74-C91 HydrophobicContact CE2-CB 4.28Å; F74-C91 VanDerWaalsContact CE2-O 3.31Å; F74-C91 WeakPolarHBondContact CE2-O 3.46Å; C75-C91 HydrophobicContact CB-CB 3.77Å; C75-C91 WeakPolarHBondContact CB-SG 3.37Å; C75-C91 WeakPolarHBondContact SG-CB 3.31Å; C75-C91 CovalentContact SG-SG 2.04Å; C75-C91 PolarHBondContact SG-SG 3.05Å; A88-C91 PolarHBondContact O-N 2.97Å; A89-C91 PolarHBondContact O-N 3.48Å; C91-I93 PolarHBondContact O-N 3.28Å
92	T	96.6	Very high	97.9	Very high	80 Å²	80	34.8 Å²	34.8	49%	0.491	18%	0.184	S	C	.	.			trans	53.7	43	174.3	62.4	0	0	0	0	115.9	A89 H90 R94	A89-T92 PolarHBondContact O-N 3.46Å; H90-T92 VanDerWaalsContact C-N 3.25Å; H90-T92 PolarHBondContact O-N 3.45Å; T92-R94 WeakPolarHBondContact O-CG 3.17Å
93	I	97.1	Very high	97.9	Very high	15 Å²	15	32 Å²	32	8%	0.077	17%	0.171	C	C	.	.			trans	-55.5	137.5	176.8	-171.1	74.8	0	0	0	112.7	L66 F74 C91 D97 P118 V121 T137 I139	L66-I93 HydrophobicContact CB-CD1 4.42Å; L66-I93 HydrophobicContact CD1-CD1 4.34Å; L66-I93 HydrophobicContact CD2-CD1 4.14Å; F74-I93 HydrophobicContact CZ-CD1 3.84Å; C91-I93 PolarHBondContact O-N 3.28Å; I93-D97 HydrophobicContact CD1-CB 3.46Å; I93-D97 VanDerWaalsContact CD1-CB 3.46Å; I93-D97 HydrophobicContact CG1-CB 4.39Å; I93-P118 HydrophobicContact CD1-CG 4.16Å; I93-P118 HydrophobicContact CG1-CG 3.93Å; I93-V121 HydrophobicContact CG2-CB 4.25Å; I93-V121 HydrophobicContact CG2-CG1 3.37Å; I93-V121 HydrophobicContact CG2-CG2 3.81Å; I93-T137 HydrophobicContact CG2-CG2 4.03Å; I93-I139 HydrophobicContact CB-CD1 4.33Å; I93-I139 HydrophobicContact CD1-CD1 4.41Å; I93-I139 HydrophobicContact CG1-CD1 3.85Å; I93-I139 HydrophobicContact CG1-CG1 4.34Å; I93-I139 HydrophobicContact CG2-CD1 4.05Å; I93-I139 HydrophobicContact CG2-CG1 3.93Å
94	R	95.6	Very high	97.8	Very high	176 Å²	176	30 Å²	30	66%	0.664	16%	0.16	S	C	*	.			trans	-120.9	164.2	-177.5	-54.9	177.2	-175.3	177.1	1.3	110.8	T92 G96 D97 P118	T92-R94 WeakPolarHBondContact O-CG 3.17Å; R94-G96 VanDerWaalsContact C-N 3.25Å; R94-G96 PolarHBondContact O-N 2.92Å; R94-D97 WeakPolarHBondContact CB-OD2 3.43Å; R94-D97 PolarHBondContact N-OD2 2.97Å; R94-D97 WeakPolarHBondContact O-CB 3.23Å; R94-D97 PolarHBondContact O-N 2.88Å; R94-P118 WeakPolarHBondContact O-CG 3.25Å
95	S	92.9	Very high	97.7	Very high	99 Å²	99	31.4 Å²	31.4	69%	0.692	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-23.9	-179.6	52.2	0	0	0	0	114.8
96	G	94.5	Very high	97.6	Very high	48 Å²	48	34 Å²	34	50%	0.495	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-5.1	177.1	0	0	0	0	0	114.7	R94	R94-G96 VanDerWaalsContact C-N 3.25Å; R94-G96 PolarHBondContact O-N 2.92Å
97	D	98.4	Very high	97.3	Very high	16 Å²	16	38.4 Å²	38.4	9%	0.086	21%	0.209	C	C	.	.	S	Bend	trans	-78.8	173.2	178.5	-62	-19.6	0	0	0	110.6	Q67 F74 I93 R94 P118	Q67-D97 CarbonylContact O-C 3.59Å; Q67-D97 WeakPolarHBondContact O-CA 3.37Å; Q67-D97 WeakPolarHBondContact O-CB 3.41Å; F74-D97 HydrophobicContact CE1-CB 4.49Å; I93-D97 HydrophobicContact CD1-CB 3.46Å; I93-D97 VanDerWaalsContact CD1-CB 3.46Å; I93-D97 HydrophobicContact CG1-CB 4.39Å; R94-D97 WeakPolarHBondContact CB-OD2 3.43Å; R94-D97 PolarHBondContact N-OD2 2.97Å; R94-D97 WeakPolarHBondContact O-CB 3.23Å; R94-D97 PolarHBondContact O-N 2.88Å; D97-P118 WeakPolarHBondContact O-CD 3.16Å
98	R	98.6	Very high	97	Very high	95 Å²	95	40.3 Å²	40.3	36%	0.358	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	131.1	-175.5	-56	175.7	-176.1	-167	3.3	109.8	Q67 Y69 V100 V115	Q67-R98 HydrophobicContact CB-CB 4.23Å; Q67-R98 PolarHBondContact N-O 3.29Å; Q67-R98 PolarHBondContact O-N 2.84Å; Y69-R98 PolarHBondContact O-NH2 2.84Å; R98-V100 HydrophobicContact CB-CG2 4.19Å; R98-V115 HydrophobicContact CB-CG1 4Å; R98-V115 HydrophobicContact CG-CG1 4.15Å
99	V	98.8	Very high	96.6	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	109.5	166.2	-176	0	0	0	0	107.3	V64 L66 V85 L101 I116 P118 I139 L141	V64-V99 HydrophobicContact CG1-CG1 3.56Å; V64-V99 HydrophobicContact CG2-CG1 4.39Å; L66-V99 HydrophobicContact CD2-CG1 4.47Å; L66-V99 HydrophobicContact CD2-CG2 4.11Å; V85-V99 HydrophobicContact CG2-CG1 3.9Å; V99-L101 HydrophobicContact CG1-CD1 4.49Å; V99-L101 HydrophobicContact CG1-CG 4.46Å; V99-I116 WeakPolarHBondContact CA-O 3.4Å; V99-I116 VanDerWaalsContact CB-O 3.26Å; V99-I116 WeakPolarHBondContact CB-O 3.48Å; V99-I116 PolarHBondContact N-O 3.14Å; V99-I116 PolarHBondContact O-N 3.27Å; V99-P118 HydrophobicContact CG2-CG 4.05Å; V99-I139 HydrophobicContact CG2-CG2 4.21Å; V99-L141 HydrophobicContact CB-CD2 4Å; V99-L141 HydrophobicContact CG1-CD2 3.82Å; V99-L141 HydrophobicContact CG2-CD2 3.85Å
100	V	98.8	Very high	96.4	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.006	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	125	-178.8	-174.6	0	0	0	0	110.2	V64 S65 Q67 R98 E103 I113 Q114 V115	V64-V100 WeakPolarHBondContact CA-O 3.4Å; S65-V100 PolarHBondContact N-O 2.86Å; S65-V100 WeakPolarHBondContact O-CB 3.43Å; S65-V100 PolarHBondContact O-N 3.06Å; Q67-V100 HydrophobicContact CG-CG2 4.12Å; R98-V100 HydrophobicContact CB-CG2 4.19Å; V100-E103 HydrophobicContact CG1-CB 4.03Å; V100-I113 HydrophobicContact CG1-CB 4.23Å; V100-I113 HydrophobicContact CG1-CD1 3.95Å; V100-Q114 WeakPolarHBondContact CA-O 3.29Å; V100-V115 HydrophobicContact CG2-CG1 4.41Å; V100-V115 HydrophobicContact CG2-CG2 4.22Å
101	L	98.8	Very high	96.1	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	145.7	-176.1	-66.6	146.3	0	0	0	110.6	V64 L79 V99 E103 I113 Q114 I116 A145 V151	V64-L101 HydrophobicContact CG2-CD2 3.47Å; V64-L101 VanDerWaalsContact CG2-CD2 3.47Å; V64-L101 HydrophobicContact CG2-CG 4.23Å; L79-L101 HydrophobicContact CB-CD2 4Å; L79-L101 HydrophobicContact CD1-CD2 3.97Å; L79-L101 HydrophobicContact CD2-CD2 4.14Å; L79-L101 HydrophobicContact CG-CD2 4.26Å; V99-L101 HydrophobicContact CG1-CD1 4.49Å; V99-L101 HydrophobicContact CG1-CG 4.46Å; L101-E103 VanDerWaalsContact C-N 3.29Å; L101-E103 PolarHBondContact O-N 2.94Å; L101-I113 WeakPolarHBondContact O-CA 3.39Å; L101-Q114 HydrophobicContact CB-CB 4.25Å; L101-Q114 PolarHBondContact N-O 2.97Å; L101-Q114 PolarHBondContact O-N 3.46Å; L101-I116 HydrophobicContact CD1-CD1 3.83Å; L101-A145 HydrophobicContact CD1-CB 3.79Å; L101-V151 HydrophobicContact CB-CG1 4.12Å; L101-V151 HydrophobicContact CB-CG2 4.03Å; L101-V151 HydrophobicContact CD2-CG1 4.16Å
102	G	98.3	Very high	95.9	Very high	4 Å²	4	56.1 Å²	56.1	4%	0.041	33%	0.327	C	S	.	.	S	Bend	trans	78	9.5	176.6	0	0	0	0	0	115	H58	H58-G102 PolarHBondContact CE1-O 3.24Å; H58-G102 VanDerWaalsContact CE1-O 3.27Å; H58-G102 PolarHBondContact ND1-O 2.04Å; H58-G102 VanDerWaalsContact ND1-O 3.14Å
103	E	98.2	Very high	96	Very high	20 Å²	20	55.2 Å²	55.2	9%	0.093	32%	0.318	C	S	.	.			trans	-80	137.5	177.3	-172.8	170.9	-121.2	0	0	110.6	S65 Q67 V100 L101 R106 I113 W174	S65-E103 WeakPolarHBondContact CB-OE2 3.44Å; S65-E103 PolarHBondContact OG-OE2 2.94Å; Q67-E103 PolarHBondContact NE2-OE1 2.85Å; Q67-E103 PolarHBondContact NE2-OE2 2.84Å; V100-E103 HydrophobicContact CG1-CB 4.03Å; L101-E103 VanDerWaalsContact C-N 3.29Å; L101-E103 PolarHBondContact O-N 2.94Å; E103-R106 HydrophobicContact CG-CG 4.04Å; E103-I113 HydrophobicContact CB-CG2 3.9Å; E103-I113 HydrophobicContact CG-CG2 4.39Å; E103-W174 HydrophobicContact CB-CH2 4.49Å; E103-W174 HydrophobicContact CB-CZ2 4.41Å; E103-W174 HydrophobicContact CG-CZ2 4.35Å; E103-W174 VanDerWaalsContact O-CZ2 3.29Å; E103-W174 WeakPolarHBondContact O-CZ2 3.3Å
104	H	98	Very high	96.1	Very high	7 Å²	7	56 Å²	56	3%	0.032	32%	0.322	C	S	.	.	S	Bend	trans	-118.9	-47.4	167.7	179.3	70.7	0	0	0	110.5	E54 A55 P57 E111 W174 L187 L188	E54-H104 IonicContact OE1-CE1 3.54Å; E54-H104 IonicContact OE1-NE2 3.7Å; E54-H104 PolarHBondContact OE1-NE2 3.22Å; A55-H104 PolarHBondContact O-CE1 3.41Å; P57-H104 HydrophobicContact CB-CB 4.35Å; H104-E111 VanDerWaalsContact CB-OE1 3.24Å; H104-E111 WeakPolarHBondContact CB-OE1 3.24Å; H104-E111 PolarHBondContact N-OE1 2.86Å; H104-E111 PolarHBondContact N-OE2 2.64Å; H104-W174 PolarHBondContact O-NE1 2.76Å; H104-L187 CarbonylContact O-C 3.52Å; H104-L187 WeakPolarHBondContact O-CA 3.04Å; H104-L188 PolarHBondContact O-N 2.78Å
105	D	97.5	Very high	96.2	Very high	37 Å²	37	51.4 Å²	51.4	20%	0.198	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-111.5	100	-177.5	-176.4	-1.1	0	0	0	111.5	S107 S108 E111 A186 L187	D105-S107 PolarHBondContact O-N 2.81Å; D105-S107 VanDerWaalsContact O-N 3.07Å; D105-S107 WeakPolarHBondContact OD1-CA 3.24Å; D105-S107 WeakPolarHBondContact OD1-CB 3.22Å; D105-S107 PolarHBondContact OD1-N 3.04Å; D105-S107 PolarHBondContact OD1-OG 3.18Å; D105-S107 PolarHBondContact OD2-OG 2.9Å; D105-S108 PolarHBondContact O-N 2.98Å; D105-S108 VanDerWaalsContact O-N 3.08Å; D105-E111 PolarHBondContact N-OE2 2.86Å; D105-A186 WeakPolarHBondContact OD1-CB 3.41Å; D105-L187 HydrophobicContact CB-CD2 3.55Å
106	R	94.8	Very high	96.5	Very high	56 Å²	56	47.2 Å²	47.2	21%	0.211	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-7.7	179.5	-61.8	-176.4	-58.5	152.8	13.9	114.1	H73 E103 W174 T184 P185 A186	H73-R106 PolarHBondContact CD2-NH1 2.98Å; E103-R106 HydrophobicContact CG-CG 4.04Å; R106-W174 HydrophobicContact CG-CD2 4.41Å; R106-W174 HydrophobicContact CG-CG 4.39Å; R106-W174 VanDerWaalsContact NE-CD1 3.26Å; R106-W174 VanDerWaalsContact NE-CG 3.28Å; R106-T184 PolarHBondContact NH2-OG1 3.47Å; R106-P185 PolarHBondContact NH2-O 2.78Å; R106-A186 PolarHBondContact N-O 3.47Å
107	S	93.6	Very high	96.6	Very high	93 Å²	93	47.5 Å²	47.5	65%	0.65	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-2.1	176	73.1	0	0	0	0	113.3	D105	D105-S107 PolarHBondContact O-N 2.81Å; D105-S107 VanDerWaalsContact O-N 3.07Å; D105-S107 WeakPolarHBondContact OD1-CA 3.24Å; D105-S107 WeakPolarHBondContact OD1-CB 3.22Å; D105-S107 PolarHBondContact OD1-N 3.04Å; D105-S107 PolarHBondContact OD1-OG 3.18Å; D105-S107 PolarHBondContact OD2-OG 2.9Å
108	S	92.7	Very high	96.6	Very high	40 Å²	40	47.1 Å²	47.1	28%	0.28	28%	0.276	S	S	.	.			trans	-122	138.7	-174.2	-176.9	0	0	0	0	112.4	D105 A110	D105-S108 PolarHBondContact O-N 2.98Å; D105-S108 VanDerWaalsContact O-N 3.08Å; S108-A110 WeakPolarHBondContact OG-CB 3.28Å; S108-A110 PolarHBondContact OG-N 3.19Å; S108-A110 VanDerWaalsContact OG-N 3.16Å
109	N	91.3	Very high	96.6	Very high	171 Å²	171	45 Å²	45	91%	0.914	28%	0.283	S	S	*	.	S	Bend	trans	-98.9	11.6	170.3	-66.1	-35.2	0	0	0	112.3	E111	N109-E111 VanDerWaalsContact C-N 3.31Å
110	A	92.8	Very high	96.6	Very high	90 Å²	90	50 Å²	50	74%	0.744	31%	0.305	S	S	*	.			trans	-77.6	-20.3	-178.8	0	0	0	0	0	112.7	S108	S108-A110 WeakPolarHBondContact OG-CB 3.28Å; S108-A110 PolarHBondContact OG-N 3.19Å; S108-A110 VanDerWaalsContact OG-N 3.16Å
111	E	93.8	Very high	96.6	Very high	33 Å²	33	52.4 Å²	52.4	15%	0.154	32%	0.32	C	S	.	.	S	Bend	trans	-80.5	138.9	-176.8	-56.5	-168.7	104.2	0	0	111.4	H58 H104 D105 N109 I113	H58-E111 IonicContact CE1-OE1 3.68Å; H58-E111 PolarHBondContact CE1-OE1 3.35Å; H58-E111 IonicContact ND1-OE1 2.88Å; H58-E111 IonicContact NE2-OE1 3.57Å; H104-E111 VanDerWaalsContact CB-OE1 3.24Å; H104-E111 WeakPolarHBondContact CB-OE1 3.24Å; H104-E111 PolarHBondContact N-OE1 2.86Å; H104-E111 PolarHBondContact N-OE2 2.64Å; D105-E111 PolarHBondContact N-OE2 2.86Å; N109-E111 VanDerWaalsContact C-N 3.31Å; E111-I113 VanDerWaalsContact C-N 3.26Å; E111-I113 HydrophobicContact CB-CG2 3.94Å; E111-I113 PolarHBondContact O-N 3.42Å
112	S	93.9	Very high	96.6	Very high	97 Å²	97	53.7 Å²	53.7	68%	0.678	33%	0.325	S	S	*	.			trans	-79.4	80	172	-171.5	0	0	0	0	109.5
113	I	97.9	Very high	96.6	Very high	61 Å²	61	60.2 Å²	60.2	31%	0.313	35%	0.349	S	S	.	.			trans	-84.1	158.4	177	64.6	175.1	0	0	0	111.4	V100 L101 E103 E111 V115	V100-I113 HydrophobicContact CG1-CB 4.23Å; V100-I113 HydrophobicContact CG1-CD1 3.95Å; L101-I113 WeakPolarHBondContact O-CA 3.39Å; E103-I113 HydrophobicContact CB-CG2 3.9Å; E103-I113 HydrophobicContact CG-CG2 4.39Å; E111-I113 VanDerWaalsContact C-N 3.26Å; E111-I113 HydrophobicContact CB-CG2 3.94Å; E111-I113 PolarHBondContact O-N 3.42Å; I113-V115 HydrophobicContact CD1-CG2 3.94Å; I113-V115 HydrophobicContact CG1-CG2 4.25Å
114	Q	98.6	Very high	96.6	Very high	32 Å²	32	59.8 Å²	59.8	15%	0.15	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	125.4	167.9	-60.3	174.5	49.4	0	0	109.3	V100 L101 I116 Q146 N148	V100-Q114 WeakPolarHBondContact CA-O 3.29Å; L101-Q114 HydrophobicContact CB-CB 4.25Å; L101-Q114 PolarHBondContact N-O 2.97Å; L101-Q114 PolarHBondContact O-N 3.46Å; Q114-I116 HydrophobicContact CB-CD1 4.47Å; Q114-I116 HydrophobicContact CB-CG1 4.46Å; Q114-Q146 PolarHBondContact NE2-O 3.05Å; Q114-N148 PolarHBondContact NE2-ND2 3Å
115	V	98.3	Very high	96.6	Very high	79 Å²	79	64.7 Å²	64.7	48%	0.479	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	112.1	175.4	-175.7	0	0	0	0	107.8	R98 V100 I113	R98-V115 HydrophobicContact CB-CG1 4Å; R98-V115 HydrophobicContact CG-CG1 4.15Å; V100-V115 HydrophobicContact CG2-CG1 4.41Å; V100-V115 HydrophobicContact CG2-CG2 4.22Å; I113-V115 HydrophobicContact CD1-CG2 3.94Å; I113-V115 HydrophobicContact CG1-CG2 4.25Å
116	I	98.6	Very high	96.7	Very high	12 Å²	12	69.4 Å²	69.4	6%	0.062	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	136.7	-175.5	-52.1	176.7	0	0	0	108.7	V99 L101 Q114 L141 A145	V99-I116 WeakPolarHBondContact CA-O 3.4Å; V99-I116 VanDerWaalsContact CB-O 3.26Å; V99-I116 WeakPolarHBondContact CB-O 3.48Å; V99-I116 PolarHBondContact N-O 3.14Å; V99-I116 PolarHBondContact O-N 3.27Å; L101-I116 HydrophobicContact CD1-CD1 3.83Å; Q114-I116 HydrophobicContact CB-CD1 4.47Å; Q114-I116 HydrophobicContact CB-CG1 4.46Å; I116-L141 HydrophobicContact CD1-CD1 4.18Å; I116-L141 HydrophobicContact CG2-CB 3.95Å; I116-L141 HydrophobicContact CG2-CD2 4.35Å; I116-A145 HydrophobicContact CD1-CB 3.98Å
117	S	98.3	Very high	96.9	Very high	54 Å²	54	68.4 Å²	68.4	38%	0.378	40%	0.396	S	S	.	.			trans	-79.6	149.8	177	55.7	0	0	0	0	111.9	G119 S142	S117-G119 PolarHBondContact O-N 3.49Å; S117-S142 WeakPolarHBondContact O-CB 3.35Å; S117-S142 PolarHBondContact O-N 2.88Å; S117-S142 PolarHBondContact O-OG 2.8Å; S117-S142 VanDerWaalsContact OG-CB 3.32Å; S117-S142 WeakPolarHBondContact OG-CB 3.42Å; S117-S142 PolarHBondContact OG-OG 2.83Å
118	P	98.4	Very high	97.1	Very high	7 Å²	7	67 Å²	67	5%	0.045	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	114.1	166.6	-24.7	36.7	0	0	0	110.8	I93 R94 D97 V99 V121 I139	I93-P118 HydrophobicContact CD1-CG 4.16Å; I93-P118 HydrophobicContact CG1-CG 3.93Å; R94-P118 WeakPolarHBondContact O-CG 3.25Å; D97-P118 WeakPolarHBondContact O-CD 3.16Å; V99-P118 HydrophobicContact CG2-CG 4.05Å; P118-V121 HydrophobicContact CB-CG2 4.03Å; P118-I139 HydrophobicContact CB-CG2 3.78Å; P118-I139 HydrophobicContact CG-CG2 4.24Å
119	G	98.1	Very high	97.3	Very high	50 Å²	50	68.8 Å²	68.8	52%	0.515	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	-43.3	174	0	0	0	0	0	111.9	S117 K140	S117-G119 PolarHBondContact O-N 3.49Å; G119-K140 WeakPolarHBondContact CA-O 3.31Å; G119-K140 PolarHBondContact N-O 3.48Å
120	K	98.3	Very high	97.6	Very high	105 Å²	105	70.7 Å²	70.7	46%	0.457	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	142.9	172.9	-169.2	169.1	168.5	-165.4	0	110.8	F122 K140 N278	K120-F122 HydrophobicContact CB-CE2 3.74Å; K120-F122 HydrophobicContact CB-CZ 4.12Å; K120-F122 HydrophobicContact CD-CE1 3.92Å; K120-F122 HydrophobicContact CD-CE2 3.84Å; K120-F122 HydrophobicContact CD-CZ 3.31Å; K120-F122 HydrophobicContact CG-CD2 4.26Å; K120-F122 HydrophobicContact CG-CE1 4.25Å; K120-F122 HydrophobicContact CG-CE2 3.56Å; K120-F122 HydrophobicContact CG-CZ 3.58Å; K120-K140 HydrophobicContact CB-CB 4.35Å; K120-K140 PolarHBondContact N-O 2.76Å; K120-K140 PolarHBondContact O-N 3.2Å; K120-N278 PolarHBondContact NZ-OD1 3.08Å
121	V	98.5	Very high	97.8	Very high	52 Å²	52	69.5 Å²	69.5	32%	0.315	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	128.4	-177.7	178.5	0	0	0	0	109.4	I93 P118 T137	I93-V121 HydrophobicContact CG2-CB 4.25Å; I93-V121 HydrophobicContact CG2-CG1 3.37Å; I93-V121 HydrophobicContact CG2-CG2 3.81Å; P118-V121 HydrophobicContact CB-CG2 4.03Å; V121-T137 HydrophobicContact CG1-CG2 3.6Å
122	F	98.7	Very high	98	Very high	28 Å²	28	70.1 Å²	70.1	12%	0.123	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	86.9	-178	-57.9	-98.4	0	0	0	108.8	W84 K120 T137 L138 K140 W270 T274 N278	W84-F122 AromaticContact CH2-CD2 3.92Å; W84-F122 HydrophobicContact CH2-CD2 3.92Å; W84-F122 AromaticContact CH2-CE2 3.45Å; W84-F122 HydrophobicContact CH2-CE2 3.45Å; W84-F122 VanDerWaalsContact CH2-CE2 3.45Å; W84-F122 AromaticContact CH2-CZ 3.94Å; W84-F122 HydrophobicContact CH2-CZ 3.94Å; W84-F122 AromaticContact CZ3-CD2 3.62Å; W84-F122 HydrophobicContact CZ3-CD2 3.62Å; W84-F122 AromaticContact CZ3-CE2 3.58Å; W84-F122 HydrophobicContact CZ3-CE2 3.58Å; W84-F122 HydrophobicContact CZ3-CZ 4.47Å; K120-F122 HydrophobicContact CB-CE2 3.74Å; K120-F122 HydrophobicContact CB-CZ 4.12Å; K120-F122 HydrophobicContact CD-CE1 3.92Å; K120-F122 HydrophobicContact CD-CE2 3.84Å; K120-F122 HydrophobicContact CD-CZ 3.31Å; K120-F122 HydrophobicContact CG-CD2 4.26Å; K120-F122 HydrophobicContact CG-CE1 4.25Å; K120-F122 HydrophobicContact CG-CE2 3.56Å; K120-F122 HydrophobicContact CG-CZ 3.58Å; F122-T137 WeakPolarHBondContact O-CA 3.33Å; F122-L138 HydrophobicContact CB-CB 4.25Å; F122-L138 PolarHBondContact N-O 3.3Å; F122-L138 PolarHBondContact O-N 2.95Å; F122-K140 HydrophobicContact CE2-CB 4.01Å; F122-W270 HydrophobicContact CB-CZ2 4.43Å; F122-W270 VanDerWaalsContact O-CH2 3.25Å; F122-W270 WeakPolarHBondContact O-CH2 3.3Å; F122-W270 WeakPolarHBondContact O-CZ2 3Å; F122-T274 HydrophobicContact CB-CG2 3.85Å; F122-T274 HydrophobicContact CD1-CG2 3.66Å; F122-T274 HydrophobicContact CD2-CG2 4.3Å; F122-T274 HydrophobicContact CE1-CG2 4.19Å; F122-T274 HydrophobicContact CG-CG2 3.7Å; F122-N278 HydrophobicContact CE1-CB 4.32Å; F122-N278 VanDerWaalsContact CE1-CG 3.41Å; F122-N278 WeakPolarHBondContact CE1-ND2 3.43Å; F122-N278 VanDerWaalsContact CE1-OD1 3.24Å; F122-N278 WeakPolarHBondContact CE1-OD1 3.38Å; F122-N278 HydrophobicContact CZ-CB 3.81Å; F122-N278 VanDerWaalsContact CZ-OD1 3.22Å; F122-N278 WeakPolarHBondContact CZ-OD1 3.42Å
123	R	98.6	Very high	98.2	Very high	140 Å²	140	67 Å²	67	53%	0.528	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	138.5	170.9	-166.9	175.3	84.7	178.4	5.4	109.2	A89	A89-R123 HydrophobicContact CB-CG 3.71Å
124	H	98.7	Very high	98.2	Very high	12 Å²	12	65 Å²	65	6%	0.056	34%	0.343	C	S	.	.			trans	-54.7	127.1	176.4	-163.9	-77.9	0	0	0	110.4	Q126 Y127 N134 I136 W270	H124-Q126 PolarHBondContact ND1-N 2.91Å; H124-Q126 VanDerWaalsContact ND1-N 3.18Å; H124-Q126 PolarHBondContact O-N 2.82Å; H124-Y127 WeakPolarHBondContact O-CB 3.29Å; H124-Y127 PolarHBondContact O-N 2.74Å; H124-N134 HydrophobicContact CB-CB 4.23Å; H124-N134 WeakPolarHBondContact CB-O 3.43Å; H124-N134 WeakPolarHBondContact ND1-CB 3.24Å; H124-I136 HydrophobicContact CB-CG2 3.75Å; H124-I136 WeakPolarHBondContact CB-O 3.2Å; H124-I136 PolarHBondContact N-O 3.1Å; H124-W270 HydrophobicContact CB-CH2 4.43Å; H124-W270 HydrophobicContact CB-CZ2 4.12Å; H124-W270 AromaticContact CD2-CD1 3.68Å; H124-W270 AromaticContact CD2-CD2 3.3Å; H124-W270 AromaticContact CD2-CE2 3.61Å; H124-W270 AromaticContact CD2-CE3 3.79Å; H124-W270 AromaticContact CD2-CG 3.36Å; H124-W270 AromaticContact CD2-NE1 3.82Å; H124-W270 AromaticContact NE2-CD1 3.75Å; H124-W270 AromaticContact NE2-CG 3.53Å
125	P	98.4	Very high	98.2	Very high	109 Å²	109	63.5 Å²	63.5	71%	0.708	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-25.6	-172.2	24.5	-34.2	0	0	0	112.9
126	Q	98.6	Very high	98.3	Very high	137 Å²	137	59.8 Å²	59.8	64%	0.64	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	15.7	176.8	-56.9	178.9	-54.8	0	0	113.5	H124 N128 N134	H124-Q126 PolarHBondContact ND1-N 2.91Å; H124-Q126 VanDerWaalsContact ND1-N 3.18Å; H124-Q126 PolarHBondContact O-N 2.82Å; Q126-N128 PolarHBondContact O-N 2.9Å; Q126-N134 PolarHBondContact O-ND2 3.25Å
127	Y	98.7	Very high	98.3	Very high	35 Å²	35	59.4 Å²	59.4	14%	0.137	31%	0.311	C	S	.	.			trans	-57.3	125.9	170.9	170.8	-116.6	0	0	0	110	A89 H90 H124 I132 N133 D135	A89-Y127 HydrophobicContact CB-CD1 3.81Å; A89-Y127 HydrophobicContact CB-CD2 3.5Å; A89-Y127 HydrophobicContact CB-CE1 4.19Å; A89-Y127 HydrophobicContact CB-CE2 3.92Å; A89-Y127 HydrophobicContact CB-CG 3.44Å; A89-Y127 VanDerWaalsContact CB-CG 3.44Å; H90-Y127 WeakPolarHBondContact CB-OH 3.44Å; H124-Y127 WeakPolarHBondContact O-CB 3.29Å; H124-Y127 PolarHBondContact O-N 2.74Å; Y127-I132 HydrophobicContact CE2-CG2 4.34Å; Y127-N133 WeakPolarHBondContact CA-O 3.34Å; Y127-N133 WeakPolarHBondContact CD2-O 3.22Å; Y127-D135 HydrophobicContact CD2-CB 4.19Å; Y127-D135 HydrophobicContact CE2-CB 4.01Å
128	N	98.4	Very high	98.3	Very high	62 Å²	62	56.8 Å²	56.8	33%	0.332	29%	0.293	S	S	.	.	B	Isolated β-bridge	trans	-112.2	113.5	179.7	-176.3	-40.3	0	0	0	109.3	Q126 Y130 T131 I132 N133	Q126-N128 PolarHBondContact O-N 2.9Å; N128-Y130 PolarHBondContact O-N 3.03Å; N128-Y130 WeakPolarHBondContact OD1-CA 3.36Å; N128-Y130 WeakPolarHBondContact OD1-CB 3.26Å; N128-Y130 PolarHBondContact OD1-N 2.83Å; N128-T131 WeakPolarHBondContact CB-OG1 3.45Å; N128-T131 VanDerWaalsContact CG-OG1 3.32Å; N128-T131 PolarHBondContact OD1-N 3.16Å; N128-T131 VanDerWaalsContact OD1-N 3.1Å; N128-I132 WeakPolarHBondContact O-CA 3.32Å; N128-I132 PolarHBondContact O-N 3.28Å; N128-N133 PolarHBondContact N-O 3.36Å; N128-N133 VanDerWaalsContact N-O 3.09Å
129	S	97.1	Very high	98.3	Very high	78 Å²	78	56.5 Å²	56.5	55%	0.545	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-14.1	-178	55	0	0	0	0	114.8
130	Y	96.3	Very high	98.4	Very high	212 Å²	212	57 Å²	57	83%	0.831	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	-45	176.6	-60.5	-78.5	0	0	0	111.5	N128	N128-Y130 PolarHBondContact O-N 3.03Å; N128-Y130 WeakPolarHBondContact OD1-CA 3.36Å; N128-Y130 WeakPolarHBondContact OD1-CB 3.26Å; N128-Y130 PolarHBondContact OD1-N 2.83Å
131	T	97.4	Very high	98.4	Very high	64 Å²	64	52.5 Å²	52.5	39%	0.393	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-13.1	-178.8	63.1	0	0	0	0	113.4	N128 N133 M213	N128-T131 WeakPolarHBondContact CB-OG1 3.45Å; N128-T131 VanDerWaalsContact CG-OG1 3.32Å; N128-T131 PolarHBondContact OD1-N 3.16Å; N128-T131 VanDerWaalsContact OD1-N 3.1Å; T131-N133 PolarHBondContact O-N 3.3Å; T131-N133 PolarHBondContact OG1-N 3.32Å; T131-M213 WeakPolarHBondContact O-CE 3.34Å
132	I	98.1	Very high	98.4	Very high	46 Å²	46	53.1 Å²	53.1	24%	0.236	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.3	24.5	-174.3	-39.8	-179.3	0	0	0	111.7	Y127 N128 D135 S247 W248	Y127-I132 HydrophobicContact CE2-CG2 4.34Å; N128-I132 WeakPolarHBondContact O-CA 3.32Å; N128-I132 PolarHBondContact O-N 3.28Å; I132-D135 HydrophobicContact CG2-CB 3.85Å; I132-D135 WeakPolarHBondContact O-CB 3.39Å; I132-S247 WeakPolarHBondContact CG2-OG 3.1Å; I132-W248 HydrophobicContact CD1-CB 4.03Å; I132-W248 HydrophobicContact CD1-CG 3.95Å
133	N	98.3	Very high	98.4	Very high	31 Å²	31	54.6 Å²	54.6	17%	0.166	28%	0.281	C	S	.	.	B	Isolated β-bridge	trans	-73.4	151.4	170.1	-90.9	-9.6	0	0	0	111.4	Y127 N128 T131 D135 T210 L212 M213	Y127-N133 WeakPolarHBondContact CA-O 3.34Å; Y127-N133 WeakPolarHBondContact CD2-O 3.22Å; N128-N133 PolarHBondContact N-O 3.36Å; N128-N133 VanDerWaalsContact N-O 3.09Å; T131-N133 PolarHBondContact O-N 3.3Å; T131-N133 PolarHBondContact OG1-N 3.32Å; N133-D135 PolarHBondContact O-N 3.15Å; N133-T210 WeakPolarHBondContact OD1-CB 3.5Å; N133-T210 VanDerWaalsContact OD1-CG2 3.27Å; N133-T210 WeakPolarHBondContact OD1-CG2 3.34Å; N133-T210 PolarHBondContact OD1-OG1 2.94Å; N133-L212 HydrophobicContact CB-CD1 4.1Å; N133-M213 WeakPolarHBondContact OD1-CE 3.34Å
134	N	98.6	Very high	98.4	Very high	20 Å²	20	50.9 Å²	50.9	11%	0.107	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.3	40.2	-177.2	-52.8	-66	0	0	0	112.4	H124 Q126 I136 L212 L267	H124-N134 HydrophobicContact CB-CB 4.23Å; H124-N134 WeakPolarHBondContact CB-O 3.43Å; H124-N134 WeakPolarHBondContact ND1-CB 3.24Å; Q126-N134 PolarHBondContact O-ND2 3.25Å; N134-I136 PolarHBondContact O-N 2.82Å; N134-L212 VanDerWaalsContact OD1-CD1 3.27Å; N134-L212 WeakPolarHBondContact OD1-CD1 3.38Å; N134-L267 HydrophobicContact CB-CD2 4.39Å
135	D	98.8	Very high	98.4	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.005	27%	0.274	C	S	.	.			trans	-78.2	68	-177.2	-173.6	28.2	0	0	0	112	A89 H90 Y127 I132 N133 S247 A262	A89-D135 VanDerWaalsContact CA-OD1 3.31Å; A89-D135 WeakPolarHBondContact CA-OD1 3.3Å; A89-D135 WeakPolarHBondContact CB-OD1 3.08Å; A89-D135 PolarHBondContact N-OD1 3.2Å; H90-D135 IonicContact CE1-OD2 3.84Å; H90-D135 PolarHBondContact CE1-OD2 2.03Å; H90-D135 IonicContact CG-OD1 3.31Å; H90-D135 IonicContact CG-OD2 3.31Å; H90-D135 PolarHBondContact N-OD1 3.34Å; H90-D135 IonicContact ND1-OD1 2.63Å; H90-D135 PolarHBondContact ND1-OD1 3.06Å; H90-D135 IonicContact ND1-OD2 3.24Å; H90-D135 PolarHBondContact ND1-OD2 2.87Å; Y127-D135 HydrophobicContact CD2-CB 4.19Å; Y127-D135 HydrophobicContact CE2-CB 4.01Å; I132-D135 HydrophobicContact CG2-CB 3.85Å; I132-D135 WeakPolarHBondContact O-CB 3.39Å; N133-D135 PolarHBondContact O-N 3.15Å; D135-S247 VanDerWaalsContact OD2-CB 3.3Å; D135-S247 WeakPolarHBondContact OD2-CB 3.4Å; D135-S247 PolarHBondContact OD2-OG 2.55Å; D135-A262 HydrophobicContact CB-CB 4.45Å; D135-A262 WeakPolarHBondContact O-CB 3.41Å
136	I	98.9	Very high	98.4	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.005	27%	0.269	C	S	.	.			trans	-141.4	141.8	-178.3	-169.2	173.6	0	0	0	111.1	V86 T87 H124 N134 I245 L267 W270 V271	V86-I136 HydrophobicContact CG2-CD1 3.75Å; V86-I136 HydrophobicContact CG2-CG1 3.68Å; T87-I136 CarbonylContact O-C 3.39Å; T87-I136 WeakPolarHBondContact O-CA 3.09Å; H124-I136 HydrophobicContact CB-CG2 3.75Å; H124-I136 WeakPolarHBondContact CB-O 3.2Å; H124-I136 PolarHBondContact N-O 3.1Å; N134-I136 PolarHBondContact O-N 2.82Å; I136-I245 HydrophobicContact CB-CD1 4.4Å; I136-I245 HydrophobicContact CD1-CD1 3.66Å; I136-I245 HydrophobicContact CG1-CD1 3.67Å; I136-L267 HydrophobicContact CB-CD1 4.04Å; I136-L267 HydrophobicContact CD1-CB 4.07Å; I136-L267 HydrophobicContact CD1-CD1 4.29Å; I136-L267 HydrophobicContact CG2-CB 4.41Å; I136-L267 HydrophobicContact CG2-CD1 3.88Å; I136-L267 HydrophobicContact CG2-CD2 4.2Å; I136-L267 HydrophobicContact CG2-CG 4.38Å; I136-W270 HydrophobicContact CB-CZ3 4.25Å; I136-W270 HydrophobicContact CD1-CE3 4.2Å; I136-W270 HydrophobicContact CD1-CZ3 3.89Å; I136-W270 HydrophobicContact CG1-CE3 4.48Å; I136-W270 HydrophobicContact CG1-CZ3 3.77Å; I136-W270 HydrophobicContact CG2-CE3 3.82Å; I136-W270 HydrophobicContact CG2-CH2 4.24Å; I136-W270 HydrophobicContact CG2-CZ3 3.61Å; I136-V271 HydrophobicContact CD1-CG2 3.72Å
137	T	98.9	Very high	98.4	Very high	3 Å²	3	47.1 Å²	47.1	2%	0.018	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	141.1	172.6	-67.7	0	0	0	0	109.4	V86 T87 A89 I93 V121 F122 I139	V86-T137 WeakPolarHBondContact CA-O 3.49Å; T87-T137 HydrophobicContact CG2-CG2 4.3Å; T87-T137 PolarHBondContact N-O 2.89Å; T87-T137 PolarHBondContact O-N 3.04Å; A89-T137 VanDerWaalsContact CA-OG1 3.27Å; A89-T137 WeakPolarHBondContact CA-OG1 3.5Å; I93-T137 HydrophobicContact CG2-CG2 4.03Å; V121-T137 HydrophobicContact CG1-CG2 3.6Å; F122-T137 WeakPolarHBondContact O-CA 3.33Å; T137-I139 HydrophobicContact CG2-CG1 4.45Å
138	L	98.9	Very high	98.3	Very high	0 Å²	0	48 Å²	48	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	139.1	165.8	-70.2	174.9	0	0	0	110.4	I80 W84 V85 V86 F122 W270 V271 T274 I275	I80-L138 HydrophobicContact CD1-CD2 3.77Å; W84-L138 HydrophobicContact CE3-CB 3.92Å; W84-L138 HydrophobicContact CE3-CD1 4.43Å; W84-L138 HydrophobicContact CZ3-CB 3.81Å; W84-L138 HydrophobicContact CZ3-CD1 4.32Å; V85-L138 CarbonylContact O-C 3.52Å; V85-L138 WeakPolarHBondContact O-CA 3.47Å; V86-L138 HydrophobicContact CB-CD2 3.82Å; V86-L138 HydrophobicContact CG2-CD2 3.89Å; F122-L138 HydrophobicContact CB-CB 4.25Å; F122-L138 PolarHBondContact N-O 3.3Å; F122-L138 PolarHBondContact O-N 2.95Å; L138-W270 HydrophobicContact CB-CH2 4.28Å; L138-W270 HydrophobicContact CD1-CH2 4.25Å; L138-W270 HydrophobicContact CD1-CZ3 4.09Å; L138-W270 HydrophobicContact CG-CH2 3.9Å; L138-W270 HydrophobicContact CG-CZ3 3.81Å; L138-V271 HydrophobicContact CD1-CB 4.39Å; L138-V271 HydrophobicContact CD1-CG1 4.15Å; L138-V271 HydrophobicContact CD1-CG2 4.45Å; L138-V271 HydrophobicContact CD2-CG1 4.29Å; L138-V271 HydrophobicContact CD2-CG2 4.49Å; L138-T274 HydrophobicContact CD1-CG2 3.82Å; L138-I275 HydrophobicContact CD1-CG1 4.13Å
139	I	98.9	Very high	98.2	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	115.4	173.6	-56.7	163	0	0	0	106.8	L66 W84 V85 T87 I93 V99 P118 T137 L141	L66-I139 HydrophobicContact CD1-CD1 4.26Å; L66-I139 HydrophobicContact CD2-CD1 3.94Å; W84-I139 WeakPolarHBondContact CA-O 3.37Å; V85-I139 HydrophobicContact CB-CB 4.27Å; V85-I139 HydrophobicContact CG1-CD1 4.27Å; V85-I139 PolarHBondContact N-O 2.95Å; V85-I139 PolarHBondContact O-N 3.21Å; T87-I139 HydrophobicContact CG2-CD1 3.89Å; T87-I139 HydrophobicContact CG2-CG1 4.4Å; I93-I139 HydrophobicContact CB-CD1 4.33Å; I93-I139 HydrophobicContact CD1-CD1 4.41Å; I93-I139 HydrophobicContact CG1-CD1 3.85Å; I93-I139 HydrophobicContact CG1-CG1 4.34Å; I93-I139 HydrophobicContact CG2-CD1 4.05Å; I93-I139 HydrophobicContact CG2-CG1 3.93Å; V99-I139 HydrophobicContact CG2-CG2 4.21Å; P118-I139 HydrophobicContact CB-CG2 3.78Å; P118-I139 HydrophobicContact CG-CG2 4.24Å; T137-I139 HydrophobicContact CG2-CG1 4.45Å; I139-L141 HydrophobicContact CG2-CD2 4.33Å
140	K	98.8	Very high	98.3	Very high	62 Å²	62	50 Å²	50	27%	0.27	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	119.5	165.1	-169.2	171.9	-174.1	163.1	0	107.7	N83 W84 G119 K120 F122 N278	N83-K140 WeakPolarHBondContact O-CA 3.31Å; W84-K140 HydrophobicContact CD2-CB 4.21Å; W84-K140 HydrophobicContact CD2-CG 4.33Å; W84-K140 HydrophobicContact CE3-CB 3.9Å; W84-K140 HydrophobicContact CH2-CB 3.78Å; W84-K140 HydrophobicContact CH2-CD 4.05Å; W84-K140 HydrophobicContact CH2-CG 4.19Å; W84-K140 HydrophobicContact CZ2-CB 4.04Å; W84-K140 HydrophobicContact CZ2-CD 3.69Å; W84-K140 HydrophobicContact CZ2-CG 3.94Å; W84-K140 HydrophobicContact CZ3-CB 3.69Å; W84-K140 HydrophobicContact CZ3-CG 4.46Å; G119-K140 WeakPolarHBondContact CA-O 3.31Å; G119-K140 PolarHBondContact N-O 3.48Å; K120-K140 HydrophobicContact CB-CB 4.35Å; K120-K140 PolarHBondContact N-O 2.76Å; K120-K140 PolarHBondContact O-N 3.2Å; F122-K140 HydrophobicContact CE2-CB 4.01Å; K140-N278 PolarHBondContact NZ-O 3.42Å; K140-N278 PolarHBondContact NZ-OXT 3.15Å
141	L	98.8	Very high	98.4	Very high	9 Å²	9	39.9 Å²	39.9	5%	0.047	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	148.7	-179.8	-58.5	-178.6	0	0	0	110.7	L79 N83 V85 V99 I116 I139 S143 A145	L79-L141 HydrophobicContact CD1-CD1 4.22Å; N83-L141 PolarHBondContact O-N 2.75Å; V85-L141 HydrophobicContact CG2-CD1 4.49Å; V85-L141 HydrophobicContact CG2-CD2 4.04Å; V99-L141 HydrophobicContact CB-CD2 4Å; V99-L141 HydrophobicContact CG1-CD2 3.82Å; V99-L141 HydrophobicContact CG2-CD2 3.85Å; I116-L141 HydrophobicContact CD1-CD1 4.18Å; I116-L141 HydrophobicContact CG2-CB 3.95Å; I116-L141 HydrophobicContact CG2-CD2 4.35Å; I139-L141 HydrophobicContact CG2-CD2 4.33Å; L141-S143 WeakPolarHBondContact CB-O 3.46Å; L141-S143 PolarHBondContact O-N 3.17Å; L141-A145 HydrophobicContact CD1-CB 4.21Å
142	S	98.6	Very high	98.4	Very high	66 Å²	66	37.1 Å²	37.1	46%	0.462	20%	0.197	S	C	.	.	S	Bend	trans	-69	-25.9	176.4	59	0	0	0	0	112.8	S117	S117-S142 WeakPolarHBondContact O-CB 3.35Å; S117-S142 PolarHBondContact O-N 2.88Å; S117-S142 PolarHBondContact O-OG 2.8Å; S117-S142 VanDerWaalsContact OG-CB 3.32Å; S117-S142 WeakPolarHBondContact OG-CB 3.42Å; S117-S142 PolarHBondContact OG-OG 2.83Å
143	S	98.6	Very high	98.5	Very high	58 Å²	58	35.4 Å²	35.4	41%	0.406	19%	0.189	S	C	.	.	S	Bend	trans	-141.4	153.6	169.2	57.1	0	0	0	0	110.3	L141	L141-S143 WeakPolarHBondContact CB-O 3.46Å; L141-S143 PolarHBondContact O-N 3.17Å
144	P	98.7	Very high	98.5	Very high	63 Å²	63	34 Å²	34	41%	0.409	18%	0.181	S	C	.	.			trans	-63.4	137.5	176.5	-15.1	25.9	0	0	0	111.8	E82 N83	E82-P144 HydrophobicContact CB-CB 4.37Å; E82-P144 HydrophobicContact CG-CB 4.05Å; E82-P144 CarbonylContact O-C 3.53Å; E82-P144 VanDerWaalsContact O-CA 3.28Å; E82-P144 WeakPolarHBondContact O-CA 3.32Å; N83-P144 WeakPolarHBondContact OD1-CG 3.27Å
145	A	98.7	Very high	98.5	Very high	4 Å²	4	33.9 Å²	33.9	3%	0.033	18%	0.182	C	C	.	.			trans	-63.2	139.7	168.9	0	0	0	0	0	111	L79 E82 L101 I116 L141 L147 V151	L79-A145 HydrophobicContact CD1-CB 4.33Å; L79-A145 HydrophobicContact CD2-CB 4.42Å; E82-A145 PolarHBondContact O-N 2.87Å; L101-A145 HydrophobicContact CD1-CB 3.79Å; I116-A145 HydrophobicContact CD1-CB 3.98Å; L141-A145 HydrophobicContact CD1-CB 4.21Å; A145-L147 PolarHBondContact O-N 2.94Å; A145-V151 HydrophobicContact CB-CG1 4.29Å
146	Q	98.4	Very high	98.5	Very high	132 Å²	132	35.4 Å²	35.4	62%	0.617	19%	0.19	S	C	*	.			trans	-81.7	101.4	175.6	-60.3	-57.7	-48.4	0	0	109.6	Q114 N148	Q114-Q146 PolarHBondContact NE2-O 3.05Å; Q146-N148 PolarHBondContact O-N 2.53Å; Q146-N148 PolarHBondContact O-ND2 2.71Å; Q146-N148 VanDerWaalsContact O-ND2 3.09Å
147	L	98.3	Very high	98.5	Very high	43 Å²	43	35.4 Å²	35.4	23%	0.225	19%	0.19	C	C	.	.			trans	-65.8	132.9	-179.1	-55	-172.2	0	0	0	111.1	Y32 L79 E82 A145 V151	Y32-L147 HydrophobicContact CD2-CB 4.34Å; Y32-L147 HydrophobicContact CG-CB 4.41Å; L79-L147 HydrophobicContact CD2-CD2 3.94Å; E82-L147 HydrophobicContact CB-CD1 4.37Å; E82-L147 HydrophobicContact CB-CD2 4.06Å; E82-L147 HydrophobicContact CB-CG 4.14Å; A145-L147 PolarHBondContact O-N 2.94Å; L147-V151 CarbonylContact C-O 3.5Å; L147-V151 VanDerWaalsContact CA-O 3.25Å; L147-V151 WeakPolarHBondContact CA-O 3.38Å; L147-V151 HydrophobicContact CD2-CG1 4.5Å
148	N	96.8	Very high	98.5	Very high	52 Å²	52	36.1 Å²	36.1	28%	0.278	20%	0.197	S	C	.	.	B	Isolated β-bridge	trans	-159.1	-172.7	179.4	65.7	64.6	0	0	0	110.2	Q114 Q146 R150 V151	Q114-N148 PolarHBondContact NE2-ND2 3Å; Q146-N148 PolarHBondContact O-N 2.53Å; Q146-N148 PolarHBondContact O-ND2 2.71Å; Q146-N148 VanDerWaalsContact O-ND2 3.09Å; N148-R150 PolarHBondContact O-N 3.45Å; N148-R150 WeakPolarHBondContact OD1-CA 3.34Å; N148-R150 WeakPolarHBondContact OD1-CB 3.25Å; N148-R150 PolarHBondContact OD1-N 3.17Å; N148-V151 PolarHBondContact N-O 3.44Å; N148-V151 CarbonylContact O-C 3.44Å; N148-V151 PolarHBondContact O-N 2.89Å; N148-V151 VanDerWaalsContact O-N 3.15Å; N148-V151 PolarHBondContact OD1-N 2.84Å
149	M	96.8	Very high	98.4	Very high	102 Å²	102	39.4 Å²	39.4	50%	0.502	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-18.4	-178.1	71.8	-174.3	-62.1	0	0	115.4	A38 I39	A38-M149 HydrophobicContact CB-CB 3.79Å; I39-M149 HydrophobicContact CD1-CE 3.93Å; I39-M149 HydrophobicContact CG1-CE 4.19Å
150	R	97.7	Very high	98.3	Very high	80 Å²	80	44.9 Å²	44.9	30%	0.302	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	-11.1	-178.3	-48.6	179.5	-179.4	176.5	-1.9	113.3	H58 P61 N148	H58-R150 HydrophobicContact CB-CB 3.92Å; H58-R150 HydrophobicContact CB-CG 3.87Å; P61-R150 WeakPolarHBondContact CA-O 3.33Å; P61-R150 WeakPolarHBondContact CB-O 3.41Å; N148-R150 PolarHBondContact O-N 3.45Å; N148-R150 WeakPolarHBondContact OD1-CA 3.34Å; N148-R150 WeakPolarHBondContact OD1-CB 3.25Å; N148-R150 PolarHBondContact OD1-N 3.17Å
151	V	98.7	Very high	98.3	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.006	26%	0.255	C	S	.	.	B	Isolated β-bridge	trans	-136.8	104	-176	-178.4	0	0	0	0	108.6	P61 L79 L101 A145 L147 N148	P61-V151 WeakPolarHBondContact O-CA 3.46Å; L79-V151 HydrophobicContact CD2-CG1 3.86Å; L101-V151 HydrophobicContact CB-CG1 4.12Å; L101-V151 HydrophobicContact CB-CG2 4.03Å; L101-V151 HydrophobicContact CD2-CG1 4.16Å; A145-V151 HydrophobicContact CB-CG1 4.29Å; L147-V151 CarbonylContact C-O 3.5Å; L147-V151 VanDerWaalsContact CA-O 3.25Å; L147-V151 WeakPolarHBondContact CA-O 3.38Å; L147-V151 HydrophobicContact CD2-CG1 4.5Å; N148-V151 PolarHBondContact N-O 3.44Å; N148-V151 CarbonylContact O-C 3.44Å; N148-V151 PolarHBondContact O-N 2.89Å; N148-V151 VanDerWaalsContact O-N 3.15Å; N148-V151 PolarHBondContact OD1-N 2.84Å
152	S	98.6	Very high	98.2	Very high	6 Å²	6	49.8 Å²	49.8	4%	0.042	29%	0.288	C	S	.	.			trans	-155.1	149.8	179.3	68.2	0	0	0	0	110.5	P61 W62	P61-S152 CarbonylContact C-O 3.55Å; P61-S152 VanDerWaalsContact C-O 3.31Å; P61-S152 WeakPolarHBondContact CB-OG 3.33Å; P61-S152 WeakPolarHBondContact CG-OG 3.43Å; P61-S152 PolarHBondContact O-N 2.96Å; P61-S152 VanDerWaalsContact O-N 3.12Å; W62-S152 VanDerWaalsContact CA-O 3.22Å; W62-S152 WeakPolarHBondContact CA-O 3.41Å; W62-S152 WeakPolarHBondContact CB-O 3.32Å; W62-S152 PolarHBondContact N-O 2.93Å; W62-S152 VanDerWaalsContact N-O 3.16Å
153	P	98.7	Very high	98.1	Very high	10 Å²	10	47.6 Å²	47.6	7%	0.065	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-74.6	154.5	-171.9	29.7	-35	0	0	0	113.8	C34 G35 L79 I80	C34-P153 CarbonylContact C-O 3.57Å; C34-P153 WeakPolarHBondContact CA-O 3.25Å; C34-P153 HydrophobicContact CB-CG 4.45Å; G35-P153 PolarHBondContact N-O 3.33Å; L79-P153 CarbonylContact O-C 3.54Å; L79-P153 VanDerWaalsContact O-CA 3.23Å; L79-P153 WeakPolarHBondContact O-CA 3.35Å; I80-P153 VanDerWaalsContact C-CB 3.42Å; I80-P153 WeakPolarHBondContact O-CB 3.28Å
154	V	98.9	Very high	98.1	Very high	2 Å²	2	47.9 Å²	47.9	1%	0.012	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-83.2	151.2	166.1	71.5	0	0	0	0	110.3	W62 L79 I80 V233 W240 L242	W62-V154 HydrophobicContact CB-CB 3.86Å; W62-V154 HydrophobicContact CB-CG1 4.45Å; W62-V154 HydrophobicContact CD2-CB 3.66Å; W62-V154 HydrophobicContact CD2-CG2 3.95Å; W62-V154 HydrophobicContact CE3-CB 4.11Å; W62-V154 HydrophobicContact CE3-CG2 4.44Å; W62-V154 HydrophobicContact CG-CB 3.55Å; W62-V154 HydrophobicContact CG-CG1 4.44Å; W62-V154 HydrophobicContact CG-CG2 4.18Å; W62-V154 HydrophobicContact CZ2-CG2 4.28Å; L79-V154 PolarHBondContact O-N 2.8Å; I80-V154 HydrophobicContact CG2-CG1 4.06Å; V154-V233 HydrophobicContact CG2-CG1 3.63Å; V154-W240 WeakPolarHBondContact CG2-O 3.39Å; V154-L242 HydrophobicContact CG1-CB 3.83Å; V154-L242 HydrophobicContact CG1-CD2 4.31Å; V154-L242 HydrophobicContact CG1-CG 4.49Å; V154-L242 HydrophobicContact CG2-CB 4.04Å
155	C	98.8	Very high	98	Very high	16 Å²	16	46.7 Å²	46.7	11%	0.108	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	150.7	168.9	-61.9	0	0	0	0	110.4	C34 W240 T241 L242	C34-C155 HydrophobicContact CB-CB 3.92Å; C34-C155 WeakPolarHBondContact CB-SG 3.31Å; C34-C155 PolarHBondContact O-SG 2.79Å; C34-C155 WeakPolarHBondContact SG-CA 3.21Å; C34-C155 WeakPolarHBondContact SG-CB 3.37Å; C34-C155 CovalentContact SG-SG 2.04Å; C34-C155 PolarHBondContact SG-SG 2.91Å; C155-W240 WeakPolarHBondContact CB-O 3.3Å; C155-W240 PolarHBondContact N-O 2.8Å; C155-T241 HydrophobicContact CB-CG2 4.32Å; C155-T241 CarbonylContact O-C 3.58Å; C155-T241 WeakPolarHBondContact O-CA 3.42Å; C155-L242 WeakPolarHBondContact O-CB 3.22Å; C155-L242 PolarHBondContact O-N 3.09Å
156	L	98.7	Very high	97.9	Very high	34 Å²	34	49 Å²	49	18%	0.178	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	134.2	173.2	-72.6	176.3	0	0	0	110.8	I80 G158 L242 V264 R268 V271	I80-L156 HydrophobicContact CB-CD1 4.27Å; I80-L156 HydrophobicContact CB-CD2 4.49Å; I80-L156 HydrophobicContact CB-CG 4.35Å; I80-L156 HydrophobicContact CD1-CD1 4.12Å; I80-L156 HydrophobicContact CG2-CD1 4.33Å; I80-L156 HydrophobicContact CG2-CD2 3.72Å; I80-L156 HydrophobicContact CG2-CG 4.09Å; L156-G158 PolarHBondContact O-N 3.04Å; L156-L242 HydrophobicContact CD2-CB 4.25Å; L156-L242 HydrophobicContact CD2-CD2 3.91Å; L156-V264 HydrophobicContact CD2-CG1 4.24Å; L156-R268 PolarHBondContact O-NH1 3.18Å; L156-V271 HydrophobicContact CD1-CG1 3.81Å
157	A	98.7	Very high	97.7	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-58.3	134.7	170.7	0	0	0	0	0	110.6	F163 T241 L242 V264 T265 R268	A157-F163 HydrophobicContact CB-CE2 3.76Å; A157-F163 HydrophobicContact CB-CZ 4.25Å; A157-T241 HydrophobicContact CB-CG2 3.95Å; A157-T241 VanDerWaalsContact N-CG2 3.26Å; A157-L242 VanDerWaalsContact CB-O 3.28Å; A157-L242 WeakPolarHBondContact CB-O 3.48Å; A157-L242 PolarHBondContact N-O 3.11Å; A157-V264 HydrophobicContact CB-CB 4.48Å; A157-V264 HydrophobicContact CB-CG1 4.18Å; A157-T265 HydrophobicContact CB-CG2 3.79Å; A157-R268 VanDerWaalsContact C-NH1 3.32Å; A157-R268 WeakPolarHBondContact O-CD 3.31Å; A157-R268 WeakPolarHBondContact O-CG 3.46Å; A157-R268 PolarHBondContact O-NH1 3.42Å
158	G	98.4	Very high	97.5	Very high	18 Å²	18	49.1 Å²	49.1	19%	0.186	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-76.9	155.8	173.4	0	0	0	0	0	111.4	L156 S160 D161 T265	L156-G158 PolarHBondContact O-N 3.04Å; G158-S160 PolarHBondContact O-N 2.96Å; G158-S160 VanDerWaalsContact O-N 3.17Å; G158-D161 PolarHBondContact N-OD2 2.91Å; G158-D161 WeakPolarHBondContact O-CB 3.36Å; G158-D161 PolarHBondContact O-N 3Å; G158-T265 WeakPolarHBondContact O-CG2 3.47Å
159	S	97.9	Very high	97.4	Very high	70 Å²	70	46.7 Å²	46.7	49%	0.49	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-26.1	-179.1	-61.7	0	0	0	0	114.3	T265 R268	S159-T265 WeakPolarHBondContact CA-O 3.48Å; S159-T265 PolarHBondContact OG-O 3.09Å; S159-R268 WeakPolarHBondContact OG-CB 3.44Å
160	S	97.6	Very high	97.4	Very high	115 Å²	115	41.9 Å²	41.9	80%	0.804	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	0.3	177.7	60.5	0	0	0	0	113.8	G158	G158-S160 PolarHBondContact O-N 2.96Å; G158-S160 VanDerWaalsContact O-N 3.17Å
161	D	98	Very high	97.3	Very high	35 Å²	35	38.5 Å²	38.5	19%	0.187	24%	0.244	C	C	.	.			trans	-71.6	141.6	179.5	-70.8	-20.9	0	0	0	110.7	G158 F163 K236 T265	G158-D161 PolarHBondContact N-OD2 2.91Å; G158-D161 WeakPolarHBondContact O-CB 3.36Å; G158-D161 PolarHBondContact O-N 3Å; D161-F163 HydrophobicContact CB-CD2 4.25Å; D161-F163 HydrophobicContact CB-CE2 3.54Å; D161-F163 HydrophobicContact CB-CZ 4.23Å; D161-K236 WeakPolarHBondContact OD1-CE 3.4Å; D161-K236 IonicContact OD1-NZ 2.63Å; D161-K236 PolarHBondContact OD1-NZ 2.64Å; D161-K236 IonicContact OD2-NZ 2.68Å; D161-K236 PolarHBondContact OD2-NZ 3.27Å; D161-T265 HydrophobicContact CB-CG2 4.35Å
162	N	96.5	Very high	97.2	Very high	139 Å²	139	38.6 Å²	38.6	74%	0.743	25%	0.245	S	C	*	.			trans	-119.6	118.1	177.4	-177.7	29.4	0	0	0	110.3
163	F	97.8	Very high	97.2	Very high	20 Å²	20	38.4 Å²	38.4	9%	0.088	25%	0.245	C	C	.	.			trans	-111.3	101.6	175.5	-62.3	-90.7	0	0	0	108.4	A157 D161 M167 L195 C234 K236 T241 V243 T265	A157-F163 HydrophobicContact CB-CE2 3.76Å; A157-F163 HydrophobicContact CB-CZ 4.25Å; D161-F163 HydrophobicContact CB-CD2 4.25Å; D161-F163 HydrophobicContact CB-CE2 3.54Å; D161-F163 HydrophobicContact CB-CZ 4.23Å; F163-M167 HydrophobicContact CB-SD 4.3Å; F163-M167 HydrophobicContact CD1-SD 3.7Å; F163-M167 HydrophobicContact CG-SD 4.49Å; F163-L195 HydrophobicContact CB-CD1 3.59Å; F163-C234 HydrophobicContact CD1-CB 3.92Å; F163-C234 HydrophobicContact CE1-CB 4.01Å; F163-K236 HydrophobicContact CE1-CB 4.37Å; F163-K236 HydrophobicContact CZ-CD 4.26Å; F163-T241 HydrophobicContact CZ-CG2 4.16Å; F163-V243 HydrophobicContact CB-CG1 4.15Å; F163-V243 HydrophobicContact CD1-CG2 3.63Å; F163-V243 HydrophobicContact CD2-CB 4.48Å; F163-V243 HydrophobicContact CD2-CG1 3.91Å; F163-V243 HydrophobicContact CD2-CG2 3.72Å; F163-V243 HydrophobicContact CE1-CG2 3.47Å; F163-V243 VanDerWaalsContact CE1-CG2 3.47Å; F163-V243 HydrophobicContact CE2-CG1 4.47Å; F163-V243 HydrophobicContact CE2-CG2 3.57Å; F163-V243 HydrophobicContact CG-CG1 3.95Å; F163-V243 HydrophobicContact CG-CG2 3.75Å; F163-V243 HydrophobicContact CZ-CG2 3.43Å; F163-V243 VanDerWaalsContact CZ-CG2 3.43Å; F163-T265 HydrophobicContact CD2-CG2 4.36Å; F163-T265 HydrophobicContact CE2-CG2 4.33Å
164	P	97.5	Very high	97	Very high	64 Å²	64	38 Å²	38	42%	0.416	24%	0.242	S	C	.	.			trans	-73.4	155.7	-170.1	29.6	-35.4	0	0	0	112.6	M167	P164-M167 HydrophobicContact CG-CB 4.43Å; P164-M167 WeakPolarHBondContact O-CB 3.06Å; P164-M167 PolarHBondContact O-N 2.85Å
165	G	97.1	Very high	96.5	Very high	38 Å²	38	38 Å²	38	39%	0.392	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	142	168.7	0	0	0	0	0	111.4	M167	G165-M167 VanDerWaalsContact C-N 3.29Å; G165-M167 PolarHBondContact O-N 3.01Å
166	G	95.4	Very high	95.7	Very high	53 Å²	53	38.7 Å²	38.7	55%	0.546	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	86	-15.4	-174.4	0	0	0	0	0	114.7	K168 L195	G166-K168 PolarHBondContact O-N 3.21Å; G166-L195 PolarHBondContact N-O 2.89Å
167	M	95.8	Very high	94.6	Very high	66 Å²	66	39.3 Å²	39.3	33%	0.325	25%	0.25	S	S	.	.			trans	-60.1	130.6	172.8	178.4	171.1	-92.2	0	0	109.8	F163 P164 G165 P194 L195 C234	F163-M167 HydrophobicContact CB-SD 4.3Å; F163-M167 HydrophobicContact CD1-SD 3.7Å; F163-M167 HydrophobicContact CG-SD 4.49Å; P164-M167 HydrophobicContact CG-CB 4.43Å; P164-M167 WeakPolarHBondContact O-CB 3.06Å; P164-M167 PolarHBondContact O-N 2.85Å; G165-M167 VanDerWaalsContact C-N 3.29Å; G165-M167 PolarHBondContact O-N 3.01Å; M167-P194 CarbonylContact O-C 3.52Å; M167-P194 WeakPolarHBondContact O-CA 3.47Å; M167-L195 HydrophobicContact CB-CD1 4.23Å; M167-L195 HydrophobicContact CB-CG 4.5Å; M167-L195 PolarHBondContact O-N 3.26Å; M167-C234 HydrophobicContact SD-CB 4.23Å
168	K	93.3	Very high	93.3	Very high	111 Å²	111	47 Å²	47	48%	0.483	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	125	179.3	-54.9	-164.3	-170.3	179.1	0	109.7	Y46 G166	Y46-K168 HydrophobicContact CD1-CB 4.14Å; Y46-K168 HydrophobicContact CD1-CD 3.32Å; Y46-K168 HydrophobicContact CD1-CG 4.37Å; Y46-K168 HydrophobicContact CE1-CB 3.77Å; Y46-K168 HydrophobicContact CE1-CD 3.82Å; Y46-K168 HydrophobicContact CE1-CG 4.46Å; Y46-K168 HydrophobicContact CG-CD 4.29Å; Y46-K168 PolarHBondContact O-NZ 2.93Å; G166-K168 PolarHBondContact O-N 3.21Å
169	C	95.6	Very high	92.3	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	176.5	178.4	-59	0	0	0	0	108.8	A192 L193 L195 L232 V233 C234	C169-A192 CarbonylContact O-C 3.57Å; C169-A192 WeakPolarHBondContact O-CA 3.48Å; C169-L193 PolarHBondContact N-O 3.27Å; C169-L193 PolarHBondContact O-N 2.88Å; C169-L195 HydrophobicContact CB-CD2 4.3Å; C169-L195 VanDerWaalsContact SG-CG 3.51Å; C169-L232 HydrophobicContact CB-CD1 3.83Å; C169-L232 HydrophobicContact CB-CG 4.39Å; C169-V233 CarbonylContact C-O 3.56Å; C169-V233 VanDerWaalsContact CA-O 3.3Å; C169-V233 WeakPolarHBondContact CA-O 3.03Å; C169-V233 WeakPolarHBondContact CB-O 3.45Å; C169-C234 HydrophobicContact CB-CB 4.07Å; C169-C234 WeakPolarHBondContact CB-SG 3.49Å; C169-C234 WeakPolarHBondContact SG-CB 3.41Å; C169-C234 CovalentContact SG-SG 2.03Å; C169-C234 PolarHBondContact SG-SG 3.31Å
170	V	96.1	Very high	91.4	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.006	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	136	-179.3	-175.6	0	0	0	0	109.7	I43 W60 Q190 A191 L232 V233 W240	I43-V170 HydrophobicContact CD1-CG2 3.72Å; I43-V170 HydrophobicContact CG1-CG2 4.43Å; W60-V170 HydrophobicContact CH2-CB 3.98Å; W60-V170 HydrophobicContact CH2-CG1 3.87Å; W60-V170 HydrophobicContact CH2-CG2 4.18Å; W60-V170 HydrophobicContact CZ2-CB 4.2Å; W60-V170 HydrophobicContact CZ2-CG1 3.58Å; W60-V170 HydrophobicContact CZ2-CG2 4.45Å; V170-Q190 HydrophobicContact CG1-CB 4.19Å; V170-A191 VanDerWaalsContact CA-O 3.31Å; V170-A191 WeakPolarHBondContact CA-O 3.39Å; V170-L232 WeakPolarHBondContact O-CA 3.49Å; V170-V233 HydrophobicContact CB-CG2 4.26Å; V170-V233 PolarHBondContact N-O 3.19Å; V170-V233 WeakPolarHBondContact O-CG2 3.22Å; V170-V233 PolarHBondContact O-N 3.19Å; V170-W240 HydrophobicContact CB-CZ3 4.21Å; V170-W240 HydrophobicContact CG2-CH2 3.73Å; V170-W240 HydrophobicContact CG2-CZ3 3.79Å
171	T	96.2	Very high	90.5	Very high	9 Å²	9	50.8 Å²	50.8	6%	0.055	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	145.7	165.7	-167.8	0	0	0	0	108.7	Q190 A191 L193 P231	T171-Q190 CarbonylContact O-C 3.56Å; T171-Q190 WeakPolarHBondContact O-CA 3.44Å; T171-A191 HydrophobicContact CG2-CB 4.15Å; T171-A191 PolarHBondContact N-O 2.93Å; T171-A191 PolarHBondContact O-N 3.27Å; T171-L193 HydrophobicContact CG2-CD1 4.37Å; T171-L193 HydrophobicContact CG2-CD2 3.7Å; T171-P231 VanDerWaalsContact CA-O 3.27Å; T171-P231 WeakPolarHBondContact CA-O 3.27Å; T171-P231 PolarHBondContact OG1-O 2.89Å; T171-P231 VanDerWaalsContact OG1-O 3.05Å
172	S	96.9	Very high	89.6	Confident	3 Å²	3	53.8 Å²	53.8	2%	0.021	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	153.7	175.7	57.3	0	0	0	0	111	Q63 Q189 P231	Q63-S172 PolarHBondContact OE1-O 3.21Å; Q63-S172 PolarHBondContact OE1-OG 2.98Å; S172-Q189 WeakPolarHBondContact CA-O 3.38Å; S172-Q189 WeakPolarHBondContact CB-O 3.2Å; S172-P231 WeakPolarHBondContact OG-CG 3.35Å
173	G	96.8	Very high	88.9	Confident	3 Å²	3	53.5 Å²	53.5	3%	0.031	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	167.7	178.4	179.5	0	0	0	0	0	113.6	Q189 D227	G173-Q189 PolarHBondContact N-O 2.76Å; G173-Q189 WeakPolarHBondContact O-CB 3.46Å; G173-Q189 PolarHBondContact O-N 3.17Å; G173-D227 WeakPolarHBondContact CA-OD1 3.4Å
174	W	95.4	Very high	88.4	Confident	1 Å²	1	54.9 Å²	54.9	0%	0.004	31%	0.314	C	S	.	.			trans	-111.7	26.2	174.5	-61.6	-92.4	0	0	0	111.4	Q63 H73 E103 H104 R106 T184 A186 L187 L188	Q63-W174 HydrophobicContact CG-CE3 4.48Å; Q63-W174 HydrophobicContact CG-CH2 3.63Å; Q63-W174 HydrophobicContact CG-CZ3 3.5Å; H73-W174 AromaticContact CE1-CE3 3.85Å; E103-W174 HydrophobicContact CB-CH2 4.49Å; E103-W174 HydrophobicContact CB-CZ2 4.41Å; E103-W174 HydrophobicContact CG-CZ2 4.35Å; E103-W174 VanDerWaalsContact O-CZ2 3.29Å; E103-W174 WeakPolarHBondContact O-CZ2 3.3Å; H104-W174 PolarHBondContact O-NE1 2.76Å; R106-W174 HydrophobicContact CG-CD2 4.41Å; R106-W174 HydrophobicContact CG-CG 4.39Å; R106-W174 VanDerWaalsContact NE-CD1 3.26Å; R106-W174 VanDerWaalsContact NE-CG 3.28Å; W174-T184 WeakPolarHBondContact O-CB 3.41Å; W174-T184 VanDerWaalsContact O-CG2 3.24Å; W174-T184 WeakPolarHBondContact O-CG2 3.2Å; W174-A186 VanDerWaalsContact CD1-O 3.25Å; W174-A186 PolarHBondContact NE1-O 3.47Å; W174-L187 VanDerWaalsContact CD1-C 3.5Å; W174-L188 HydrophobicContact CD2-CD1 3.81Å; W174-L188 HydrophobicContact CE3-CD1 3.93Å; W174-L188 HydrophobicContact CG-CD1 4.49Å; W174-L188 HydrophobicContact CH2-CD1 3.91Å; W174-L188 HydrophobicContact CZ2-CB 3.82Å; W174-L188 HydrophobicContact CZ2-CD1 3.78Å; W174-L188 HydrophobicContact CZ2-CD2 4.46Å; W174-L188 HydrophobicContact CZ2-CG 4.22Å; W174-L188 HydrophobicContact CZ3-CD1 3.98Å; W174-L188 VanDerWaalsContact NE1-CA 3.33Å; W174-L188 VanDerWaalsContact NE1-N 3.13Å
175	G	87.6	Confident	88	Confident	3 Å²	3	52.9 Å²	52.9	3%	0.031	30%	0.301	C	S	.	.	S	Bend	trans	-64.1	166.4	171.1	0	0	0	0	0	112.2	T177 P185 M225 D227	G175-T177 PolarHBondContact O-N 2.61Å; G175-P185 WeakPolarHBondContact O-CD 3.3Å; G175-P185 WeakPolarHBondContact O-CG 3.48Å; G175-M225 CarbonylContact C-O 3.45Å; G175-M225 WeakPolarHBondContact CA-O 3.48Å; G175-D227 VanDerWaalsContact CA-OD1 3.26Å; G175-D227 WeakPolarHBondContact CA-OD1 3.35Å; G175-D227 PolarHBondContact N-OD1 2.8Å
176	L	81.9	Confident	87.9	Confident	30 Å²	30	52.7 Å²	52.7	16%	0.157	30%	0.296	C	S	.	.			trans	-56.8	129.9	-179.5	-64	173	0	0	0	110.7	R178 A181 T184 C224 M225	L176-R178 WeakPolarHBondContact CB-O 3.43Å; L176-R178 PolarHBondContact O-N 3.07Å; L176-A181 HydrophobicContact CD2-CB 4.17Å; L176-T184 HydrophobicContact CD2-CG2 3.76Å; L176-T184 HydrophobicContact CG-CG2 4.13Å; L176-C224 HydrophobicContact CB-CB 4.26Å; L176-C224 WeakPolarHBondContact O-CB 3.27Å; L176-M225 HydrophobicContact CD1-CB 3.99Å; L176-M225 HydrophobicContact CD1-SD 4.42Å; L176-M225 HydrophobicContact CG-CB 4.34Å; L176-M225 PolarHBondContact N-O 2.89Å
177	T	75.4	Confident	87.9	Confident	47 Å²	47	52.8 Å²	52.8	29%	0.288	28%	0.283	S	S	.	.	S	Bend	trans	-76.7	-12.8	173.7	54.6	0	0	0	0	112.5	N51 G175 P185 Q189	N51-T177 WeakPolarHBondContact CB-O 3.41Å; G175-T177 PolarHBondContact O-N 2.61Å; T177-P185 HydrophobicContact CG2-CB 4.15Å; T177-P185 HydrophobicContact CG2-CG 3.87Å; T177-Q189 HydrophobicContact CG2-CG 3.96Å
178	R	72	Confident	88	Confident	161 Å²	161	49.8 Å²	49.8	61%	0.608	27%	0.269	S	S	*	.	S	Bend	trans	-148.9	138.4	172.7	-57.3	-177.7	-177.7	-176.8	0.5	108.8	L176 N180 A181	L176-R178 WeakPolarHBondContact CB-O 3.43Å; L176-R178 PolarHBondContact O-N 3.07Å; R178-N180 PolarHBondContact O-N 3.08Å; R178-A181 HydrophobicContact CB-CB 4.24Å; R178-A181 VanDerWaalsContact O-CB 3.25Å; R178-A181 WeakPolarHBondContact O-CB 3.34Å; R178-A181 PolarHBondContact O-N 3.42Å
179	Y	77.1	Confident	88	Confident	139 Å²	139	46.3 Å²	46.3	55%	0.545	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-27.8	-174.7	83	-89.1	0	0	0	114.5	T252	Y179-T252 WeakPolarHBondContact CB-O 3Å
180	N	78.6	Confident	88	Confident	111 Å²	111	46.4 Å²	46.4	59%	0.594	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	10.9	179.8	67.6	-24.8	0	0	0	113.1	R178	R178-N180 PolarHBondContact O-N 3.08Å
181	A	80.1	Confident	87.8	Confident	33 Å²	33	47 Å²	47	27%	0.273	26%	0.259	S	S	.	.			trans	-65.1	136.7	174.2	0	0	0	0	0	109.7	L176 R178 N183	L176-A181 HydrophobicContact CD2-CB 4.17Å; R178-A181 HydrophobicContact CB-CB 4.24Å; R178-A181 VanDerWaalsContact O-CB 3.25Å; R178-A181 WeakPolarHBondContact O-CB 3.34Å; R178-A181 PolarHBondContact O-N 3.42Å; A181-N183 PolarHBondContact O-N 3.34Å
182	A	78.4	Confident	87.5	Confident	98 Å²	98	47.4 Å²	47.4	81%	0.81	26%	0.264	S	S	*	.	S	Bend	trans	-66.8	-28.8	179.6	0	0	0	0	0	112.5
183	N	82.9	Confident	87.2	Confident	133 Å²	133	47.5 Å²	47.5	71%	0.711	26%	0.264	S	S	*	.	S	Bend	trans	-138.2	154	-177	-61.8	-55.2	0	0	0	110.7	A181	A181-N183 PolarHBondContact O-N 3.34Å
184	T	86.6	Confident	87.1	Confident	49 Å²	49	49.2 Å²	49.2	30%	0.301	27%	0.274	S	S	.	.			trans	-70.8	150.4	166.5	44.3	0	0	0	0	110.8	R106 W174 L176	R106-T184 PolarHBondContact NH2-OG1 3.47Å; W174-T184 WeakPolarHBondContact O-CB 3.41Å; W174-T184 VanDerWaalsContact O-CG2 3.24Å; W174-T184 WeakPolarHBondContact O-CG2 3.2Å; L176-T184 HydrophobicContact CD2-CG2 3.76Å; L176-T184 HydrophobicContact CG-CG2 4.13Å
185	P	89.6	Confident	87.2	Confident	22 Å²	22	49.3 Å²	49.3	14%	0.143	28%	0.275	C	S	.	.			trans	-63	141.2	178.2	29.9	-37.7	0	0	0	110.9	R106 G175 T177 Q189	R106-P185 PolarHBondContact NH2-O 2.78Å; G175-P185 WeakPolarHBondContact O-CD 3.3Å; G175-P185 WeakPolarHBondContact O-CG 3.48Å; T177-P185 HydrophobicContact CG2-CB 4.15Å; T177-P185 HydrophobicContact CG2-CG 3.87Å; P185-Q189 HydrophobicContact CB-CG 4.17Å; P185-Q189 HydrophobicContact CG-CG 3.75Å
186	A	93.4	Very high	87.7	Confident	34 Å²	34	50.6 Å²	50.6	28%	0.281	28%	0.281	S	S	.	.	S	Bend	trans	-68.9	-40.5	175.2	0	0	0	0	0	111.7	D105 R106 W174	D105-A186 WeakPolarHBondContact OD1-CB 3.41Å; R106-A186 PolarHBondContact N-O 3.47Å; W174-A186 VanDerWaalsContact CD1-O 3.25Å; W174-A186 PolarHBondContact NE1-O 3.47Å
187	L	96	Very high	88.5	Confident	54 Å²	54	51.9 Å²	51.9	28%	0.283	29%	0.29	S	S	.	.	B	Isolated β-bridge	trans	-85.5	142.1	-177.3	-53	175.6	0	0	0	111.5	E54 H104 D105 W174 Q189	E54-L187 HydrophobicContact CG-CB 4.03Å; E54-L187 HydrophobicContact CG-CD1 4.29Å; E54-L187 WeakPolarHBondContact OE2-CD1 3.37Å; H104-L187 CarbonylContact O-C 3.52Å; H104-L187 WeakPolarHBondContact O-CA 3.04Å; D105-L187 HydrophobicContact CB-CD2 3.55Å; W174-L187 VanDerWaalsContact CD1-C 3.5Å; L187-Q189 PolarHBondContact O-N 3.35Å; L187-Q189 PolarHBondContact O-NE2 2.85Å
188	L	97.1	Very high	89.6	Confident	3 Å²	3	51.3 Å²	51.3	2%	0.016	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-61	130.8	178.1	-179.2	62.9	0	0	0	110.4	A55 W60 Q63 H104 W174	A55-L188 HydrophobicContact CB-CB 4.44Å; A55-L188 HydrophobicContact CB-CD2 4.24Å; A55-L188 HydrophobicContact CB-CG 4.15Å; A55-L188 PolarHBondContact N-O 2.82Å; W60-L188 HydrophobicContact CB-CD2 4.24Å; Q63-L188 HydrophobicContact CB-CD2 4.37Å; Q63-L188 HydrophobicContact CG-CD1 3.85Å; Q63-L188 HydrophobicContact CG-CD2 4.12Å; H104-L188 PolarHBondContact O-N 2.78Å; W174-L188 HydrophobicContact CD2-CD1 3.81Å; W174-L188 HydrophobicContact CE3-CD1 3.93Å; W174-L188 HydrophobicContact CG-CD1 4.49Å; W174-L188 HydrophobicContact CH2-CD1 3.91Å; W174-L188 HydrophobicContact CZ2-CB 3.82Å; W174-L188 HydrophobicContact CZ2-CD1 3.78Å; W174-L188 HydrophobicContact CZ2-CD2 4.46Å; W174-L188 HydrophobicContact CZ2-CG 4.22Å; W174-L188 HydrophobicContact CZ3-CD1 3.98Å; W174-L188 VanDerWaalsContact NE1-CA 3.33Å; W174-L188 VanDerWaalsContact NE1-N 3.13Å
189	Q	95.1	Very high	90.8	Very high	38 Å²	38	47.1 Å²	47.1	18%	0.178	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	157.4	175.9	-53.8	-59.9	-73.4	0	0	110.6	E53 S172 G173 T177 P185 L187	E53-Q189 CarbonylContact O-C 3.49Å; E53-Q189 WeakPolarHBondContact O-CA 3.18Å; S172-Q189 WeakPolarHBondContact CA-O 3.38Å; S172-Q189 WeakPolarHBondContact CB-O 3.2Å; G173-Q189 PolarHBondContact N-O 2.76Å; G173-Q189 WeakPolarHBondContact O-CB 3.46Å; G173-Q189 PolarHBondContact O-N 3.17Å; T177-Q189 HydrophobicContact CG2-CG 3.96Å; P185-Q189 HydrophobicContact CB-CG 4.17Å; P185-Q189 HydrophobicContact CG-CG 3.75Å; L187-Q189 PolarHBondContact O-N 3.35Å; L187-Q189 PolarHBondContact O-NE2 2.85Å
190	Q	94.3	Very high	91.8	Very high	3 Å²	3	43.2 Å²	43.2	1%	0.014	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	153	170.9	65.5	179.5	43.3	0	0	110.4	V42 G52 E53 A55 V170 T171	V42-Q190 PolarHBondContact O-NE2 2.89Å; G52-Q190 CarbonylContact C-O 3.51Å; G52-Q190 VanDerWaalsContact CA-O 3.28Å; G52-Q190 WeakPolarHBondContact CA-O 3.35Å; E53-Q190 HydrophobicContact CG-CG 3.62Å; E53-Q190 PolarHBondContact N-O 2.88Å; E53-Q190 PolarHBondContact O-N 3.12Å; E53-Q190 PolarHBondContact OE1-NE2 2.68Å; A55-Q190 HydrophobicContact CB-CB 4.28Å; A55-Q190 HydrophobicContact CB-CG 4.2Å; V170-Q190 HydrophobicContact CG1-CB 4.19Å; T171-Q190 CarbonylContact O-C 3.56Å; T171-Q190 WeakPolarHBondContact O-CA 3.44Å
191	A	91.3	Very high	92.7	Very high	12 Å²	12	37.9 Å²	37.9	10%	0.099	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	132.8	171.8	0	0	0	0	0	110.6	V170 T171 L193 A221	V170-A191 VanDerWaalsContact CA-O 3.31Å; V170-A191 WeakPolarHBondContact CA-O 3.39Å; T171-A191 HydrophobicContact CG2-CB 4.15Å; T171-A191 PolarHBondContact N-O 2.93Å; T171-A191 PolarHBondContact O-N 3.27Å; A191-L193 WeakPolarHBondContact O-CD2 3.28Å; A191-A221 HydrophobicContact CB-CB 3.88Å
192	A	91.4	Very high	93.5	Very high	18 Å²	18	38.4 Å²	38.4	15%	0.149	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	131.5	168.7	0	0	0	0	0	110.1	I43 Y46 C169	I43-A192 HydrophobicContact CG2-CB 3.82Å; Y46-A192 HydrophobicContact CD1-CB 3.92Å; Y46-A192 HydrophobicContact CE1-CB 4.05Å; C169-A192 CarbonylContact O-C 3.57Å; C169-A192 WeakPolarHBondContact O-CA 3.48Å
193	L	91.1	Very high	94.4	Very high	5 Å²	5	42.5 Å²	42.5	3%	0.026	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	141.5	-176.7	59.2	169.2	0	0	0	111.3	C169 T171 A191 A216 L232 Y261	C169-L193 PolarHBondContact N-O 3.27Å; C169-L193 PolarHBondContact O-N 2.88Å; T171-L193 HydrophobicContact CG2-CD1 4.37Å; T171-L193 HydrophobicContact CG2-CD2 3.7Å; A191-L193 WeakPolarHBondContact O-CD2 3.28Å; L193-A216 HydrophobicContact CD1-CB 3.35Å; L193-A216 HydrophobicContact CG-CB 3.84Å; L193-L232 HydrophobicContact CD1-CD1 4.15Å; L193-L232 HydrophobicContact CD2-CD1 3.92Å; L193-L232 HydrophobicContact CG-CD1 4.1Å; L193-Y261 HydrophobicContact CD1-CE2 4.48Å; L193-Y261 WeakPolarHBondContact CD1-OH 3.16Å
194	P	94.1	Very high	95.1	Very high	39 Å²	39	41.8 Å²	41.8	25%	0.253	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	142.9	173.8	31.7	-33.5	0	0	0	110.2	M167 A216 G217 A219	M167-P194 CarbonylContact O-C 3.52Å; M167-P194 WeakPolarHBondContact O-CA 3.47Å; P194-A216 CarbonylContact O-C 3.59Å; P194-A216 WeakPolarHBondContact O-CA 3.47Å; P194-A216 WeakPolarHBondContact O-CB 3.48Å; P194-G217 PolarHBondContact O-N 3.38Å; P194-A219 HydrophobicContact CG-CB 3.91Å
195	L	97.4	Very high	95.6	Very high	4 Å²	4	41.8 Å²	41.8	2%	0.021	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	150.5	162.9	-63.1	-175.7	0	0	0	110.2	F163 G166 M167 C169 I214 A216 L232	F163-L195 HydrophobicContact CB-CD1 3.59Å; G166-L195 PolarHBondContact N-O 2.89Å; M167-L195 HydrophobicContact CB-CD1 4.23Å; M167-L195 HydrophobicContact CB-CG 4.5Å; M167-L195 PolarHBondContact O-N 3.26Å; C169-L195 HydrophobicContact CB-CD2 4.3Å; C169-L195 VanDerWaalsContact SG-CG 3.51Å; L195-I214 HydrophobicContact CD1-CD1 4.12Å; L195-I214 HydrophobicContact CD2-CD1 4.1Å; L195-A216 HydrophobicContact CD2-CB 3.92Å; L195-L232 HydrophobicContact CD2-CD2 3.81Å
196	L	98.1	Very high	95.9	Very high	30 Å²	30	42.4 Å²	42.4	16%	0.157	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	150.4	169.4	-78.6	75.2	0	0	0	109.4	D200 C201 C215 G217 P258	L196-D200 HydrophobicContact CB-CB 4.38Å; L196-D200 HydrophobicContact CD2-CB 4.24Å; L196-C201 HydrophobicContact CB-CB 4.41Å; L196-C201 HydrophobicContact CD2-CB 4.48Å; L196-C215 HydrophobicContact CB-CB 4.13Å; L196-C215 PolarHBondContact N-O 3.17Å; L196-G217 WeakPolarHBondContact CD1-O 3.25Å; L196-P258 HydrophobicContact CD2-CB 3.91Å; L196-P258 HydrophobicContact CD2-CG 3.6Å
197	T	98.2	Very high	96.1	Very high	57 Å²	57	46.3 Å²	46.3	35%	0.35	26%	0.256	S	S	.	.			trans	-66.7	154.1	162.1	72.4	0	0	0	0	109.3	S199 D200 C201	T197-S199 PolarHBondContact O-N 2.81Å; T197-D200 PolarHBondContact O-N 2.84Å; T197-D200 PolarHBondContact OG1-N 3.18Å; T197-D200 VanDerWaalsContact OG1-N 3.08Å; T197-D200 PolarHBondContact OG1-OD2 3.29Å; T197-C201 PolarHBondContact O-N 2.85Å
198	N	98.1	Very high	96.1	Very high	34 Å²	34	48.5 Å²	48.5	18%	0.182	27%	0.267	C	S	.	.	H	α-helix	trans	-58.1	-35.1	173.7	-84	5.1	0	0	0	111.4	C201 S202 I209 T210 M213 R263	N198-C201 PolarHBondContact O-N 2.96Å; N198-S202 VanDerWaalsContact O-CB 3.31Å; N198-S202 WeakPolarHBondContact O-CB 3.29Å; N198-S202 PolarHBondContact O-N 2.99Å; N198-S202 PolarHBondContact O-OG 2.75Å; N198-S202 VanDerWaalsContact O-OG 3.06Å; N198-I209 HydrophobicContact CB-CG2 4.33Å; N198-T210 PolarHBondContact ND2-O 2.9Å; N198-M213 PolarHBondContact OD1-O 3.17Å; N198-R263 PolarHBondContact OD1-NH2 2.82Å
199	S	98.1	Very high	96.2	Very high	73 Å²	73	49.1 Å²	49.1	51%	0.51	27%	0.271	S	S	.	.	H	α-helix	trans	-60.9	-48.8	175.5	-179.3	0	0	0	0	112.1	T197 C201 S202 R203	T197-S199 PolarHBondContact O-N 2.81Å; S199-C201 VanDerWaalsContact C-N 3.31Å; S199-C201 PolarHBondContact O-N 3Å; S199-S202 PolarHBondContact O-N 2.86Å; S199-R203 WeakPolarHBondContact O-CG 3.35Å; S199-R203 PolarHBondContact O-N 2.87Å; S199-R203 VanDerWaalsContact O-N 3.13Å
200	D	97.4	Very high	96.3	Very high	57 Å²	57	48.9 Å²	48.9	31%	0.305	27%	0.272	S	S	.	.	H	α-helix	trans	-63.7	-41	178.8	-58.4	-41.1	0	0	0	111	L196 T197 R203	L196-D200 HydrophobicContact CB-CB 4.38Å; L196-D200 HydrophobicContact CD2-CB 4.24Å; T197-D200 PolarHBondContact O-N 2.84Å; T197-D200 PolarHBondContact OG1-N 3.18Å; T197-D200 VanDerWaalsContact OG1-N 3.08Å; T197-D200 PolarHBondContact OG1-OD2 3.29Å; D200-R203 WeakPolarHBondContact O-CB 3.44Å; D200-R203 PolarHBondContact O-N 3.49Å; D200-R203 IonicContact OD1-CZ 2.83Å; D200-R203 VanDerWaalsContact OD1-CZ 3.31Å; D200-R203 IonicContact OD1-NH1 3.95Å; D200-R203 PolarHBondContact OD1-NH1 2.8Å; D200-R203 IonicContact OD1-NH2 2.97Å; D200-R203 PolarHBondContact OD1-NH2 2.97Å
201	C	97.6	Very high	96.5	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-64.6	-41.5	177.1	-165.6	0	0	0	0	112.4	L196 T197 N198 S199 R203 Y204 W205 I209 C215	L196-C201 HydrophobicContact CB-CB 4.41Å; L196-C201 HydrophobicContact CD2-CB 4.48Å; T197-C201 PolarHBondContact O-N 2.85Å; N198-C201 PolarHBondContact O-N 2.96Å; S199-C201 VanDerWaalsContact C-N 3.31Å; S199-C201 PolarHBondContact O-N 3Å; C201-R203 PolarHBondContact O-N 2.8Å; C201-Y204 PolarHBondContact O-N 3.41Å; C201-W205 PolarHBondContact O-N 3.46Å; C201-W205 VanDerWaalsContact SG-CD1 3.58Å; C201-I209 HydrophobicContact CB-CG1 4.33Å; C201-C215 HydrophobicContact CB-CB 3.53Å; C201-C215 WeakPolarHBondContact CB-SG 3.33Å; C201-C215 WeakPolarHBondContact SG-CB 3.4Å; C201-C215 CovalentContact SG-SG 2.01Å; C201-C215 PolarHBondContact SG-SG 2.98Å
202	S	97.9	Very high	96.8	Very high	43 Å²	43	56 Å²	56	30%	0.301	31%	0.308	S	S	.	.	H	α-helix	trans	-65.1	-21.9	174.9	-71.2	0	0	0	0	113.4	N198 S199 Y204 G206	N198-S202 VanDerWaalsContact O-CB 3.31Å; N198-S202 WeakPolarHBondContact O-CB 3.29Å; N198-S202 PolarHBondContact O-N 2.99Å; N198-S202 PolarHBondContact O-OG 2.75Å; N198-S202 VanDerWaalsContact O-OG 3.06Å; S199-S202 PolarHBondContact O-N 2.86Å; S202-Y204 PolarHBondContact O-N 3.39Å; S202-G206 WeakPolarHBondContact O-CA 3.27Å; S202-G206 PolarHBondContact O-N 2.74Å; S202-G206 PolarHBondContact OG-O 2.75Å
203	R	97.2	Very high	97.2	Very high	185 Å²	185	55.2 Å²	55.2	70%	0.698	30%	0.301	S	S	*	.	H	α-helix	trans	-64.7	-27.1	170.3	-63.8	-168.5	-164.4	108.6	14.6	112.3	S199 D200 C201	S199-R203 WeakPolarHBondContact O-CG 3.35Å; S199-R203 PolarHBondContact O-N 2.87Å; S199-R203 VanDerWaalsContact O-N 3.13Å; D200-R203 WeakPolarHBondContact O-CB 3.44Å; D200-R203 PolarHBondContact O-N 3.49Å; D200-R203 IonicContact OD1-CZ 2.83Å; D200-R203 VanDerWaalsContact OD1-CZ 3.31Å; D200-R203 IonicContact OD1-NH1 3.95Å; D200-R203 PolarHBondContact OD1-NH1 2.8Å; D200-R203 IonicContact OD1-NH2 2.97Å; D200-R203 PolarHBondContact OD1-NH2 2.97Å; C201-R203 PolarHBondContact O-N 2.8Å
204	Y	96.5	Very high	97.6	Very high	118 Å²	118	55.1 Å²	55.1	46%	0.463	30%	0.301	S	S	.	.	H	α-helix	trans	-93.9	-50.7	177.3	-169.6	-86.8	0	0	0	112	C201 S202 S257 P258	C201-Y204 PolarHBondContact O-N 3.41Å; S202-Y204 PolarHBondContact O-N 3.39Å; Y204-S257 VanDerWaalsContact CZ-OG 3.27Å; Y204-S257 PolarHBondContact OH-OG 2.82Å; Y204-P258 HydrophobicContact CG-CG 4.44Å
205	W	97.3	Very high	97.8	Very high	48 Å²	48	53.2 Å²	53.2	18%	0.182	29%	0.289	C	S	.	.	H	α-helix	trans	-96.4	-2	-172.9	-68.4	121.4	0	0	0	114.6	C201 N208 I209 W248 P258	C201-W205 PolarHBondContact O-N 3.46Å; C201-W205 VanDerWaalsContact SG-CD1 3.58Å; W205-N208 WeakPolarHBondContact O-CB 3.43Å; W205-N208 PolarHBondContact O-N 3.07Å; W205-N208 PolarHBondContact O-ND2 3.48Å; W205-I209 HydrophobicContact CB-CD1 3.65Å; W205-I209 HydrophobicContact CB-CG1 3.58Å; W205-I209 HydrophobicContact CG-CD1 4Å; W205-I209 HydrophobicContact CG-CG1 4.37Å; W205-W248 HydrophobicContact CB-CH2 4.21Å; W205-W248 AromaticContact CD2-CH2 3.96Å; W205-W248 HydrophobicContact CD2-CH2 3.96Å; W205-W248 AromaticContact CD2-CZ3 3.68Å; W205-W248 HydrophobicContact CD2-CZ3 3.68Å; W205-W248 AromaticContact CE2-CZ3 3.92Å; W205-W248 HydrophobicContact CE3-CH2 4.27Å; W205-W248 AromaticContact CE3-CZ3 3.79Å; W205-W248 HydrophobicContact CE3-CZ3 3.79Å; W205-W248 AromaticContact CG-CH2 3.96Å; W205-W248 HydrophobicContact CG-CH2 3.96Å; W205-W248 HydrophobicContact CG-CZ3 4.16Å; W205-W248 HydrophobicContact CH2-CZ3 4.33Å; W205-W248 HydrophobicContact CZ2-CZ3 4.24Å; W205-W248 HydrophobicContact CZ3-CZ3 4.12Å; W205-P258 PolarHBondContact NE1-O 3.4Å
206	G	97.5	Very high	97.7	Very high	36 Å²	36	53.1 Å²	53.1	37%	0.371	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	63.2	-139.9	178.5	0	0	0	0	0	113.3	S202 N208	S202-G206 WeakPolarHBondContact O-CA 3.27Å; S202-G206 PolarHBondContact O-N 2.74Å; S202-G206 PolarHBondContact OG-O 2.75Å; G206-N208 PolarHBondContact O-N 3.3Å
207	S	96.1	Very high	97.4	Very high	116 Å²	116	51.9 Å²	51.9	81%	0.811	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-72.8	-1	-179.2	56.3	0	0	0	0	114.4	I209	S207-I209 VanDerWaalsContact C-N 3.25Å; S207-I209 PolarHBondContact O-N 2.88Å
208	N	97	Very high	96.8	Very high	99 Å²	99	50.6 Å²	50.6	53%	0.529	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-75	-18	177.5	-64.2	-24.5	0	0	0	112.4	W205 G206 W248	W205-N208 WeakPolarHBondContact O-CB 3.43Å; W205-N208 PolarHBondContact O-N 3.07Å; W205-N208 PolarHBondContact O-ND2 3.48Å; G206-N208 PolarHBondContact O-N 3.3Å; N208-W248 HydrophobicContact CB-CH2 4.09Å; N208-W248 HydrophobicContact CB-CZ2 4.41Å
209	I	98.4	Very high	96.1	Very high	16 Å²	16	51.8 Å²	51.8	8%	0.082	30%	0.295	C	S	.	.			trans	-85.2	128.9	177.3	-55.9	-55.5	0	0	0	109.9	N198 C201 W205 S207 M213 W248 V260	N198-I209 HydrophobicContact CB-CG2 4.33Å; C201-I209 HydrophobicContact CB-CG1 4.33Å; W205-I209 HydrophobicContact CB-CD1 3.65Å; W205-I209 HydrophobicContact CB-CG1 3.58Å; W205-I209 HydrophobicContact CG-CD1 4Å; W205-I209 HydrophobicContact CG-CG1 4.37Å; S207-I209 VanDerWaalsContact C-N 3.25Å; S207-I209 PolarHBondContact O-N 2.88Å; I209-M213 HydrophobicContact CD1-SD 4.49Å; I209-W248 HydrophobicContact CD1-CH2 3.96Å; I209-W248 HydrophobicContact CD1-CZ2 3.9Å; I209-V260 HydrophobicContact CD1-CG1 4.23Å; I209-V260 HydrophobicContact CD1-CG2 3.87Å
210	T	98.3	Very high	95.1	Very high	34 Å²	34	49 Å²	49	21%	0.209	28%	0.278	C	S	.	.			trans	-119	173.6	178.3	82.7	0	0	0	0	111.1	N133 N198 L212 M213	N133-T210 WeakPolarHBondContact OD1-CB 3.5Å; N133-T210 VanDerWaalsContact OD1-CG2 3.27Å; N133-T210 WeakPolarHBondContact OD1-CG2 3.34Å; N133-T210 PolarHBondContact OD1-OG1 2.94Å; N198-T210 PolarHBondContact ND2-O 2.9Å; T210-L212 PolarHBondContact O-N 2.82Å; T210-L212 PolarHBondContact OG1-N 3.11Å; T210-M213 PolarHBondContact O-N 3.45Å
211	N	97.8	Very high	94.2	Very high	123 Å²	123	46.6 Å²	46.6	66%	0.658	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-24.3	175.9	-67.6	-15.6	0	0	0	112.8	M213 R263	N211-M213 PolarHBondContact O-N 2.71Å; N211-R263 WeakPolarHBondContact O-CD 3.16Å; N211-R263 PolarHBondContact O-NE 3.06Å; N211-R263 VanDerWaalsContact O-NE 3.12Å
212	L	98.5	Very high	93.3	Very high	40 Å²	40	47.9 Å²	47.9	21%	0.209	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	0.5	178	-60.8	170.2	0	0	0	113.2	N133 N134 T210 R263 E266 L267	N133-L212 HydrophobicContact CB-CD1 4.1Å; N134-L212 VanDerWaalsContact OD1-CD1 3.27Å; N134-L212 WeakPolarHBondContact OD1-CD1 3.38Å; T210-L212 PolarHBondContact O-N 2.82Å; T210-L212 PolarHBondContact OG1-N 3.11Å; L212-R263 WeakPolarHBondContact O-CB 3.43Å; L212-R263 PolarHBondContact O-N 3.32Å; L212-E266 HydrophobicContact CD2-CB 3.84Å; L212-L267 HydrophobicContact CD2-CD2 4.31Å
213	M	98.8	Very high	92.5	Very high	2 Å²	2	46.6 Å²	46.6	1%	0.01	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	147.1	-179.9	-61.5	178.3	179.6	0	0	110.5	T131 N133 N198 I209 T210 N211 W248 V260 Y261 R263	T131-M213 WeakPolarHBondContact O-CE 3.34Å; N133-M213 WeakPolarHBondContact OD1-CE 3.34Å; N198-M213 PolarHBondContact OD1-O 3.17Å; I209-M213 HydrophobicContact CD1-SD 4.49Å; T210-M213 PolarHBondContact O-N 3.45Å; N211-M213 PolarHBondContact O-N 2.71Å; M213-W248 HydrophobicContact CE-CZ2 4.37Å; M213-W248 HydrophobicContact SD-CZ2 3.94Å; M213-V260 HydrophobicContact CB-CG1 3.81Å; M213-V260 HydrophobicContact CG-CG1 4.02Å; M213-V260 HydrophobicContact SD-CG1 3.71Å; M213-Y261 CarbonylContact C-O 3.59Å; M213-Y261 WeakPolarHBondContact CA-O 3.26Å; M213-R263 VanDerWaalsContact O-CZ 3.25Å; M213-R263 PolarHBondContact O-NE 3.38Å; M213-R263 PolarHBondContact O-NH2 3.37Å
214	I	98.7	Very high	91.9	Very high	3 Å²	3	38.2 Å²	38.2	2%	0.015	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	144.2	168.8	-168.6	170.8	0	0	0	108.8	L195 V243 Y261 R263	L195-I214 HydrophobicContact CD1-CD1 4.12Å; L195-I214 HydrophobicContact CD2-CD1 4.1Å; I214-V243 HydrophobicContact CD1-CG1 3.72Å; I214-Y261 PolarHBondContact N-O 2.89Å; I214-Y261 WeakPolarHBondContact O-CB 2.91Å; I214-Y261 WeakPolarHBondContact O-CD2 3.48Å; I214-Y261 PolarHBondContact O-N 3.31Å; I214-R263 HydrophobicContact CB-CB 4.18Å; I214-R263 HydrophobicContact CB-CG 4.23Å; I214-R263 HydrophobicContact CG2-CB 4.3Å
215	C	98.3	Very high	90.9	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	149.4	-179.3	-52.9	0	0	0	0	111.4	L196 C201 P258 G259	L196-C215 HydrophobicContact CB-CB 4.13Å; L196-C215 PolarHBondContact N-O 3.17Å; C201-C215 HydrophobicContact CB-CB 3.53Å; C201-C215 WeakPolarHBondContact CB-SG 3.33Å; C201-C215 WeakPolarHBondContact SG-CB 3.4Å; C201-C215 CovalentContact SG-SG 2.01Å; C201-C215 PolarHBondContact SG-SG 2.98Å; C215-P258 HydrophobicContact CB-CB 4.23Å; C215-G259 WeakPolarHBondContact CA-O 3.14Å
216	A	96	Very high	90.2	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.008	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	154.7	174.3	0	0	0	0	0	110.4	L193 P194 L195 L232 G259 Y261	L193-A216 HydrophobicContact CD1-CB 3.35Å; L193-A216 HydrophobicContact CG-CB 3.84Å; P194-A216 CarbonylContact O-C 3.59Å; P194-A216 WeakPolarHBondContact O-CA 3.47Å; P194-A216 WeakPolarHBondContact O-CB 3.48Å; L195-A216 HydrophobicContact CD2-CB 3.92Å; A216-L232 HydrophobicContact CB-CD1 4.24Å; A216-L232 HydrophobicContact CB-CD2 3.89Å; A216-G259 PolarHBondContact N-O 2.87Å; A216-G259 PolarHBondContact O-N 3.29Å; A216-Y261 HydrophobicContact CB-CD2 4.39Å; A216-Y261 HydrophobicContact CB-CE2 3.78Å
217	G	92.4	Very high	89.9	Confident	5 Å²	5	34.5 Å²	34.5	5%	0.052	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	96.9	-140.7	177.9	0	0	0	0	0	113.2	P194 L196 A219	P194-G217 PolarHBondContact O-N 3.38Å; L196-G217 WeakPolarHBondContact CD1-O 3.25Å; G217-A219 PolarHBondContact O-N 3.27Å
218	G	84.9	Confident	89.9	Confident	30 Å²	30	30.2 Å²	30.2	31%	0.309	19%	0.191	S	C	.	.			trans	65.1	18.7	-168.5	0	0	0	0	0	113.8	T255 S257	G218-T255 CarbonylContact C-O 3.45Å; G218-S257 PolarHBondContact N-O 3.19Å
219	A	83.1	Confident	90	Very high	58 Å²	58	25.5 Å²	25.5	48%	0.479	17%	0.166	S	C	.	.	S	Bend	trans	-136.8	34.7	-170	0	0	0	0	0	112.5	P194 G217 T255	P194-A219 HydrophobicContact CG-CB 3.91Å; G217-A219 PolarHBondContact O-N 3.27Å; A219-T255 PolarHBondContact N-O 3.34Å
220	G	76.8	Confident	90	Very high	15 Å²	15	24.8 Å²	24.8	16%	0.155	16%	0.162	C	C	.	.	S	Bend	trans	106.8	-13.7	176.9	0	0	0	0	0	114.4	V50 T255	V50-G220 WeakPolarHBondContact CA-O 3.46Å; G220-T255 VanDerWaalsContact C-CB 3.49Å; G220-T255 PolarHBondContact N-O 3.5Å; G220-T255 VanDerWaalsContact O-CB 3.28Å; G220-T255 WeakPolarHBondContact O-CB 3.31Å; G220-T255 VanDerWaalsContact O-CG2 3.31Å; G220-T255 WeakPolarHBondContact O-CG2 3.43Å
221	A	78.9	Confident	90	Very high	7 Å²	7	23.1 Å²	23.1	6%	0.058	15%	0.152	C	C	.	.			trans	-128.2	152.1	173.9	0	0	0	0	0	111.6	A191	A191-A221 HydrophobicContact CB-CB 3.88Å
222	S	79.1	Confident	90.1	Very high	27 Å²	27	17.3 Å²	17.3	19%	0.189	12%	0.121	C	C	.	.			trans	-143.4	142.1	176.6	-175.7	0	0	0	0	109.3	C253	S222-C253 WeakPolarHBondContact CB-O 3.35Å
223	S	80.6	Confident	90.1	Very high	16 Å²	16	15.4 Å²	15.4	11%	0.112	11%	0.111	C	C	.	.			trans	-67.8	156.4	157.7	-44.7	0	0	0	0	109.5	Y261	S223-Y261 PolarHBondContact OG-OH 2.63Å
224	C	84.6	Confident	90.1	Very high	9 Å²	9	15.3 Å²	15.3	6%	0.061	11%	0.111	C	C	.	.			trans	-144.1	-174.8	-176.3	-161.7	0	0	0	0	111.8	L176 G226 D227 C253	L176-C224 HydrophobicContact CB-CB 4.26Å; L176-C224 WeakPolarHBondContact O-CB 3.27Å; C224-G226 PolarHBondContact O-N 2.99Å; C224-D227 PolarHBondContact N-OD2 2.67Å; C224-D227 WeakPolarHBondContact O-CB 3.18Å; C224-D227 PolarHBondContact O-N 2.97Å; C224-C253 WeakPolarHBondContact CA-SG 3.11Å; C224-C253 HydrophobicContact CB-CB 3.66Å; C224-C253 WeakPolarHBondContact CB-SG 3.02Å; C224-C253 WeakPolarHBondContact SG-CB 3.01Å; C224-C253 CovalentContact SG-SG 2Å; C224-C253 PolarHBondContact SG-SG 2.79Å
225	M	76.6	Confident	90	Very high	90 Å²	90	20.4 Å²	20.4	44%	0.443	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	126	-178.6	-66.9	76.7	-104.8	0	0	110.1	G175 L176 C253	G175-M225 CarbonylContact C-O 3.45Å; G175-M225 WeakPolarHBondContact CA-O 3.48Å; L176-M225 HydrophobicContact CD1-CB 3.99Å; L176-M225 HydrophobicContact CD1-SD 4.42Å; L176-M225 HydrophobicContact CG-CB 4.34Å; L176-M225 PolarHBondContact N-O 2.89Å; M225-C253 WeakPolarHBondContact CE-SG 3.43Å; M225-C253 PolarHBondContact SD-SG 3Å
226	G	81.1	Confident	89.8	Confident	15 Å²	15	23.9 Å²	23.9	16%	0.155	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	101.7	-17.3	-174.1	0	0	0	0	0	114.2	H73 C224 S228	H73-G226 PolarHBondContact NE2-O 3.15Å; C224-G226 PolarHBondContact O-N 2.99Å; G226-S228 VanDerWaalsContact C-N 3.34Å
227	D	92.4	Very high	89.7	Confident	18 Å²	18	31.5 Å²	31.5	10%	0.096	19%	0.19	C	C	.	.			trans	-81.8	-15.2	174.8	-65.8	-45.2	0	0	0	113.2	G173 G175 C224 G229 G230 V246	G173-D227 WeakPolarHBondContact CA-OD1 3.4Å; G175-D227 VanDerWaalsContact CA-OD1 3.26Å; G175-D227 WeakPolarHBondContact CA-OD1 3.35Å; G175-D227 PolarHBondContact N-OD1 2.8Å; C224-D227 PolarHBondContact N-OD2 2.67Å; C224-D227 WeakPolarHBondContact O-CB 3.18Å; C224-D227 PolarHBondContact O-N 2.97Å; D227-G229 PolarHBondContact O-N 3.08Å; D227-G230 WeakPolarHBondContact O-CA 3.01Å; D227-G230 PolarHBondContact O-N 2.85Å; D227-V246 HydrophobicContact CB-CG1 4.05Å; D227-V246 HydrophobicContact CB-CG2 4.36Å; D227-V246 VanDerWaalsContact O-CB 3.25Å; D227-V246 WeakPolarHBondContact O-CB 3.35Å; D227-V246 WeakPolarHBondContact O-CG2 3.31Å
228	S	96.7	Very high	89.8	Confident	26 Å²	26	34.3 Å²	34.3	18%	0.182	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-44.4	131.7	179.6	-77.6	0	0	0	0	113	C75 G76 H90 G226 G230	C75-S228 CarbonylContact C-O 3.6Å; C75-S228 WeakPolarHBondContact CA-O 3.5Å; C75-S228 VanDerWaalsContact CB-O 3.29Å; C75-S228 WeakPolarHBondContact CB-O 3.39Å; C75-S228 VanDerWaalsContact SG-CB 3.59Å; C75-S228 PolarHBondContact SG-O 3.25Å; G76-S228 PolarHBondContact N-O 3.08Å; H90-S228 PolarHBondContact CE1-OG 3.18Å; H90-S228 WeakPolarHBondContact NE2-CB 3.45Å; H90-S228 PolarHBondContact NE2-OG 2.98Å; G226-S228 VanDerWaalsContact C-N 3.34Å; S228-G230 PolarHBondContact O-N 2.01Å
229	G	98.6	Very high	90.4	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.01	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	79	-11.3	-175.3	0	0	0	0	0	115.2	G76 G77 T87 D227 V246	G76-G229 CarbonylContact C-O 3.52Å; G76-G229 CarbonylContact O-C 3.53Å; G77-G229 VanDerWaalsContact CA-O 3.31Å; G77-G229 WeakPolarHBondContact CA-O 3.44Å; T87-G229 WeakPolarHBondContact OG1-CA 3.38Å; D227-G229 PolarHBondContact O-N 3.08Å; G229-V246 PolarHBondContact N-O 3.04Å
230	G	98.4	Very high	91.2	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	19%	0.19	C	C	.	.			trans	-67.4	165.6	175.3	0	0	0	0	0	113.7	D227 S228 I245 V246	D227-G230 WeakPolarHBondContact O-CA 3.01Å; D227-G230 PolarHBondContact O-N 2.85Å; S228-G230 PolarHBondContact O-N 2.01Å; G230-I245 WeakPolarHBondContact O-CA 3.3Å; G230-V246 WeakPolarHBondContact O-CG2 3.33Å; G230-V246 PolarHBondContact O-N 2.94Å
231	P	98.7	Very high	92.2	Very high	0 Å²	0	31 Å²	31	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	144.4	-175.3	27.4	-32.2	0	0	0	113.8	S78 T171 S172 V233 L242	S78-P231 WeakPolarHBondContact OG-CB 3.32Å; T171-P231 VanDerWaalsContact CA-O 3.27Å; T171-P231 WeakPolarHBondContact CA-O 3.27Å; T171-P231 PolarHBondContact OG1-O 2.89Å; T171-P231 VanDerWaalsContact OG1-O 3.05Å; S172-P231 WeakPolarHBondContact OG-CG 3.35Å; P231-V233 HydrophobicContact CB-CG1 4.03Å; P231-L242 HydrophobicContact CB-CD1 3.57Å
232	L	98.6	Very high	93.2	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	110.8	150	176.2	68.7	0	0	0	108.3	C169 V170 L193 L195 A216 V243 G244 Y261	C169-L232 HydrophobicContact CB-CD1 3.83Å; C169-L232 HydrophobicContact CB-CG 4.39Å; V170-L232 WeakPolarHBondContact O-CA 3.49Å; L193-L232 HydrophobicContact CD1-CD1 4.15Å; L193-L232 HydrophobicContact CD2-CD1 3.92Å; L193-L232 HydrophobicContact CG-CD1 4.1Å; L195-L232 HydrophobicContact CD2-CD2 3.81Å; A216-L232 HydrophobicContact CB-CD1 4.24Å; A216-L232 HydrophobicContact CB-CD2 3.89Å; L232-V243 PolarHBondContact O-N 2.9Å; L232-G244 PolarHBondContact N-O 3.2Å; L232-G244 PolarHBondContact O-N 3.26Å; L232-G244 VanDerWaalsContact O-N 3.1Å; L232-Y261 HydrophobicContact CB-CD1 3.57Å; L232-Y261 HydrophobicContact CB-CE1 3.64Å; L232-Y261 HydrophobicContact CB-CG 4.33Å; L232-Y261 HydrophobicContact CD1-CE1 4.3Å; L232-Y261 HydrophobicContact CD2-CD1 3.88Å; L232-Y261 HydrophobicContact CD2-CD2 3.92Å; L232-Y261 HydrophobicContact CD2-CE1 4.05Å; L232-Y261 HydrophobicContact CD2-CE2 4.13Å; L232-Y261 HydrophobicContact CD2-CG 3.83Å; L232-Y261 HydrophobicContact CG-CD1 4.29Å; L232-Y261 HydrophobicContact CG-CE1 4.21Å
233	V	98.7	Very high	94.1	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.006	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	141.5	-175.6	-69.5	0	0	0	0	112.3	W60 W62 V154 C169 V170 P231 W240 T241 L242	W60-V233 HydrophobicContact CE3-CG2 4.37Å; W60-V233 HydrophobicContact CH2-CG2 4.35Å; W60-V233 HydrophobicContact CZ3-CG2 3.77Å; W62-V233 HydrophobicContact CZ2-CG1 4.49Å; V154-V233 HydrophobicContact CG2-CG1 3.63Å; C169-V233 CarbonylContact C-O 3.56Å; C169-V233 VanDerWaalsContact CA-O 3.3Å; C169-V233 WeakPolarHBondContact CA-O 3.03Å; C169-V233 WeakPolarHBondContact CB-O 3.45Å; V170-V233 HydrophobicContact CB-CG2 4.26Å; V170-V233 PolarHBondContact N-O 3.19Å; V170-V233 WeakPolarHBondContact O-CG2 3.22Å; V170-V233 PolarHBondContact O-N 3.19Å; P231-V233 HydrophobicContact CB-CG1 4.03Å; V233-W240 HydrophobicContact CB-CB 4.42Å; V233-W240 HydrophobicContact CB-CE3 3.94Å; V233-W240 HydrophobicContact CG2-CD2 4.32Å; V233-W240 HydrophobicContact CG2-CE3 3.58Å; V233-W240 HydrophobicContact CG2-CZ3 4.12Å; V233-T241 CarbonylContact C-O 3.55Å; V233-T241 VanDerWaalsContact CA-O 3.23Å; V233-T241 WeakPolarHBondContact CA-O 3.43Å; V233-L242 HydrophobicContact CG1-CB 4.49Å; V233-L242 HydrophobicContact CG1-CD1 4.06Å
234	C	98.2	Very high	95	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	145.5	174.9	-47.3	0	0	0	0	108.8	F163 M167 C169 T241 V243	F163-C234 HydrophobicContact CD1-CB 3.92Å; F163-C234 HydrophobicContact CE1-CB 4.01Å; M167-C234 HydrophobicContact SD-CB 4.23Å; C169-C234 HydrophobicContact CB-CB 4.07Å; C169-C234 WeakPolarHBondContact CB-SG 3.49Å; C169-C234 WeakPolarHBondContact SG-CB 3.41Å; C169-C234 CovalentContact SG-SG 2.03Å; C169-C234 PolarHBondContact SG-SG 3.31Å; C234-T241 PolarHBondContact N-O 3.39Å; C234-T241 PolarHBondContact O-N 3.21Å; C234-V243 HydrophobicContact CB-CG2 3.9Å; C234-V243 VanDerWaalsContact SG-CG2 3.55Å
235	E	96.3	Very high	95.7	Very high	110 Å²	110	28.4 Å²	28.4	51%	0.514	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	132.1	173.5	-71.2	-169.3	158.2	0	0	111	W240	E235-W240 HydrophobicContact CG-CD2 3.86Å; E235-W240 HydrophobicContact CG-CE3 3.85Å; E235-W240 HydrophobicContact CG-CH2 3.77Å; E235-W240 HydrophobicContact CG-CZ2 3.76Å; E235-W240 HydrophobicContact CG-CZ3 3.82Å; E235-W240 WeakPolarHBondContact OE1-CZ2 3.08Å
236	K	95.8	Very high	96.7	Very high	72 Å²	72	24.5 Å²	24.5	31%	0.313	15%	0.147	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	118.8	173.2	-176.6	-167.7	179.3	-165	0	108.3	D161 F163 G238 A239	D161-K236 WeakPolarHBondContact OD1-CE 3.4Å; D161-K236 IonicContact OD1-NZ 2.63Å; D161-K236 PolarHBondContact OD1-NZ 2.64Å; D161-K236 IonicContact OD2-NZ 2.68Å; D161-K236 PolarHBondContact OD2-NZ 3.27Å; F163-K236 HydrophobicContact CE1-CB 4.37Å; F163-K236 HydrophobicContact CZ-CD 4.26Å; K236-G238 PolarHBondContact O-N 3.32Å; K236-A239 PolarHBondContact N-O 3.04Å; K236-A239 PolarHBondContact O-N 3.32Å
237	N	94.1	Very high	97.5	Very high	161 Å²	161	24 Å²	24	86%	0.861	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.1	38.3	179.2	-56.7	-27.8	0	0	0	113.7
238	G	94.1	Very high	97.7	Very high	64 Å²	64	25.7 Å²	25.7	66%	0.66	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.5	7.8	-180	0	0	0	0	0	115.6	K236	K236-G238 PolarHBondContact O-N 3.32Å
239	A	97.6	Very high	97.6	Very high	17 Å²	17	25.9 Å²	25.9	14%	0.14	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	139.1	175.4	0	0	0	0	0	112	T36 K236 T241	T36-A239 HydrophobicContact CG2-CB 4.33Å; K236-A239 PolarHBondContact N-O 3.04Å; K236-A239 PolarHBondContact O-N 3.32Å; A239-T241 PolarHBondContact O-N 2.85Å; A239-T241 PolarHBondContact O-OG1 3.43Å
240	W	98.6	Very high	97.2	Very high	12 Å²	12	26.4 Å²	26.4	5%	0.045	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	120.4	171.4	-67.8	98.6	0	0	0	110.6	G35 P41 I43 W60 W62 V154 C155 V170 V233 E235	G35-W240 WeakPolarHBondContact CA-O 3.45Å; G35-W240 PolarHBondContact O-N 2.82Å; P41-W240 HydrophobicContact CG-CZ2 4.16Å; I43-W240 HydrophobicContact CD1-CH2 3.69Å; I43-W240 HydrophobicContact CD1-CZ2 3.84Å; W60-W240 HydrophobicContact CH2-CD2 4.06Å; W60-W240 AromaticContact CH2-CE2 3.82Å; W60-W240 HydrophobicContact CH2-CE3 4.17Å; W60-W240 AromaticContact CH2-CH2 3.84Å; W60-W240 HydrophobicContact CH2-CH2 3.84Å; W60-W240 AromaticContact CH2-CZ2 3.72Å; W60-W240 HydrophobicContact CH2-CZ2 3.72Å; W60-W240 HydrophobicContact CH2-CZ3 4.06Å; W60-W240 AromaticContact CZ3-CD2 3.72Å; W60-W240 HydrophobicContact CZ3-CD2 3.72Å; W60-W240 AromaticContact CZ3-CE2 3.81Å; W60-W240 HydrophobicContact CZ3-CE3 4.02Å; W60-W240 HydrophobicContact CZ3-CG 4.11Å; W60-W240 HydrophobicContact CZ3-CH2 4.47Å; W60-W240 HydrophobicContact CZ3-CZ2 4.21Å; W60-W240 HydrophobicContact CZ3-CZ3 4.38Å; W62-W240 HydrophobicContact CH2-CB 3.37Å; W62-W240 AromaticContact CH2-CD1 3.67Å; W62-W240 AromaticContact CH2-CG 3.65Å; W62-W240 HydrophobicContact CH2-CG 3.65Å; W62-W240 HydrophobicContact CZ2-CB 3.5Å; W62-W240 VanDerWaalsContact CZ2-CB 3.5Å; W62-W240 AromaticContact CZ2-CG 3.85Å; W62-W240 HydrophobicContact CZ2-CG 3.85Å; W62-W240 HydrophobicContact CZ3-CB 4.38Å; V154-W240 WeakPolarHBondContact CG2-O 3.39Å; C155-W240 WeakPolarHBondContact CB-O 3.3Å; C155-W240 PolarHBondContact N-O 2.8Å; V170-W240 HydrophobicContact CB-CZ3 4.21Å; V170-W240 HydrophobicContact CG2-CH2 3.73Å; V170-W240 HydrophobicContact CG2-CZ3 3.79Å; V233-W240 HydrophobicContact CB-CB 4.42Å; V233-W240 HydrophobicContact CB-CE3 3.94Å; V233-W240 HydrophobicContact CG2-CD2 4.32Å; V233-W240 HydrophobicContact CG2-CE3 3.58Å; V233-W240 HydrophobicContact CG2-CZ3 4.12Å; E235-W240 HydrophobicContact CG-CD2 3.86Å; E235-W240 HydrophobicContact CG-CE3 3.85Å; E235-W240 HydrophobicContact CG-CH2 3.77Å; E235-W240 HydrophobicContact CG-CZ2 3.76Å; E235-W240 HydrophobicContact CG-CZ3 3.82Å; E235-W240 WeakPolarHBondContact OE1-CZ2 3.08Å
241	T	98.9	Very high	96.6	Very high	6 Å²	6	31.7 Å²	31.7	4%	0.037	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	130.2	-176.7	-57.9	0	0	0	0	109.4	C155 A157 F163 V233 C234 A239 V243	C155-T241 HydrophobicContact CB-CG2 4.32Å; C155-T241 CarbonylContact O-C 3.58Å; C155-T241 WeakPolarHBondContact O-CA 3.42Å; A157-T241 HydrophobicContact CB-CG2 3.95Å; A157-T241 VanDerWaalsContact N-CG2 3.26Å; F163-T241 HydrophobicContact CZ-CG2 4.16Å; V233-T241 CarbonylContact C-O 3.55Å; V233-T241 VanDerWaalsContact CA-O 3.23Å; V233-T241 WeakPolarHBondContact CA-O 3.43Å; C234-T241 PolarHBondContact N-O 3.39Å; C234-T241 PolarHBondContact O-N 3.21Å; A239-T241 PolarHBondContact O-N 2.85Å; A239-T241 PolarHBondContact O-OG1 3.43Å; T241-V243 PolarHBondContact O-N 2.87Å
242	L	98.9	Very high	96.1	Very high	0 Å²	0	35 Å²	35	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	113.5	176	-169.5	72.9	0	0	0	109.7	V86 V154 C155 L156 A157 P231 V233 G244 I245 V264	V86-L242 HydrophobicContact CG1-CD2 3.49Å; V86-L242 VanDerWaalsContact CG1-CD2 3.49Å; V154-L242 HydrophobicContact CG1-CB 3.83Å; V154-L242 HydrophobicContact CG1-CD2 4.31Å; V154-L242 HydrophobicContact CG1-CG 4.49Å; V154-L242 HydrophobicContact CG2-CB 4.04Å; C155-L242 WeakPolarHBondContact O-CB 3.22Å; C155-L242 PolarHBondContact O-N 3.09Å; L156-L242 HydrophobicContact CD2-CB 4.25Å; L156-L242 HydrophobicContact CD2-CD2 3.91Å; A157-L242 VanDerWaalsContact CB-O 3.28Å; A157-L242 WeakPolarHBondContact CB-O 3.48Å; A157-L242 PolarHBondContact N-O 3.11Å; P231-L242 HydrophobicContact CB-CD1 3.57Å; V233-L242 HydrophobicContact CG1-CB 4.49Å; V233-L242 HydrophobicContact CG1-CD1 4.06Å; L242-G244 VanDerWaalsContact CD1-O 3.32Å; L242-G244 WeakPolarHBondContact CD1-O 3.33Å; L242-I245 HydrophobicContact CD2-CG1 4.24Å; L242-V264 HydrophobicContact CD2-CG2 4.22Å; L242-V264 HydrophobicContact CG-CG2 4.1Å; L242-V264 WeakPolarHBondContact O-CG1 3.28Å
243	V	98.8	Very high	95.4	Very high	2 Å²	2	35.6 Å²	35.6	1%	0.012	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	-31.3	-177.3	174.7	0	0	0	0	111.2	F163 I214 L232 C234 T241 V264	F163-V243 HydrophobicContact CB-CG1 4.15Å; F163-V243 HydrophobicContact CD1-CG2 3.63Å; F163-V243 HydrophobicContact CD2-CB 4.48Å; F163-V243 HydrophobicContact CD2-CG1 3.91Å; F163-V243 HydrophobicContact CD2-CG2 3.72Å; F163-V243 HydrophobicContact CE1-CG2 3.47Å; F163-V243 VanDerWaalsContact CE1-CG2 3.47Å; F163-V243 HydrophobicContact CE2-CG1 4.47Å; F163-V243 HydrophobicContact CE2-CG2 3.57Å; F163-V243 HydrophobicContact CG-CG1 3.95Å; F163-V243 HydrophobicContact CG-CG2 3.75Å; F163-V243 HydrophobicContact CZ-CG2 3.43Å; F163-V243 VanDerWaalsContact CZ-CG2 3.43Å; I214-V243 HydrophobicContact CD1-CG1 3.72Å; L232-V243 PolarHBondContact O-N 2.9Å; C234-V243 HydrophobicContact CB-CG2 3.9Å; C234-V243 VanDerWaalsContact SG-CG2 3.55Å; T241-V243 PolarHBondContact O-N 2.87Å; V243-V264 WeakPolarHBondContact O-CB 3.31Å; V243-V264 PolarHBondContact O-N 3.03Å
244	G	98.8	Very high	94.9	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	160.7	176.6	0	0	0	0	0	112.6	L232 L242 A262	L232-G244 PolarHBondContact N-O 3.2Å; L232-G244 PolarHBondContact O-N 3.26Å; L232-G244 VanDerWaalsContact O-N 3.1Å; L242-G244 VanDerWaalsContact CD1-O 3.32Å; L242-G244 WeakPolarHBondContact CD1-O 3.33Å; G244-A262 VanDerWaalsContact CA-O 3.27Å; G244-A262 WeakPolarHBondContact CA-O 3.35Å
245	I	98.9	Very high	94.4	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.005	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	126.3	171.2	-60.7	160.6	0	0	0	107	V86 A88 I136 G230 L242 S247 Y261 A262 V264	V86-I245 HydrophobicContact CG2-CD1 3.57Å; A88-I245 HydrophobicContact CB-CG2 4.23Å; I136-I245 HydrophobicContact CB-CD1 4.4Å; I136-I245 HydrophobicContact CD1-CD1 3.66Å; I136-I245 HydrophobicContact CG1-CD1 3.67Å; G230-I245 WeakPolarHBondContact O-CA 3.3Å; L242-I245 HydrophobicContact CD2-CG1 4.24Å; I245-S247 PolarHBondContact O-N 2.95Å; I245-Y261 CarbonylContact O-C 3.42Å; I245-Y261 WeakPolarHBondContact O-CA 3.31Å; I245-Y261 VanDerWaalsContact O-CB 3.3Å; I245-Y261 WeakPolarHBondContact O-CB 3.27Å; I245-A262 HydrophobicContact CB-CB 4.23Å; I245-A262 PolarHBondContact N-O 3.13Å; I245-A262 PolarHBondContact O-N 3.18Å; I245-V264 HydrophobicContact CD1-CG2 4.19Å; I245-V264 HydrophobicContact CG1-CG2 4.1Å
246	V	98.6	Very high	94.1	Very high	8 Å²	8	37.4 Å²	37.4	5%	0.048	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.4	123.3	-177.2	179.1	0	0	0	0	109.6	D227 G229 G230 Y261	D227-V246 HydrophobicContact CB-CG1 4.05Å; D227-V246 HydrophobicContact CB-CG2 4.36Å; D227-V246 VanDerWaalsContact O-CB 3.25Å; D227-V246 WeakPolarHBondContact O-CB 3.35Å; D227-V246 WeakPolarHBondContact O-CG2 3.31Å; G229-V246 PolarHBondContact N-O 3.04Å; G230-V246 WeakPolarHBondContact O-CG2 3.33Å; G230-V246 PolarHBondContact O-N 2.94Å; V246-Y261 HydrophobicContact CB-CD1 4.32Å; V246-Y261 HydrophobicContact CB-CE1 4.31Å; V246-Y261 HydrophobicContact CG2-CD1 3.96Å; V246-Y261 HydrophobicContact CG2-CE1 3.57Å
247	S	98.2	Very high	93.9	Very high	6 Å²	6	34 Å²	34	4%	0.042	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	-66.6	-172.5	-176.7	0	0	0	0	111.5	H90 I132 D135 I245 V260	H90-S247 PolarHBondContact CE1-O 3.06Å; I132-S247 WeakPolarHBondContact CG2-OG 3.1Å; D135-S247 VanDerWaalsContact OD2-CB 3.3Å; D135-S247 WeakPolarHBondContact OD2-CB 3.4Å; D135-S247 PolarHBondContact OD2-OG 2.55Å; I245-S247 PolarHBondContact O-N 2.95Å; S247-V260 WeakPolarHBondContact CB-O 3.48Å; S247-V260 PolarHBondContact N-O 3.39Å
248	W	96.4	Very high	94	Very high	52 Å²	52	26.7 Å²	26.7	20%	0.197	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	172.8	-179.8	61.7	-87.3	0	0	0	111.6	I132 W205 N208 I209 M213 V260	I132-W248 HydrophobicContact CD1-CB 4.03Å; I132-W248 HydrophobicContact CD1-CG 3.95Å; W205-W248 HydrophobicContact CB-CH2 4.21Å; W205-W248 AromaticContact CD2-CH2 3.96Å; W205-W248 HydrophobicContact CD2-CH2 3.96Å; W205-W248 AromaticContact CD2-CZ3 3.68Å; W205-W248 HydrophobicContact CD2-CZ3 3.68Å; W205-W248 AromaticContact CE2-CZ3 3.92Å; W205-W248 HydrophobicContact CE3-CH2 4.27Å; W205-W248 AromaticContact CE3-CZ3 3.79Å; W205-W248 HydrophobicContact CE3-CZ3 3.79Å; W205-W248 AromaticContact CG-CH2 3.96Å; W205-W248 HydrophobicContact CG-CH2 3.96Å; W205-W248 HydrophobicContact CG-CZ3 4.16Å; W205-W248 HydrophobicContact CH2-CZ3 4.33Å; W205-W248 HydrophobicContact CZ2-CZ3 4.24Å; W205-W248 HydrophobicContact CZ3-CZ3 4.12Å; N208-W248 HydrophobicContact CB-CH2 4.09Å; N208-W248 HydrophobicContact CB-CZ2 4.41Å; I209-W248 HydrophobicContact CD1-CH2 3.96Å; I209-W248 HydrophobicContact CD1-CZ2 3.9Å; M213-W248 HydrophobicContact CE-CZ2 4.37Å; M213-W248 HydrophobicContact SD-CZ2 3.94Å; W248-V260 HydrophobicContact CD2-CB 3.81Å; W248-V260 HydrophobicContact CD2-CG1 4.31Å; W248-V260 HydrophobicContact CD2-CG2 3.96Å; W248-V260 HydrophobicContact CE3-CB 4.35Å; W248-V260 HydrophobicContact CE3-CG2 4.02Å; W248-V260 HydrophobicContact CG-CB 4.14Å; W248-V260 HydrophobicContact CH2-CB 4.5Å; W248-V260 HydrophobicContact CH2-CG2 3.76Å; W248-V260 HydrophobicContact CZ2-CB 3.99Å; W248-V260 HydrophobicContact CZ2-CG1 3.83Å; W248-V260 HydrophobicContact CZ2-CG2 3.69Å; W248-V260 HydrophobicContact CZ3-CG2 3.91Å; W248-V260 PolarHBondContact N-O 2.6Å; W248-V260 WeakPolarHBondContact O-CA 3.32Å; W248-V260 WeakPolarHBondContact O-CB 3.3Å; W248-V260 PolarHBondContact O-N 3.19Å; W248-V260 VanDerWaalsContact O-O 3.06Å
249	G	93.6	Very high	94	Very high	30 Å²	30	23.9 Å²	23.9	31%	0.309	16%	0.158	S	C	.	.			trans	-177.8	-151.2	179.2	0	0	0	0	0	112.6	S251	G249-S251 PolarHBondContact O-N 3.01Å
250	S	90.5	Very high	94.1	Very high	13 Å²	13	23.1 Å²	23.1	9%	0.091	15%	0.152	C	C	.	.			trans	-58.9	131.3	176.2	177.6	0	0	0	0	111.5	T252 C253 S254	S250-T252 PolarHBondContact O-N 2.86Å; S250-T252 VanDerWaalsContact O-N 3.15Å; S250-T252 PolarHBondContact OG-N 2.86Å; S250-T252 PolarHBondContact OG-OG1 3.44Å; S250-C253 PolarHBondContact O-N 3.24Å; S250-C253 VanDerWaalsContact O-N 3.08Å; S250-C253 PolarHBondContact OG-N 2.72Å; S250-S254 WeakPolarHBondContact OG-CB 3.07Å; S250-S254 PolarHBondContact OG-N 2.75Å
251	S	86.8	Confident	94.1	Very high	110 Å²	110	22.6 Å²	22.6	77%	0.769	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-15.4	174.6	55.2	0	0	0	0	113.6	G249	G249-S251 PolarHBondContact O-N 3.01Å
252	T	87.3	Confident	94.1	Very high	70 Å²	70	22.5 Å²	22.5	43%	0.429	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.6	17.2	176.9	58.4	0	0	0	0	112.2	Y179 S250 S254	Y179-T252 WeakPolarHBondContact CB-O 3Å; S250-T252 PolarHBondContact O-N 2.86Å; S250-T252 VanDerWaalsContact O-N 3.15Å; S250-T252 PolarHBondContact OG-N 2.86Å; S250-T252 PolarHBondContact OG-OG1 3.44Å; T252-S254 PolarHBondContact O-N 3.25Å; T252-S254 VanDerWaalsContact O-N 3.08Å
253	C	85.2	Confident	94.1	Very high	13 Å²	13	24.3 Å²	24.3	9%	0.088	16%	0.156	C	C	.	.			trans	49.8	37.7	-179.7	-50.9	0	0	0	0	113.1	S222 C224 M225 S250 T255	S222-C253 WeakPolarHBondContact CB-O 3.35Å; C224-C253 WeakPolarHBondContact CA-SG 3.11Å; C224-C253 HydrophobicContact CB-CB 3.66Å; C224-C253 WeakPolarHBondContact CB-SG 3.02Å; C224-C253 WeakPolarHBondContact SG-CB 3.01Å; C224-C253 CovalentContact SG-SG 2Å; C224-C253 PolarHBondContact SG-SG 2.79Å; M225-C253 WeakPolarHBondContact CE-SG 3.43Å; M225-C253 PolarHBondContact SD-SG 3Å; S250-C253 PolarHBondContact O-N 3.24Å; S250-C253 VanDerWaalsContact O-N 3.08Å; S250-C253 PolarHBondContact OG-N 2.72Å; C253-T255 PolarHBondContact O-N 2.8Å
254	S	88.3	Confident	94.1	Very high	32 Å²	32	24.3 Å²	24.3	22%	0.224	16%	0.156	C	C	.	.			trans	-60.9	124.7	-177.8	177.4	0	0	0	0	110.7	S250 T252 S256 S257	S250-S254 WeakPolarHBondContact OG-CB 3.07Å; S250-S254 PolarHBondContact OG-N 2.75Å; T252-S254 PolarHBondContact O-N 3.25Å; T252-S254 VanDerWaalsContact O-N 3.08Å; S254-S256 PolarHBondContact O-N 3.47Å; S254-S256 PolarHBondContact OG-N 2.04Å; S254-S256 PolarHBondContact OG-OG 3.28Å; S254-S257 WeakPolarHBondContact CB-OG 3.47Å; S254-S257 PolarHBondContact O-N 3.38Å
255	T	87.2	Confident	94.1	Very high	37 Å²	37	24.9 Å²	24.9	23%	0.227	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-8.9	178.5	56.1	0	0	0	0	113.9	V50 G218 A219 G220 C253	V50-T255 HydrophobicContact CG1-CG2 4.05Å; G218-T255 CarbonylContact C-O 3.45Å; A219-T255 PolarHBondContact N-O 3.34Å; G220-T255 VanDerWaalsContact C-CB 3.49Å; G220-T255 PolarHBondContact N-O 3.5Å; G220-T255 VanDerWaalsContact O-CB 3.28Å; G220-T255 WeakPolarHBondContact O-CB 3.31Å; G220-T255 VanDerWaalsContact O-CG2 3.31Å; G220-T255 WeakPolarHBondContact O-CG2 3.43Å; C253-T255 PolarHBondContact O-N 2.8Å
256	S	89.6	Confident	94	Very high	80 Å²	80	29.9 Å²	29.9	56%	0.559	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.3	-3.6	172.9	73.1	0	0	0	0	113.3	S254	S254-S256 PolarHBondContact O-N 3.47Å; S254-S256 PolarHBondContact OG-N 2.04Å; S254-S256 PolarHBondContact OG-OG 3.28Å
257	S	92.1	Very high	94.1	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.007	18%	0.181	C	C	.	.	S	Bend	trans	-99	136.5	177.5	-58.1	0	0	0	0	109.9	Y204 G218 S254 G259	Y204-S257 VanDerWaalsContact CZ-OG 3.27Å; Y204-S257 PolarHBondContact OH-OG 2.82Å; G218-S257 PolarHBondContact N-O 3.19Å; S254-S257 WeakPolarHBondContact CB-OG 3.47Å; S254-S257 PolarHBondContact O-N 3.38Å; S257-G259 PolarHBondContact O-N 3.4Å
258	P	94.6	Very high	94.1	Very high	7 Å²	7	31.9 Å²	31.9	5%	0.045	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	131.4	171.2	-19.7	32.7	0	0	0	110.7	L196 Y204 W205 C215	L196-P258 HydrophobicContact CD2-CB 3.91Å; L196-P258 HydrophobicContact CD2-CG 3.6Å; Y204-P258 HydrophobicContact CG-CG 4.44Å; W205-P258 PolarHBondContact NE1-O 3.4Å; C215-P258 HydrophobicContact CB-CB 4.23Å
259	G	95.6	Very high	94.2	Very high	4 Å²	4	31.6 Å²	31.6	4%	0.041	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	149.6	165	0	0	0	0	0	110.3	C215 A216 S257 Y261	C215-G259 WeakPolarHBondContact CA-O 3.14Å; A216-G259 PolarHBondContact N-O 2.87Å; A216-G259 PolarHBondContact O-N 3.29Å; S257-G259 PolarHBondContact O-N 3.4Å; G259-Y261 WeakPolarHBondContact O-CE2 3.24Å
260	V	98.3	Very high	94.4	Very high	1 Å²	1	31.8 Å²	31.8	1%	0.006	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	135.5	-178.9	-170.6	0	0	0	0	109.6	I209 M213 S247 W248	I209-V260 HydrophobicContact CD1-CG1 4.23Å; I209-V260 HydrophobicContact CD1-CG2 3.87Å; M213-V260 HydrophobicContact CB-CG1 3.81Å; M213-V260 HydrophobicContact CG-CG1 4.02Å; M213-V260 HydrophobicContact SD-CG1 3.71Å; S247-V260 WeakPolarHBondContact CB-O 3.48Å; S247-V260 PolarHBondContact N-O 3.39Å; W248-V260 HydrophobicContact CD2-CB 3.81Å; W248-V260 HydrophobicContact CD2-CG1 4.31Å; W248-V260 HydrophobicContact CD2-CG2 3.96Å; W248-V260 HydrophobicContact CE3-CB 4.35Å; W248-V260 HydrophobicContact CE3-CG2 4.02Å; W248-V260 HydrophobicContact CG-CB 4.14Å; W248-V260 HydrophobicContact CH2-CB 4.5Å; W248-V260 HydrophobicContact CH2-CG2 3.76Å; W248-V260 HydrophobicContact CZ2-CB 3.99Å; W248-V260 HydrophobicContact CZ2-CG1 3.83Å; W248-V260 HydrophobicContact CZ2-CG2 3.69Å; W248-V260 HydrophobicContact CZ3-CG2 3.91Å; W248-V260 PolarHBondContact N-O 2.6Å; W248-V260 WeakPolarHBondContact O-CA 3.32Å; W248-V260 WeakPolarHBondContact O-CB 3.3Å; W248-V260 PolarHBondContact O-N 3.19Å; W248-V260 VanDerWaalsContact O-O 3.06Å
261	Y	98.8	Very high	94.8	Very high	2 Å²	2	31.2 Å²	31.2	1%	0.008	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	147.9	-172.2	-56.4	-107.2	0	0	0	109.1	L193 M213 I214 A216 S223 L232 I245 V246 G259 R263	L193-Y261 HydrophobicContact CD1-CE2 4.48Å; L193-Y261 WeakPolarHBondContact CD1-OH 3.16Å; M213-Y261 CarbonylContact C-O 3.59Å; M213-Y261 WeakPolarHBondContact CA-O 3.26Å; I214-Y261 PolarHBondContact N-O 2.89Å; I214-Y261 WeakPolarHBondContact O-CB 2.91Å; I214-Y261 WeakPolarHBondContact O-CD2 3.48Å; I214-Y261 PolarHBondContact O-N 3.31Å; A216-Y261 HydrophobicContact CB-CD2 4.39Å; A216-Y261 HydrophobicContact CB-CE2 3.78Å; S223-Y261 PolarHBondContact OG-OH 2.63Å; L232-Y261 HydrophobicContact CB-CD1 3.57Å; L232-Y261 HydrophobicContact CB-CE1 3.64Å; L232-Y261 HydrophobicContact CB-CG 4.33Å; L232-Y261 HydrophobicContact CD1-CE1 4.3Å; L232-Y261 HydrophobicContact CD2-CD1 3.88Å; L232-Y261 HydrophobicContact CD2-CD2 3.92Å; L232-Y261 HydrophobicContact CD2-CE1 4.05Å; L232-Y261 HydrophobicContact CD2-CE2 4.13Å; L232-Y261 HydrophobicContact CD2-CG 3.83Å; L232-Y261 HydrophobicContact CG-CD1 4.29Å; L232-Y261 HydrophobicContact CG-CE1 4.21Å; I245-Y261 CarbonylContact O-C 3.42Å; I245-Y261 WeakPolarHBondContact O-CA 3.31Å; I245-Y261 VanDerWaalsContact O-CB 3.3Å; I245-Y261 WeakPolarHBondContact O-CB 3.27Å; V246-Y261 HydrophobicContact CB-CD1 4.32Å; V246-Y261 HydrophobicContact CB-CE1 4.31Å; V246-Y261 HydrophobicContact CG2-CD1 3.96Å; V246-Y261 HydrophobicContact CG2-CE1 3.57Å; G259-Y261 WeakPolarHBondContact O-CE2 3.24Å; Y261-R263 PolarHBondContact O-N 3.46Å
262	A	98.8	Very high	95.4	Very high	3 Å²	3	29.2 Å²	29.2	3%	0.025	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	127	168.8	0	0	0	0	0	109	D135 G244 I245 V264 L267	D135-A262 HydrophobicContact CB-CB 4.45Å; D135-A262 WeakPolarHBondContact O-CB 3.41Å; G244-A262 VanDerWaalsContact CA-O 3.27Å; G244-A262 WeakPolarHBondContact CA-O 3.35Å; I245-A262 HydrophobicContact CB-CB 4.23Å; I245-A262 PolarHBondContact N-O 3.13Å; I245-A262 PolarHBondContact O-N 3.18Å; A262-V264 PolarHBondContact O-N 2.92Å; A262-L267 HydrophobicContact CB-CD1 3.77Å
263	R	98.9	Very high	95.9	Very high	39 Å²	39	32.3 Å²	32.3	15%	0.147	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	107.9	-174.2	-176.5	-178.4	-69.1	-88.3	0.4	110.7	N198 N211 L212 M213 I214 Y261 T265 E266 L267	N198-R263 PolarHBondContact OD1-NH2 2.82Å; N211-R263 WeakPolarHBondContact O-CD 3.16Å; N211-R263 PolarHBondContact O-NE 3.06Å; N211-R263 VanDerWaalsContact O-NE 3.12Å; L212-R263 WeakPolarHBondContact O-CB 3.43Å; L212-R263 PolarHBondContact O-N 3.32Å; M213-R263 VanDerWaalsContact O-CZ 3.25Å; M213-R263 PolarHBondContact O-NE 3.38Å; M213-R263 PolarHBondContact O-NH2 3.37Å; I214-R263 HydrophobicContact CB-CB 4.18Å; I214-R263 HydrophobicContact CB-CG 4.23Å; I214-R263 HydrophobicContact CG2-CB 4.3Å; Y261-R263 PolarHBondContact O-N 3.46Å; R263-T265 VanDerWaalsContact C-N 3.32Å; R263-T265 WeakPolarHBondContact CG-OG1 3.41Å; R263-T265 PolarHBondContact O-N 3.01Å; R263-E266 HydrophobicContact CB-CG 4.39Å; R263-E266 HydrophobicContact CG-CG 3.96Å; R263-E266 PolarHBondContact O-N 3.49Å; R263-L267 WeakPolarHBondContact O-CG 3.07Å; R263-L267 PolarHBondContact O-N 3.45Å
264	V	98.9	Very high	96.6	Very high	2 Å²	2	32.5 Å²	32.5	1%	0.012	18%	0.176	C	C	.	.	H	α-helix	trans	-63.3	-36.1	-173.8	175.4	0	0	0	0	112.4	L156 A157 L242 V243 I245 A262 E266 L267 R268	L156-V264 HydrophobicContact CD2-CG1 4.24Å; A157-V264 HydrophobicContact CB-CB 4.48Å; A157-V264 HydrophobicContact CB-CG1 4.18Å; L242-V264 HydrophobicContact CD2-CG2 4.22Å; L242-V264 HydrophobicContact CG-CG2 4.1Å; L242-V264 WeakPolarHBondContact O-CG1 3.28Å; V243-V264 WeakPolarHBondContact O-CB 3.31Å; V243-V264 PolarHBondContact O-N 3.03Å; I245-V264 HydrophobicContact CD1-CG2 4.19Å; I245-V264 HydrophobicContact CG1-CG2 4.1Å; A262-V264 PolarHBondContact O-N 2.92Å; V264-E266 VanDerWaalsContact C-N 3.29Å; V264-E266 PolarHBondContact O-N 2.86Å; V264-L267 CarbonylContact O-C 3.48Å; V264-L267 PolarHBondContact O-N 3.21Å; V264-L267 VanDerWaalsContact O-N 3.15Å; V264-R268 WeakPolarHBondContact O-CA 3.34Å; V264-R268 VanDerWaalsContact O-CB 3.31Å; V264-R268 WeakPolarHBondContact O-CB 3.32Å; V264-R268 PolarHBondContact O-N 2.85Å
265	T	98.8	Very high	97.1	Very high	11 Å²	11	33 Å²	33	7%	0.067	18%	0.176	C	C	.	.	H	α-helix	trans	-57.9	-40.4	179.6	56.4	0	0	0	0	112.5	A157 G158 S159 D161 F163 R263	A157-T265 HydrophobicContact CB-CG2 3.79Å; G158-T265 WeakPolarHBondContact O-CG2 3.47Å; S159-T265 WeakPolarHBondContact CA-O 3.48Å; S159-T265 PolarHBondContact OG-O 3.09Å; D161-T265 HydrophobicContact CB-CG2 4.35Å; F163-T265 HydrophobicContact CD2-CG2 4.36Å; F163-T265 HydrophobicContact CE2-CG2 4.33Å; R263-T265 VanDerWaalsContact C-N 3.32Å; R263-T265 WeakPolarHBondContact CG-OG1 3.41Å; R263-T265 PolarHBondContact O-N 3.01Å
266	E	98.8	Very high	97.6	Very high	107 Å²	107	35.6 Å²	35.6	50%	0.5	20%	0.201	S	C	.	.	H	α-helix	trans	-78.3	-29	179.3	-58.7	-62.9	142.3	0	0	112.5	L212 R263 V264	L212-E266 HydrophobicContact CD2-CB 3.84Å; R263-E266 HydrophobicContact CB-CG 4.39Å; R263-E266 HydrophobicContact CG-CG 3.96Å; R263-E266 PolarHBondContact O-N 3.49Å; V264-E266 VanDerWaalsContact C-N 3.29Å; V264-E266 PolarHBondContact O-N 2.86Å
267	L	98.8	Very high	98	Very high	3 Å²	3	35.6 Å²	35.6	2%	0.016	21%	0.206	C	C	.	.	H	α-helix	trans	-91.6	-5.4	-178.7	-61	169.5	0	0	0	112.6	N134 I136 L212 A262 R263 V264 A269 W270 V271	N134-L267 HydrophobicContact CB-CD2 4.39Å; I136-L267 HydrophobicContact CB-CD1 4.04Å; I136-L267 HydrophobicContact CD1-CB 4.07Å; I136-L267 HydrophobicContact CD1-CD1 4.29Å; I136-L267 HydrophobicContact CG2-CB 4.41Å; I136-L267 HydrophobicContact CG2-CD1 3.88Å; I136-L267 HydrophobicContact CG2-CD2 4.2Å; I136-L267 HydrophobicContact CG2-CG 4.38Å; L212-L267 HydrophobicContact CD2-CD2 4.31Å; A262-L267 HydrophobicContact CB-CD1 3.77Å; R263-L267 WeakPolarHBondContact O-CG 3.07Å; R263-L267 PolarHBondContact O-N 3.45Å; V264-L267 CarbonylContact O-C 3.48Å; V264-L267 PolarHBondContact O-N 3.21Å; V264-L267 VanDerWaalsContact O-N 3.15Å; L267-A269 PolarHBondContact O-N 3.25Å; L267-W270 PolarHBondContact O-N 2Å; L267-V271 PolarHBondContact O-N 2.76Å
268	R	98.7	Very high	98.3	Very high	53 Å²	53	39.2 Å²	39.2	20%	0.2	23%	0.225	C	C	.	.	H	α-helix	trans	-59.6	-42.8	-173.5	175.5	58.8	-174.3	-96.6	4.8	112.9	L156 A157 S159 V264 W270 V271 D272	L156-R268 PolarHBondContact O-NH1 3.18Å; A157-R268 VanDerWaalsContact C-NH1 3.32Å; A157-R268 WeakPolarHBondContact O-CD 3.31Å; A157-R268 WeakPolarHBondContact O-CG 3.46Å; A157-R268 PolarHBondContact O-NH1 3.42Å; S159-R268 WeakPolarHBondContact OG-CB 3.44Å; V264-R268 WeakPolarHBondContact O-CA 3.34Å; V264-R268 VanDerWaalsContact O-CB 3.31Å; V264-R268 WeakPolarHBondContact O-CB 3.32Å; V264-R268 PolarHBondContact O-N 2.85Å; R268-W270 VanDerWaalsContact C-N 3.28Å; R268-W270 PolarHBondContact O-N 3.48Å; R268-V271 WeakPolarHBondContact O-CB 3.25Å; R268-V271 PolarHBondContact O-N 3.1Å; R268-V271 VanDerWaalsContact O-N 3.1Å; R268-D272 IonicContact CZ-OD1 2.72Å; R268-D272 IonicContact CZ-OD2 3Å; R268-D272 IonicContact NE-OD1 3.88Å; R268-D272 PolarHBondContact NE-OD1 3.22Å; R268-D272 IonicContact NE-OD2 3.72Å; R268-D272 PolarHBondContact NE-OD2 2.85Å; R268-D272 IonicContact NH2-OD1 3.35Å; R268-D272 PolarHBondContact NH2-OD1 3.38Å; R268-D272 IonicContact NH2-OD2 3.44Å; R268-D272 PolarHBondContact O-N 3.05Å
269	A	98.6	Very high	98.5	Very high	46 Å²	46	40.9 Å²	40.9	38%	0.38	23%	0.234	S	C	.	.	H	α-helix	trans	-60.1	-40.1	-180	0	0	0	0	0	112	L267 Q273	L267-A269 PolarHBondContact O-N 3.25Å; A269-Q273 WeakPolarHBondContact O-CB 3.49Å; A269-Q273 WeakPolarHBondContact O-CG 3.44Å; A269-Q273 PolarHBondContact O-N 3.28Å
270	W	98.8	Very high	98.6	Very high	33 Å²	33	42.8 Å²	42.8	13%	0.125	25%	0.245	C	C	.	.	H	α-helix	trans	-66.5	-39.1	175.9	171.3	82.2	0	0	0	112	F122 H124 I136 L138 L267 R268 T274	F122-W270 HydrophobicContact CB-CZ2 4.43Å; F122-W270 VanDerWaalsContact O-CH2 3.25Å; F122-W270 WeakPolarHBondContact O-CH2 3.3Å; F122-W270 WeakPolarHBondContact O-CZ2 3Å; H124-W270 HydrophobicContact CB-CH2 4.43Å; H124-W270 HydrophobicContact CB-CZ2 4.12Å; H124-W270 AromaticContact CD2-CD1 3.68Å; H124-W270 AromaticContact CD2-CD2 3.3Å; H124-W270 AromaticContact CD2-CE2 3.61Å; H124-W270 AromaticContact CD2-CE3 3.79Å; H124-W270 AromaticContact CD2-CG 3.36Å; H124-W270 AromaticContact CD2-NE1 3.82Å; H124-W270 AromaticContact NE2-CD1 3.75Å; H124-W270 AromaticContact NE2-CG 3.53Å; I136-W270 HydrophobicContact CB-CZ3 4.25Å; I136-W270 HydrophobicContact CD1-CE3 4.2Å; I136-W270 HydrophobicContact CD1-CZ3 3.89Å; I136-W270 HydrophobicContact CG1-CE3 4.48Å; I136-W270 HydrophobicContact CG1-CZ3 3.77Å; I136-W270 HydrophobicContact CG2-CE3 3.82Å; I136-W270 HydrophobicContact CG2-CH2 4.24Å; I136-W270 HydrophobicContact CG2-CZ3 3.61Å; L138-W270 HydrophobicContact CB-CH2 4.28Å; L138-W270 HydrophobicContact CD1-CH2 4.25Å; L138-W270 HydrophobicContact CD1-CZ3 4.09Å; L138-W270 HydrophobicContact CG-CH2 3.9Å; L138-W270 HydrophobicContact CG-CZ3 3.81Å; L267-W270 PolarHBondContact O-N 2Å; R268-W270 VanDerWaalsContact C-N 3.28Å; R268-W270 PolarHBondContact O-N 3.48Å; W270-T274 PolarHBondContact NE1-OG1 2.92Å; W270-T274 VanDerWaalsContact O-CB 3.31Å; W270-T274 WeakPolarHBondContact O-CB 3.05Å; W270-T274 PolarHBondContact O-N 3.42Å; W270-T274 PolarHBondContact O-OG1 3.05Å
271	V	98.9	Very high	98.6	Very high	2 Å²	2	45.1 Å²	45.1	1%	0.012	26%	0.258	C	S	.	.	H	α-helix	trans	-59.7	-52.6	175.7	170.6	0	0	0	0	110.5	I80 I136 L138 L156 L267 R268 Q273 T274 I275	I80-V271 HydrophobicContact CD1-CG1 4.28Å; I136-V271 HydrophobicContact CD1-CG2 3.72Å; L138-V271 HydrophobicContact CD1-CB 4.39Å; L138-V271 HydrophobicContact CD1-CG1 4.15Å; L138-V271 HydrophobicContact CD1-CG2 4.45Å; L138-V271 HydrophobicContact CD2-CG1 4.29Å; L138-V271 HydrophobicContact CD2-CG2 4.49Å; L156-V271 HydrophobicContact CD1-CG1 3.81Å; L267-V271 PolarHBondContact O-N 2.76Å; R268-V271 WeakPolarHBondContact O-CB 3.25Å; R268-V271 PolarHBondContact O-N 3.1Å; R268-V271 VanDerWaalsContact O-N 3.1Å; V271-Q273 PolarHBondContact O-N 3.48Å; V271-T274 PolarHBondContact O-N 3.38Å; V271-I275 HydrophobicContact CG1-CD1 3.85Å; V271-I275 WeakPolarHBondContact O-CG1 3.48Å; V271-I275 PolarHBondContact O-N 3.31Å
272	D	98.8	Very high	98.6	Very high	68 Å²	68	47.6 Å²	47.6	36%	0.364	27%	0.273	S	S	.	.	H	α-helix	trans	-62.6	-44	-177.6	-67.7	-24.4	0	0	0	111.6	R268 T274 I275 A276	R268-D272 IonicContact CZ-OD1 2.72Å; R268-D272 IonicContact CZ-OD2 3Å; R268-D272 IonicContact NE-OD1 3.88Å; R268-D272 PolarHBondContact NE-OD1 3.22Å; R268-D272 IonicContact NE-OD2 3.72Å; R268-D272 PolarHBondContact NE-OD2 2.85Å; R268-D272 IonicContact NH2-OD1 3.35Å; R268-D272 PolarHBondContact NH2-OD1 3.38Å; R268-D272 IonicContact NH2-OD2 3.44Å; R268-D272 PolarHBondContact O-N 3.05Å; D272-T274 PolarHBondContact O-N 3.22Å; D272-I275 PolarHBondContact O-N 3.35Å; D272-A276 VanDerWaalsContact O-CB 3.29Å; D272-A276 WeakPolarHBondContact O-CB 3.44Å; D272-A276 PolarHBondContact O-N 2.7Å
273	Q	98.8	Very high	98.6	Very high	134 Å²	134	50.4 Å²	50.4	63%	0.626	29%	0.288	S	S	*	.	H	α-helix	trans	-62.7	-41.6	177.4	-73.1	169.2	18.4	0	0	112.3	A269 V271 A277	A269-Q273 WeakPolarHBondContact O-CB 3.49Å; A269-Q273 WeakPolarHBondContact O-CG 3.44Å; A269-Q273 PolarHBondContact O-N 3.28Å; V271-Q273 PolarHBondContact O-N 3.48Å; Q273-A277 VanDerWaalsContact O-CB 3.3Å; Q273-A277 WeakPolarHBondContact O-CB 3.13Å; Q273-A277 PolarHBondContact O-N 3Å; Q273-A277 VanDerWaalsContact O-N 3.09Å
274	T	98.8	Very high	98.6	Very high	17 Å²	17	51.2 Å²	51.2	10%	0.104	30%	0.297	C	S	.	.	H	α-helix	trans	-65.4	-44	-179.9	-59.9	0	0	0	0	111.3	W84 F122 L138 W270 V271 D272 A277 N278	W84-T274 HydrophobicContact CH2-CG2 4.35Å; W84-T274 HydrophobicContact CZ3-CG2 4.48Å; F122-T274 HydrophobicContact CB-CG2 3.85Å; F122-T274 HydrophobicContact CD1-CG2 3.66Å; F122-T274 HydrophobicContact CD2-CG2 4.3Å; F122-T274 HydrophobicContact CE1-CG2 4.19Å; F122-T274 HydrophobicContact CG-CG2 3.7Å; L138-T274 HydrophobicContact CD1-CG2 3.82Å; W270-T274 PolarHBondContact NE1-OG1 2.92Å; W270-T274 VanDerWaalsContact O-CB 3.31Å; W270-T274 WeakPolarHBondContact O-CB 3.05Å; W270-T274 PolarHBondContact O-N 3.42Å; W270-T274 PolarHBondContact O-OG1 3.05Å; V271-T274 PolarHBondContact O-N 3.38Å; D272-T274 PolarHBondContact O-N 3.22Å; T274-A277 PolarHBondContact O-N 3.47Å; T274-N278 PolarHBondContact O-N 3.3Å; T274-N278 PolarHBondContact O-ND2 3.08Å
275	I	98.5	Very high	98.6	Very high	42 Å²	42	54.7 Å²	54.7	22%	0.215	32%	0.318	C	S	.	.	H	α-helix	trans	-65.8	-46.8	177.5	-67.1	172.1	0	0	0	110.6	I80 W84 L138 V271 D272 A277 N278	I80-I275 HydrophobicContact CD1-CD1 3.76Å; W84-I275 HydrophobicContact CD2-CG1 3.99Å; W84-I275 HydrophobicContact CE3-CG1 4.38Å; W84-I275 HydrophobicContact CG-CD1 4.44Å; W84-I275 HydrophobicContact CG-CG1 4.27Å; W84-I275 HydrophobicContact CZ2-CG1 4.25Å; L138-I275 HydrophobicContact CD1-CG1 4.13Å; V271-I275 HydrophobicContact CG1-CD1 3.85Å; V271-I275 WeakPolarHBondContact O-CG1 3.48Å; V271-I275 PolarHBondContact O-N 3.31Å; D272-I275 PolarHBondContact O-N 3.35Å; I275-A277 PolarHBondContact O-N 3.27Å; I275-N278 PolarHBondContact O-N 3.17Å
276	A	98.4	Very high	98.6	Very high	92 Å²	92	58.1 Å²	58.1	76%	0.76	34%	0.337	S	S	*	.	H	α-helix	trans	-62.1	-30.4	-179.2	0	0	0	0	0	113	D272	D272-A276 VanDerWaalsContact O-CB 3.29Å; D272-A276 WeakPolarHBondContact O-CB 3.44Å; D272-A276 PolarHBondContact O-N 2.7Å
277	A	98.3	Very high	98.5	Very high	80 Å²	80	54 Å²	54	66%	0.661	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.9	-3.5	-179.8	0	0	0	0	0	114.5	Q273 T274 I275	Q273-A277 VanDerWaalsContact O-CB 3.3Å; Q273-A277 WeakPolarHBondContact O-CB 3.13Å; Q273-A277 PolarHBondContact O-N 3Å; Q273-A277 VanDerWaalsContact O-N 3.09Å; T274-A277 PolarHBondContact O-N 3.47Å; I275-A277 PolarHBondContact O-N 3.27Å
278	N	97.3	Very high	98.5	Very high	78 Å²	78	58.6 Å²	58.6	42%	0.417	35%	0.351	S	S	.	.			trans	-139.4	0	-173.1	-67.4	-95	0	0	0	114.2	W84 K120 F122 K140 T274 I275	W84-N278 HydrophobicContact CH2-CB 4.02Å; W84-N278 HydrophobicContact CZ2-CB 4.02Å; W84-N278 WeakPolarHBondContact CZ2-OXT 3.2Å; K120-N278 PolarHBondContact NZ-OD1 3.08Å; F122-N278 HydrophobicContact CE1-CB 4.32Å; F122-N278 VanDerWaalsContact CE1-CG 3.41Å; F122-N278 WeakPolarHBondContact CE1-ND2 3.43Å; F122-N278 VanDerWaalsContact CE1-OD1 3.24Å; F122-N278 WeakPolarHBondContact CE1-OD1 3.38Å; F122-N278 HydrophobicContact CZ-CB 3.81Å; F122-N278 VanDerWaalsContact CZ-OD1 3.22Å; F122-N278 WeakPolarHBondContact CZ-OD1 3.42Å; K140-N278 PolarHBondContact NZ-O 3.42Å; K140-N278 PolarHBondContact NZ-OXT 3.15Å; T274-N278 PolarHBondContact O-N 3.3Å; T274-N278 PolarHBondContact O-ND2 3.08Å; I275-N278 PolarHBondContact O-N 3.17Å

Retrieved 278 of 278 residues in 338.8 ms (Link to these results)

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