A0A060YZ38_ONCMY Loading...

Stromal cell-derived factor 2

AlphaFold DB , UniProt , Accession A0A060YZ38, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 224 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.2	Very low	46.3	Very low	239 Å²	239	148.4 Å²	148.4	100%	1.177	81%	0.813	S	S	*	*				0	77.8	0	-81.3	163.9	162.9	0	0	105.2
2	D	37.6	Very low	46.3	Very low	159 Å²	159	146.9 Å²	146.9	85%	0.85	80%	0.802	S	S	*	*			trans	-99	126.1	-170.5	-63.1	-50.8	0	0	0	109.4
3	N	36.8	Very low	46.6	Very low	152 Å²	152	141.5 Å²	141.5	81%	0.813	78%	0.782	S	S	*	*			trans	-87.8	125	-171.7	-158.6	16.2	0	0	0	109.8	T5	N3-T5 PolarHBondContact O-N 3.17Å; N3-T5 VanDerWaalsContact O-N 3.17Å
4	C	42.6	Very low	46.8	Very low	127 Å²	127	135.5 Å²	135.5	86%	0.858	76%	0.76	S	S	*	*			trans	-69.8	103.1	-178.8	-68.4	0	0	0	0	111.8
5	T	52.3	Low	46.7	Very low	138 Å²	138	137.8 Å²	137.8	85%	0.847	76%	0.759	S	S	*	*			trans	-105.4	110	162.3	49.7	0	0	0	0	109.6	N3	N3-T5 PolarHBondContact O-N 3.17Å; N3-T5 VanDerWaalsContact O-N 3.17Å
6	G	52.6	Low	46.6	Very low	65 Å²	65	137.6 Å²	137.6	67%	0.67	76%	0.755	S	S	*	*			trans	155.6	56.5	166.5	0	0	0	0	0	116.1
7	H	49.8	Very low	46.6	Very low	178 Å²	178	136.1 Å²	136.1	82%	0.824	75%	0.746	S	S	*	*	S	Bend	trans	-138.9	13.5	171.2	-88.7	75.5	0	0	0	114.4
8	S	51.2	Low	46.5	Very low	89 Å²	89	134.3 Å²	134.3	62%	0.622	74%	0.739	S	S	*	*	S	Bend	trans	-105.7	-8.3	-176.9	-158.5	0	0	0	0	115.7
9	H	49.4	Very low	46.4	Very low	171 Å²	171	132.8 Å²	132.8	79%	0.792	74%	0.738	S	S	*	*	S	Bend	trans	-99.3	-19.4	-177.8	-74.2	-76.6	0	0	0	114.6
10	F	47.5	Very low	46.5	Very low	181 Å²	181	132.8 Å²	132.8	79%	0.794	74%	0.736	S	S	*	*	H	α-helix	trans	-78.9	-27	-177.1	-109.2	-91.1	0	0	0	113.7
11	L	49.4	Very low	46.7	Very low	133 Å²	133	133.9 Å²	133.9	70%	0.696	74%	0.74	S	S	*	*	H	α-helix	trans	-79	-29.9	-177.8	-67.2	172	0	0	0	113.2
12	L	46.3	Very low	47.1	Very low	131 Å²	131	125.6 Å²	125.6	69%	0.686	72%	0.716	S	S	*	*	H	α-helix	trans	-73.1	-29	174.7	-88.8	114.5	0	0	0	112.8	L16	L12-L16 PolarHBondContact O-N 3.38Å
13	S	50.4	Low	47.6	Very low	76 Å²	76	125.3 Å²	125.3	53%	0.531	71%	0.714	S	S	.	*	H	α-helix	trans	-71.4	-36.4	177.5	161	0	0	0	0	112.5	L17	S13-L17 PolarHBondContact O-N 3.47Å
14	A	49.3	Very low	48.1	Very low	58 Å²	58	123.2 Å²	123.2	48%	0.479	71%	0.711	S	S	.	*	H	α-helix	trans	-72.3	-33.8	-179.1	0	0	0	0	0	112.8	L17 T18	A14-L17 PolarHBondContact O-N 3.25Å; A14-T18 PolarHBondContact O-N 3.1Å; A14-T18 PolarHBondContact O-OG1 3.48Å
15	F	45.5	Very low	48.4	Very low	170 Å²	170	124.6 Å²	124.6	75%	0.746	71%	0.709	S	S	*	*	H	α-helix	trans	-74.1	-31.2	178.4	-119.3	-93.9	0	0	0	113.2	L17 T18	F15-L17 VanDerWaalsContact C-N 3.34Å; F15-T18 PolarHBondContact O-OG1 3.33Å; F15-T18 VanDerWaalsContact O-OG1 3.1Å
16	L	45.2	Very low	48.2	Very low	134 Å²	134	120.6 Å²	120.6	70%	0.702	70%	0.695	S	S	*	*	H	α-helix	trans	-72.9	-28.5	176	-138.3	79.6	0	0	0	112	L12	L12-L16 PolarHBondContact O-N 3.38Å
17	L	45.5	Very low	48.1	Very low	113 Å²	113	123.2 Å²	123.2	59%	0.592	70%	0.698	S	S	*	*	H	α-helix	trans	-82.9	-26.2	-179.1	-159.7	66.8	0	0	0	113.1	S13 A14 F15 C19	S13-L17 PolarHBondContact O-N 3.47Å; A14-L17 PolarHBondContact O-N 3.25Å; F15-L17 VanDerWaalsContact C-N 3.34Å; L17-C19 VanDerWaalsContact C-N 3.3Å
18	T	46	Very low	48.6	Very low	103 Å²	103	122.7 Å²	122.7	63%	0.632	70%	0.696	S	S	*	*	H	α-helix	trans	-75.3	-17.1	172.3	43.1	0	0	0	0	113.8	A14 F15 L20	A14-T18 PolarHBondContact O-N 3.1Å; A14-T18 PolarHBondContact O-OG1 3.48Å; F15-T18 PolarHBondContact O-OG1 3.33Å; F15-T18 VanDerWaalsContact O-OG1 3.1Å; T18-L20 VanDerWaalsContact C-N 3.31Å
19	C	44.7	Very low	49.5	Very low	106 Å²	106	119.8 Å²	119.8	72%	0.716	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-9.2	177.7	-154	0	0	0	0	113.5	L17	L17-C19 VanDerWaalsContact C-N 3.3Å
20	L	47.9	Very low	51.3	Low	133 Å²	133	114.7 Å²	114.7	70%	0.696	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.7	-1.7	-177	-77.6	160.4	0	0	0	114.3	T18	T18-L20 VanDerWaalsContact C-N 3.31Å
21	L	51	Low	53.5	Low	155 Å²	155	108 Å²	108	81%	0.812	63%	0.628	S	S	*	*	S	Bend	trans	-121.1	15.7	-172.4	-84.1	149.3	0	0	0	114.7
22	G	47.2	Very low	55.7	Low	66 Å²	66	101.7 Å²	101.7	68%	0.68	60%	0.595	S	S	*	*			trans	-115.4	6.4	-179.1	0	0	0	0	0	116	S24	G22-S24 VanDerWaalsContact C-N 3.29Å; G22-S24 PolarHBondContact O-N 3Å
23	L	48	Very low	58.1	Low	152 Å²	152	95.5 Å²	95.5	80%	0.796	56%	0.563	S	S	*	*			trans	-78.8	84.9	171.9	-80.4	159.4	0	0	0	108.4	L25	L23-L25 VanDerWaalsContact C-N 3.29Å; L23-L25 HydrophobicContact CB-CD1 4.45Å; L23-L25 PolarHBondContact O-N 2.95Å
24	S	49.2	Very low	60.3	Low	109 Å²	109	92.2 Å²	92.2	76%	0.762	54%	0.539	S	S	*	.			trans	-60.6	103.1	153.4	63.4	0	0	0	0	106.2	G22 G26	G22-S24 VanDerWaalsContact C-N 3.29Å; G22-S24 PolarHBondContact O-N 3Å; S24-G26 PolarHBondContact O-N 3.21Å
25	L	48.6	Very low	62.6	Low	155 Å²	155	90.3 Å²	90.3	81%	0.812	53%	0.525	S	S	*	.			trans	-66.1	72.9	156.5	-88	86.3	0	0	0	106.5	L23 T27	L23-L25 VanDerWaalsContact C-N 3.29Å; L23-L25 HydrophobicContact CB-CD1 4.45Å; L23-L25 PolarHBondContact O-N 2.95Å; L25-T27 PolarHBondContact O-N 2.75Å
26	G	46.8	Very low	65.1	Low	54 Å²	54	82.2 Å²	82.2	56%	0.557	49%	0.49	S	S	*	.			trans	-56.5	120.9	147.9	0	0	0	0	0	104.1	S24 E28	S24-G26 PolarHBondContact O-N 3.21Å; G26-E28 PolarHBondContact O-N 2.8Å
27	T	51.8	Low	67.6	Low	120 Å²	120	77.4 Å²	77.4	74%	0.736	47%	0.466	S	S	*	.			trans	-58.8	94.5	167.2	41.2	0	0	0	0	105.9	L25 L29	L25-T27 PolarHBondContact O-N 2.75Å; T27-L29 PolarHBondContact O-N 2.71Å
28	E	59	Low	70.1	Confident	167 Å²	167	72 Å²	72	78%	0.78	44%	0.438	S	S	*	.			trans	-52	101.1	167.2	-87.4	-79.2	165	0	0	104.6	G26 S30	G26-E28 PolarHBondContact O-N 2.8Å; E28-S30 PolarHBondContact O-N 3.4Å
29	L	70.3	Confident	72.6	Confident	28 Å²	28	67.1 Å²	67.1	15%	0.147	41%	0.408	C	S	.	.			trans	-63.3	108.1	178.1	-65.8	179.7	0	0	0	105.6	T27 F31 R152 K205 P206	T27-L29 PolarHBondContact O-N 2.71Å; L29-F31 VanDerWaalsContact C-N 3.31Å; L29-F31 PolarHBondContact O-N 2.99Å; L29-R152 WeakPolarHBondContact O-CD 3.15Å; L29-R152 PolarHBondContact O-NE 3.08Å; L29-R152 PolarHBondContact O-NH1 2.98Å; L29-R152 VanDerWaalsContact O-NH1 3.08Å; L29-R152 PolarHBondContact O-NH2 3.2Å; L29-K205 HydrophobicContact CD1-CB 4.42Å; L29-K205 HydrophobicContact CD1-CG 3.99Å; L29-P206 HydrophobicContact CD2-CG 3.72Å
30	S	87.5	Confident	75.1	Confident	64 Å²	64	62.1 Å²	62.1	45%	0.448	37%	0.374	S	S	.	.			trans	-80.6	-15.1	-169	51.7	0	0	0	0	113.6	E28 Q151 R152	E28-S30 PolarHBondContact O-N 3.4Å; S30-Q151 WeakPolarHBondContact O-CA 3.42Å; S30-Q151 PolarHBondContact O-OE1 2.91Å; S30-Q151 PolarHBondContact OG-OE1 3.43Å; S30-R152 PolarHBondContact O-N 3Å
31	F	93.4	Very high	77.5	Confident	42 Å²	42	56.3 Å²	56.3	18%	0.184	34%	0.343	C	S	.	.	B	Isolated β-bridge	trans	-120.3	161.9	-172.9	50.6	-95.5	0	0	0	113.7	L29 T33 P93 V149 W150 R152 P206	L29-F31 VanDerWaalsContact C-N 3.31Å; L29-F31 PolarHBondContact O-N 2.99Å; F31-T33 HydrophobicContact CD2-CG2 3.65Å; F31-T33 HydrophobicContact CE2-CG2 3.55Å; F31-P93 HydrophobicContact CD2-CB 3.74Å; F31-P93 HydrophobicContact CD2-CG 4.04Å; F31-P93 HydrophobicContact CE2-CB 3.78Å; F31-P93 HydrophobicContact CE2-CG 3.53Å; F31-P93 HydrophobicContact CZ-CG 4.08Å; F31-V149 HydrophobicContact CB-CG2 3.95Å; F31-V149 HydrophobicContact CD1-CG2 4.5Å; F31-V149 HydrophobicContact CG-CG2 4.32Å; F31-W150 CarbonylContact C-O 3.55Å; F31-W150 VanDerWaalsContact CA-O 3.31Å; F31-W150 WeakPolarHBondContact CA-O 3.33Å; F31-W150 WeakPolarHBondContact CB-O 2.96Å; F31-R152 PolarHBondContact O-NE 3.49Å; F31-R152 VanDerWaalsContact O-NE 3.08Å; F31-R152 PolarHBondContact O-NH2 3.13Å; F31-P206 HydrophobicContact CE2-CB 4.4Å; F31-P206 HydrophobicContact CE2-CG 3.65Å; F31-P206 HydrophobicContact CZ-CB 4.26Å; F31-P206 HydrophobicContact CZ-CG 3.48Å; F31-P206 VanDerWaalsContact CZ-CG 3.48Å
32	V	96.3	Very high	79.8	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	31%	0.305	C	S	.	.			trans	-82.8	133.9	173.2	-174.9	0	0	0	0	109.1	V80 I94 W150 R152 A198 Y203	V32-V80 HydrophobicContact CG1-CG2 4.1Å; V32-I94 PolarHBondContact O-N 2.79Å; V32-W150 HydrophobicContact CB-CB 4.49Å; V32-W150 HydrophobicContact CB-CD2 3.8Å; V32-W150 HydrophobicContact CB-CE3 3.77Å; V32-W150 HydrophobicContact CB-CG 4.13Å; V32-W150 HydrophobicContact CB-CZ3 4.27Å; V32-W150 HydrophobicContact CG1-CD2 4.26Å; V32-W150 HydrophobicContact CG1-CE3 3.78Å; V32-W150 HydrophobicContact CG1-CH2 4.28Å; V32-W150 HydrophobicContact CG1-CZ3 3.79Å; V32-W150 HydrophobicContact CG2-CD2 3.66Å; V32-W150 HydrophobicContact CG2-CE3 4.07Å; V32-W150 HydrophobicContact CG2-CG 3.96Å; V32-W150 HydrophobicContact CG2-CH2 4.49Å; V32-W150 HydrophobicContact CG2-CZ2 4.15Å; V32-W150 HydrophobicContact CG2-CZ3 4.46Å; V32-W150 PolarHBondContact N-O 2.96Å; V32-R152 HydrophobicContact CG2-CG 4.12Å; V32-A198 HydrophobicContact CG2-CB 4Å; V32-Y203 HydrophobicContact CG2-CE1 4.2Å
33	T	96.8	Very high	82.2	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.006	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-118.4	153.5	179	56.1	0	0	0	0	111	F31 G35 S36 G91 T92 M204	F31-T33 HydrophobicContact CD2-CG2 3.65Å; F31-T33 HydrophobicContact CE2-CG2 3.55Å; T33-G35 PolarHBondContact O-N 2.91Å; T33-S36 PolarHBondContact N-OG 3.28Å; T33-S36 WeakPolarHBondContact O-CB 3.44Å; T33-S36 PolarHBondContact O-N 2.85Å; T33-S36 PolarHBondContact O-OG 3.18Å; T33-S36 PolarHBondContact OG1-OG 3.33Å; T33-G91 WeakPolarHBondContact CG2-O 3.38Å; T33-T92 CarbonylContact C-O 3.6Å; T33-T92 VanDerWaalsContact CA-O 3.22Å; T33-T92 WeakPolarHBondContact CA-O 3.4Å; T33-T92 WeakPolarHBondContact CB-O 3.48Å; T33-M204 WeakPolarHBondContact OG1-CB 3.22Å; T33-M204 PolarHBondContact OG1-N 3.34Å; T33-M204 PolarHBondContact OG1-O 2.72Å
34	C	97.2	Very high	84.6	Confident	6 Å²	6	47.2 Å²	47.2	4%	0.041	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	137	170.9	-172.7	0	0	0	0	110.9	S36 C88 H89 R90 G91 T92 I94	C34-S36 VanDerWaalsContact C-N 3.28Å; C34-S36 PolarHBondContact O-N 3.11Å; C34-C88 HydrophobicContact CB-CB 3.71Å; C34-C88 WeakPolarHBondContact CB-SG 3.48Å; C34-C88 WeakPolarHBondContact SG-CB 3.47Å; C34-C88 PolarHBondContact SG-O 2.86Å; C34-C88 CovalentContact SG-SG 2.03Å; C34-C88 PolarHBondContact SG-SG 3.01Å; C34-H89 WeakPolarHBondContact CB-O 3.02Å; C34-R90 CarbonylContact O-C 3.31Å; C34-R90 WeakPolarHBondContact O-CA 3.3Å; C34-G91 PolarHBondContact O-N 2.82Å; C34-T92 PolarHBondContact N-O 3.23Å; C34-I94 HydrophobicContact CB-CD1 3.96Å
35	G	96.3	Very high	87	Confident	18 Å²	18	43.6 Å²	43.6	19%	0.186	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.1	-2.6	-172.5	0	0	0	0	0	114.8	T33 V80 M204	T33-G35 PolarHBondContact O-N 2.91Å; G35-V80 WeakPolarHBondContact CA-O 3.32Å; G35-V80 PolarHBondContact N-O 3.07Å; G35-M204 WeakPolarHBondContact O-CE 3.34Å; G35-M204 WeakPolarHBondContact O-CG 3.2Å
36	S	97.5	Very high	89.3	Confident	0 Å²	0	41 Å²	41	0%	0	23%	0.234	C	C	.	.			trans	-66.9	147.4	170.9	-62.2	0	0	0	0	110.7	T33 C34 V80 V202 M204	T33-S36 PolarHBondContact N-OG 3.28Å; T33-S36 WeakPolarHBondContact O-CB 3.44Å; T33-S36 PolarHBondContact O-N 2.85Å; T33-S36 PolarHBondContact O-OG 3.18Å; T33-S36 PolarHBondContact OG1-OG 3.33Å; C34-S36 VanDerWaalsContact C-N 3.28Å; C34-S36 PolarHBondContact O-N 3.11Å; S36-V80 PolarHBondContact O-N 2.81Å; S36-V202 WeakPolarHBondContact CA-O 3.22Å; S36-M204 PolarHBondContact OG-N 2.52Å
37	V	98	Very high	91.8	Very high	33 Å²	33	38.5 Å²	38.5	20%	0.2	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	120.8	173.9	176.8	0	0	0	0	107.7	Y77 W78 V105 G201 V202	V37-Y77 HydrophobicContact CG1-CD1 3.68Å; V37-Y77 HydrophobicContact CG1-CG 4.01Å; V37-W78 WeakPolarHBondContact CA-O 3.2Å; V37-V105 HydrophobicContact CG1-CG2 3.75Å; V37-V105 HydrophobicContact CG2-CG2 4.41Å; V37-G201 CarbonylContact O-C 3.53Å; V37-G201 WeakPolarHBondContact O-CA 3.49Å; V37-V202 PolarHBondContact N-O 3.25Å; V37-V202 PolarHBondContact O-N 3.19Å
38	V	97.8	Very high	94	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	156.7	-171	-58.9	0	0	0	0	111.2	L40 W78 V80 A198 Y203	V38-L40 HydrophobicContact CG2-CD2 4.04Å; V38-L40 HydrophobicContact CG2-CG 4.34Å; V38-W78 PolarHBondContact N-O 3.48Å; V38-W78 PolarHBondContact O-N 3.29Å; V38-V80 HydrophobicContact CG2-CG2 4.05Å; V38-A198 HydrophobicContact CB-CB 4.44Å; V38-A198 HydrophobicContact CG1-CB 4.44Å; V38-Y203 HydrophobicContact CG1-CD1 4.08Å; V38-Y203 HydrophobicContact CG1-CE1 3.51Å
39	K	98.6	Very high	95.9	Very high	1 Å²	1	25.5 Å²	25.5	0%	0.004	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	141.1	158.6	-54.3	-166.8	-170	-168.6	0	108.6	R48 V71 D73 S76 Y77 M199 E200	K39-R48 HydrophobicContact CB-CG 4.43Å; K39-V71 PolarHBondContact NZ-O 3.1Å; K39-D73 PolarHBondContact NZ-O 2.8Å; K39-S76 WeakPolarHBondContact CA-O 3.5Å; K39-S76 WeakPolarHBondContact CG-O 3.44Å; K39-Y77 HydrophobicContact CD-CE1 4.37Å; K39-Y77 VanDerWaalsContact CE-CE1 3.47Å; K39-Y77 WeakPolarHBondContact CE-OH 3.41Å; K39-Y77 HydrophobicContact CG-CD1 3.9Å; K39-Y77 HydrophobicContact CG-CE1 3.93Å; K39-M199 PolarHBondContact N-O 2.92Å; K39-M199 PolarHBondContact O-N 2.94Å; K39-E200 HydrophobicContact CB-CB 4.49Å; K39-E200 HydrophobicContact CD-CB 4.09Å; K39-E200 HydrophobicContact CG-CB 4.23Å
40	L	98.7	Very high	97.3	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	110.1	176.5	-65.7	176.9	0	0	0	109.3	V38 R48 L49 L102 W150 F158 W196	V38-L40 HydrophobicContact CG2-CD2 4.04Å; V38-L40 HydrophobicContact CG2-CG 4.34Å; L40-R48 CarbonylContact O-C 3.5Å; L40-R48 VanDerWaalsContact O-CA 3.3Å; L40-R48 WeakPolarHBondContact O-CA 3.33Å; L40-L49 HydrophobicContact CB-CB 4.01Å; L40-L49 HydrophobicContact CD1-CD2 3.92Å; L40-L49 PolarHBondContact O-N 2.85Å; L40-L102 HydrophobicContact CD1-CD1 3.64Å; L40-L102 HydrophobicContact CD1-CD2 4.2Å; L40-W150 HydrophobicContact CD2-CH2 4.01Å; L40-W150 HydrophobicContact CD2-CZ2 3.94Å; L40-F158 HydrophobicContact CD1-CE2 3.8Å; L40-F158 HydrophobicContact CD1-CZ 3.96Å; L40-F158 HydrophobicContact CD2-CE2 3.95Å; L40-F158 HydrophobicContact CD2-CZ 3.81Å; L40-F158 HydrophobicContact CG-CE2 4.45Å; L40-W196 HydrophobicContact CB-CE3 3.98Å
41	L	98.7	Very high	97.8	Very high	11 Å²	11	21.4 Å²	21.4	6%	0.058	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	121.3	178.4	179.7	69.9	0	0	0	110	V43 R48 W196 R197 M199	L41-V43 PolarHBondContact O-N 3.41Å; L41-R48 HydrophobicContact CD1-CG 4.28Å; L41-W196 CarbonylContact O-C 3.57Å; L41-W196 VanDerWaalsContact O-CA 3.25Å; L41-W196 WeakPolarHBondContact O-CA 3.35Å; L41-R197 PolarHBondContact N-O 2.92Å; L41-R197 PolarHBondContact O-N 2.83Å; L41-M199 HydrophobicContact CB-CG 3.75Å; L41-M199 HydrophobicContact CD2-CG 4.06Å
42	N	98.7	Very high	98.1	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	120.3	166.8	-172.8	-86.4	0	0	0	109.4	K44 H45 N46 V47 I169 H193 W196	N42-K44 PolarHBondContact O-N 2.93Å; N42-K44 PolarHBondContact OD1-N 2.66Å; N42-H45 PolarHBondContact OD1-CD2 2.87Å; N42-H45 PolarHBondContact OD1-N 3.24Å; N42-N46 WeakPolarHBondContact O-CA 3.46Å; N42-N46 PolarHBondContact O-N 3.46Å; N42-V47 HydrophobicContact CB-CG2 4.16Å; N42-V47 PolarHBondContact N-O 3.22Å; N42-I169 HydrophobicContact CB-CD1 4.05Å; N42-H193 PolarHBondContact ND2-O 3.13Å; N42-W196 HydrophobicContact CB-CD2 4.29Å; N42-W196 HydrophobicContact CB-CE3 3.88Å; N42-W196 HydrophobicContact CB-CH2 3.96Å; N42-W196 HydrophobicContact CB-CZ2 4.32Å; N42-W196 HydrophobicContact CB-CZ3 3.71Å; N42-W196 VanDerWaalsContact N-CE3 3.33Å
43	V	98.1	Very high	98.1	Very high	51 Å²	51	26.6 Å²	26.6	31%	0.309	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-37.2	-170.8	177.7	0	0	0	0	112	L41 A155 L195 R197	L41-V43 PolarHBondContact O-N 3.41Å; V43-A155 HydrophobicContact CG2-CB 4.11Å; V43-L195 HydrophobicContact CB-CB 4.15Å; V43-L195 HydrophobicContact CG2-CB 4.16Å; V43-L195 PolarHBondContact N-O 2.93Å; V43-R197 HydrophobicContact CG2-CB 4.22Å
44	K	98.2	Very high	98.2	Very high	131 Å²	131	28.7 Å²	28.7	57%	0.57	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-43	-176.4	176.2	59.5	179.8	179	0	112.6	N42 Q192	N42-K44 PolarHBondContact O-N 2.93Å; N42-K44 PolarHBondContact OD1-N 2.66Å; K44-Q192 WeakPolarHBondContact CB-O 3.46Å
45	H	98.1	Very high	98.2	Very high	34 Å²	34	36 Å²	36	16%	0.157	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.1	-7.1	-171.4	-69.8	-74.5	0	0	0	114.3	N42 V47 I169 T170 H193	N42-H45 PolarHBondContact OD1-CD2 2.87Å; N42-H45 PolarHBondContact OD1-N 3.24Å; H45-V47 VanDerWaalsContact C-N 3.27Å; H45-V47 HydrophobicContact CB-CG2 4.03Å; H45-V47 PolarHBondContact O-N 3.08Å; H45-I169 HydrophobicContact CB-CG2 4.26Å; H45-I169 PolarHBondContact CD2-O 3.37Å; H45-I169 PolarHBondContact NE2-O 2.94Å; H45-T170 PolarHBondContact CE1-O 2.88Å; H45-T170 PolarHBondContact NE2-O 2.91Å; H45-H193 AromaticContact CD2-ND1 3.82Å; H45-H193 AromaticContact NE2-CE1 3.59Å; H45-H193 AromaticContact NE2-ND1 3.08Å; H45-H193 PolarHBondContact NE2-ND1 3.42Å
46	N	97.9	Very high	98.3	Very high	101 Å²	101	36 Å²	36	54%	0.54	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.5	43.9	179.5	-163.9	46.9	0	0	0	112.9	N42	N42-N46 WeakPolarHBondContact O-CA 3.46Å; N42-N46 PolarHBondContact O-N 3.46Å
47	V	98.6	Very high	98.3	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.006	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	148.9	176	-66.1	0	0	0	0	110.5	N42 H45 V68 T69 I169 R182	N42-V47 HydrophobicContact CB-CG2 4.16Å; N42-V47 PolarHBondContact N-O 3.22Å; H45-V47 VanDerWaalsContact C-N 3.27Å; H45-V47 HydrophobicContact CB-CG2 4.03Å; H45-V47 PolarHBondContact O-N 3.08Å; V47-V68 CarbonylContact C-O 3.59Å; V47-V68 VanDerWaalsContact CA-O 3.24Å; V47-V68 WeakPolarHBondContact CA-O 3.07Å; V47-V68 WeakPolarHBondContact CB-O 3.3Å; V47-T69 HydrophobicContact CG1-CG2 3.79Å; V47-I169 HydrophobicContact CG2-CD1 3.3Å; V47-R182 HydrophobicContact CG1-CG 4.32Å
48	R	98.8	Very high	98.3	Very high	14 Å²	14	41.3 Å²	41.3	5%	0.053	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	138.8	179	-70.5	160.6	-176.4	70.1	8.3	110.4	K39 L40 L41 H50 G67 V68 E200	K39-R48 HydrophobicContact CB-CG 4.43Å; L40-R48 CarbonylContact O-C 3.5Å; L40-R48 VanDerWaalsContact O-CA 3.3Å; L40-R48 WeakPolarHBondContact O-CA 3.33Å; L41-R48 HydrophobicContact CD1-CG 4.28Å; R48-H50 PolarHBondContact O-N 3.31Å; R48-G67 WeakPolarHBondContact O-CA 3.31Å; R48-V68 HydrophobicContact CB-CG2 4.38Å; R48-V68 PolarHBondContact N-O 2.77Å; R48-V68 PolarHBondContact O-N 3.37Å; R48-E200 IonicContact CZ-OE1 3.7Å; R48-E200 IonicContact CZ-OE2 2.71Å; R48-E200 IonicContact NE-OE1 3.23Å; R48-E200 IonicContact NE-OE2 3.89Å; R48-E200 PolarHBondContact NE-OE2 3.26Å; R48-E200 VanDerWaalsContact NH2-CD 3.35Å; R48-E200 IonicContact NH2-OE1 3.37Å; R48-E200 PolarHBondContact NH2-OE1 3.43Å; R48-E200 IonicContact NH2-OE2 3.66Å; R48-E200 PolarHBondContact NH2-OE2 3.2Å
49	L	98.9	Very high	98.3	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.1	128.5	170.1	-169.8	70.1	0	0	0	109.4	L40 V65 S76 W78 L111 L167 V184 W196	L40-L49 HydrophobicContact CB-CB 4.01Å; L40-L49 HydrophobicContact CD1-CD2 3.92Å; L40-L49 PolarHBondContact O-N 2.85Å; L49-V65 HydrophobicContact CD1-CG1 3.46Å; L49-V65 VanDerWaalsContact CD1-CG1 3.46Å; L49-V65 HydrophobicContact CG-CG1 4.18Å; L49-S76 WeakPolarHBondContact O-CA 3.49Å; L49-S76 WeakPolarHBondContact O-CB 3.5Å; L49-W78 HydrophobicContact CD2-CD2 3.96Å; L49-W78 HydrophobicContact CD2-CG 4.34Å; L49-W78 HydrophobicContact CD2-CH2 4.41Å; L49-W78 HydrophobicContact CD2-CZ2 3.82Å; L49-W78 HydrophobicContact CG-CZ2 3.74Å; L49-W78 PolarHBondContact O-NE1 3.44Å; L49-L111 HydrophobicContact CD2-CD1 4.24Å; L49-L111 HydrophobicContact CD2-CD2 4.2Å; L49-L167 HydrophobicContact CD1-CD2 4.49Å; L49-L167 HydrophobicContact CD2-CD2 4.37Å; L49-V184 HydrophobicContact CD1-CB 4.47Å; L49-V184 HydrophobicContact CD1-CG1 3.88Å; L49-V184 HydrophobicContact CD1-CG2 3.96Å; L49-W196 HydrophobicContact CB-CH2 4.44Å; L49-W196 HydrophobicContact CB-CZ3 3.94Å; L49-W196 HydrophobicContact CD1-CH2 4.03Å; L49-W196 HydrophobicContact CD1-CZ3 4.36Å
50	H	98.9	Very high	98.3	Very high	6 Å²	6	44.7 Å²	44.7	3%	0.028	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	143.7	-168.7	168	-102	0	0	0	110.8	R48 H52 V65 T66 V68 D73 N75 Q181	R48-H50 PolarHBondContact O-N 3.31Å; H50-H52 AromaticContact CE1-CE1 3.75Å; H50-H52 AromaticContact CE1-CG 3.76Å; H50-H52 AromaticContact CE1-ND1 2.89Å; H50-H52 PolarHBondContact CE1-ND1 2.98Å; H50-H52 AromaticContact ND1-CE1 3.86Å; H50-H52 AromaticContact ND1-ND1 3.23Å; H50-H52 PolarHBondContact ND1-ND1 3.49Å; H50-H52 AromaticContact NE2-ND1 3.88Å; H50-V65 WeakPolarHBondContact O-CA 3.36Å; H50-T66 PolarHBondContact N-O 2.67Å; H50-T66 PolarHBondContact ND1-OG1 3.07Å; H50-T66 PolarHBondContact O-N 2.92Å; H50-T66 PolarHBondContact O-OG1 2.89Å; H50-V68 HydrophobicContact CB-CB 4.32Å; H50-V68 HydrophobicContact CB-CG1 3.76Å; H50-V68 HydrophobicContact CB-CG2 3.74Å; H50-V68 VanDerWaalsContact CG-CG1 3.5Å; H50-V68 WeakPolarHBondContact ND1-CG1 3.29Å; H50-D73 IonicContact CD2-OD2 2.91Å; H50-D73 IonicContact NE2-OD2 3.82Å; H50-N75 WeakPolarHBondContact CA-O 3.4Å; H50-N75 WeakPolarHBondContact CD2-CB 3.38Å; H50-N75 PolarHBondContact CD2-O 3.15Å; H50-N75 VanDerWaalsContact CD2-O 3.29Å; H50-N75 WeakPolarHBondContact NE2-CB 3.38Å; H50-Q181 PolarHBondContact ND1-OE1 3.38Å
51	S	98.9	Very high	98.2	Very high	0 Å²	0	46 Å²	46	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	158	173.3	-171.5	0	0	0	0	110.2	Q63 S64 N75 H104	S51-Q63 PolarHBondContact OG-OE1 3.49Å; S51-S64 PolarHBondContact OG-O 2.82Å; S51-S64 VanDerWaalsContact OG-O 3.12Å; S51-N75 PolarHBondContact N-O 3.32Å; S51-N75 VanDerWaalsContact O-CB 3.29Å; S51-N75 WeakPolarHBondContact O-CB 3.45Å; S51-H104 PolarHBondContact O-CE1 2.9Å; S51-H104 PolarHBondContact O-NE2 3.45Å
52	H	98.6	Very high	98.2	Very high	17 Å²	17	47.2 Å²	47.2	8%	0.079	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.1	173.9	-175.5	49.6	-91.8	0	0	0	109.6	H50 V54 Q63 S64 I178 Q181	H50-H52 AromaticContact CE1-CE1 3.75Å; H50-H52 AromaticContact CE1-CG 3.76Å; H50-H52 AromaticContact CE1-ND1 2.89Å; H50-H52 PolarHBondContact CE1-ND1 2.98Å; H50-H52 AromaticContact ND1-CE1 3.86Å; H50-H52 AromaticContact ND1-ND1 3.23Å; H50-H52 PolarHBondContact ND1-ND1 3.49Å; H50-H52 AromaticContact NE2-ND1 3.88Å; H52-V54 WeakPolarHBondContact CD2-CB 3.33Å; H52-V54 VanDerWaalsContact CD2-CG2 3.42Å; H52-V54 WeakPolarHBondContact CD2-CG2 3.45Å; H52-V54 PolarHBondContact CD2-N 3.32Å; H52-V54 WeakPolarHBondContact NE2-CB 3.25Å; H52-V54 PolarHBondContact O-N 2.87Å; H52-Q63 WeakPolarHBondContact O-CG 3.42Å; H52-Q63 PolarHBondContact O-NE2 2.86Å; H52-S64 PolarHBondContact NE2-OG 2.86Å; H52-I178 WeakPolarHBondContact NE2-CG2 3.44Å; H52-Q181 PolarHBondContact CE1-OE1 2.73Å
53	D	97.4	Very high	98.2	Very high	134 Å²	134	47.4 Å²	47.4	72%	0.717	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80	55.4	-178.7	-162.4	27.9	0	0	0	113.5
54	V	98.2	Very high	98.3	Very high	45 Å²	45	45.1 Å²	45.1	27%	0.273	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	143	166.4	176.3	0	0	0	0	107	H52 S64 P177 I178	H52-V54 WeakPolarHBondContact CD2-CB 3.33Å; H52-V54 VanDerWaalsContact CD2-CG2 3.42Å; H52-V54 WeakPolarHBondContact CD2-CG2 3.45Å; H52-V54 PolarHBondContact CD2-N 3.32Å; H52-V54 WeakPolarHBondContact NE2-CB 3.25Å; H52-V54 PolarHBondContact O-N 2.87Å; V54-S64 PolarHBondContact O-N 3.47Å; V54-S64 PolarHBondContact O-OG 2.78Å; V54-P177 HydrophobicContact CG1-CG 4.28Å; V54-P177 HydrophobicContact CG2-CG 4.45Å; V54-I178 HydrophobicContact CG2-CG2 4.28Å
55	R	98.4	Very high	98.3	Very high	160 Å²	160	38.9 Å²	38.9	60%	0.604	24%	0.236	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-107.8	154.2	179.2	-63.5	-176.3	-180	-158.7	-0.1	110.4	Q62	R55-Q62 CarbonylContact C-O 3.59Å; R55-Q62 VanDerWaalsContact CA-O 3.3Å; R55-Q62 WeakPolarHBondContact CA-O 3.42Å
56	Y	98.3	Very high	98.3	Very high	16 Å²	16	37.2 Å²	37.2	6%	0.063	23%	0.229	C	C	.	.			trans	-62.9	140.1	168.9	-63.7	-48.5	0	0	0	110.6	S58 G61 Q62 V65 P119 E125 V126 Y174	Y56-S58 VanDerWaalsContact C-N 3.29Å; Y56-S58 WeakPolarHBondContact CB-O 3.22Å; Y56-G61 WeakPolarHBondContact O-CA 3.13Å; Y56-Q62 PolarHBondContact N-O 2.84Å; Y56-V65 PolarHBondContact OH-N 3.31Å; Y56-V65 PolarHBondContact OH-O 3.16Å; Y56-V65 VanDerWaalsContact OH-O 3.06Å; Y56-P119 HydrophobicContact CD1-CG 3.47Å; Y56-P119 VanDerWaalsContact CD1-CG 3.47Å; Y56-P119 HydrophobicContact CE1-CG 3.71Å; Y56-P119 HydrophobicContact CG-CG 3.93Å; Y56-E125 HydrophobicContact CD2-CG 4.09Å; Y56-E125 HydrophobicContact CE2-CG 3.75Å; Y56-V126 WeakPolarHBondContact CE2-O 3.4Å; Y56-V126 PolarHBondContact OH-O 2.81Å; Y56-Y174 WeakPolarHBondContact CE1-OH 2.97Å
57	G	97.1	Very high	98.4	Very high	92 Å²	92	32.5 Å²	32.5	95%	0.948	20%	0.204	S	C	*	.	S	Bend	trans	-86.2	-2.3	171.6	0	0	0	0	0	113.5
58	S	97.1	Very high	98.4	Very high	54 Å²	54	32.8 Å²	32.8	38%	0.378	21%	0.206	S	C	.	.	S	Bend	trans	-138.8	-177.5	-178.8	61.7	0	0	0	0	109.6	Y56 S60 G61	Y56-S58 VanDerWaalsContact C-N 3.29Å; Y56-S58 WeakPolarHBondContact CB-O 3.22Å; S58-S60 PolarHBondContact O-N 2.81Å; S58-G61 PolarHBondContact O-N 3Å
59	G	97.8	Very high	98.3	Very high	39 Å²	39	36.9 Å²	36.9	40%	0.402	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.4	-127.7	177.7	0	0	0	0	0	111	E125	G59-E125 WeakPolarHBondContact CA-OE2 3.33Å
60	S	98.3	Very high	98.3	Very high	32 Å²	32	40.5 Å²	40.5	22%	0.224	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-16.2	-178.4	72.2	0	0	0	0	114.6	S58 Q62 H114 E125	S58-S60 PolarHBondContact O-N 2.81Å; S60-Q62 PolarHBondContact O-N 3.23Å; S60-Q62 VanDerWaalsContact OG-CB 3.31Å; S60-Q62 WeakPolarHBondContact OG-CB 3.42Å; S60-Q62 VanDerWaalsContact OG-CG 3.22Å; S60-Q62 WeakPolarHBondContact OG-CG 3.28Å; S60-Q62 PolarHBondContact OG-N 2.71Å; S60-H114 WeakPolarHBondContact CB-CE1 3.19Å; S60-H114 PolarHBondContact OG-CE1 3.22Å; S60-E125 VanDerWaalsContact CB-OE1 3.22Å; S60-E125 WeakPolarHBondContact CB-OE1 3.5Å; S60-E125 PolarHBondContact N-OE2 2.94Å; S60-E125 PolarHBondContact OG-OE1 2.9Å
61	G	98.4	Very high	98.2	Very high	28 Å²	28	43 Å²	43	29%	0.289	27%	0.27	S	S	.	.			trans	70.6	11.8	-172	0	0	0	0	0	114.9	Y56 S58	Y56-G61 WeakPolarHBondContact O-CA 3.13Å; S58-G61 PolarHBondContact O-N 3Å
62	Q	98.6	Very high	98.1	Very high	36 Å²	36	50.5 Å²	50.5	17%	0.168	31%	0.305	C	S	.	.			trans	-74.7	175	177	-67.5	175.9	-1.4	0	0	112.3	R55 Y56 S60 S64 H112 H114 S127 F129	R55-Q62 CarbonylContact C-O 3.59Å; R55-Q62 VanDerWaalsContact CA-O 3.3Å; R55-Q62 WeakPolarHBondContact CA-O 3.42Å; Y56-Q62 PolarHBondContact N-O 2.84Å; S60-Q62 PolarHBondContact O-N 3.23Å; S60-Q62 VanDerWaalsContact OG-CB 3.31Å; S60-Q62 WeakPolarHBondContact OG-CB 3.42Å; S60-Q62 VanDerWaalsContact OG-CG 3.22Å; S60-Q62 WeakPolarHBondContact OG-CG 3.28Å; S60-Q62 PolarHBondContact OG-N 2.71Å; Q62-S64 PolarHBondContact O-N 3.46Å; Q62-H112 PolarHBondContact OE1-CD2 2.91Å; Q62-H114 PolarHBondContact OE1-CE1 2.99Å; Q62-S127 PolarHBondContact OE1-OG 2.96Å; Q62-F129 HydrophobicContact CG-CD2 4.33Å; Q62-F129 VanDerWaalsContact NE2-CD2 3.26Å
63	Q	98.8	Very high	98	Very high	5 Å²	5	51.6 Å²	51.6	2%	0.023	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	134.7	177.8	178.4	173.5	93.2	0	0	110.3	S51 H52 T107 S127 A128	S51-Q63 PolarHBondContact OG-OE1 3.49Å; H52-Q63 WeakPolarHBondContact O-CG 3.42Å; H52-Q63 PolarHBondContact O-NE2 2.86Å; Q63-T107 PolarHBondContact OE1-OG1 2.97Å; Q63-S127 WeakPolarHBondContact O-CA 3.43Å; Q63-A128 HydrophobicContact CB-CB 4Å; Q63-A128 WeakPolarHBondContact CB-O 3.39Å; Q63-A128 HydrophobicContact CG-CB 4.02Å; Q63-A128 PolarHBondContact O-N 2.93Å
64	S	98.8	Very high	98	Very high	2 Å²	2	48.1 Å²	48.1	1%	0.014	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	142.9	-175.1	51.3	0	0	0	0	112.3	S51 H52 V54 Q62	S51-S64 PolarHBondContact OG-O 2.82Å; S51-S64 VanDerWaalsContact OG-O 3.12Å; H52-S64 PolarHBondContact NE2-OG 2.86Å; V54-S64 PolarHBondContact O-N 3.47Å; V54-S64 PolarHBondContact O-OG 2.78Å; Q62-S64 PolarHBondContact O-N 3.46Å
65	V	98.9	Very high	98.1	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	135	170.8	176.6	0	0	0	0	108.3	L49 H50 Y56 W78 L111 V126 S127 A128 V184	L49-V65 HydrophobicContact CD1-CG1 3.46Å; L49-V65 VanDerWaalsContact CD1-CG1 3.46Å; L49-V65 HydrophobicContact CG-CG1 4.18Å; H50-V65 WeakPolarHBondContact O-CA 3.36Å; Y56-V65 PolarHBondContact OH-N 3.31Å; Y56-V65 PolarHBondContact OH-O 3.16Å; Y56-V65 VanDerWaalsContact OH-O 3.06Å; V65-W78 HydrophobicContact CG1-CH2 4.49Å; V65-W78 HydrophobicContact CG1-CZ2 4.41Å; V65-W78 HydrophobicContact CG2-CH2 4.18Å; V65-L111 HydrophobicContact CG1-CD1 3.91Å; V65-L111 HydrophobicContact CG2-CD1 4.16Å; V65-V126 HydrophobicContact CB-CG1 4.34Å; V65-V126 HydrophobicContact CG1-CG1 4.31Å; V65-S127 WeakPolarHBondContact CG2-O 3.44Å; V65-A128 HydrophobicContact CG2-CB 3.84Å; V65-V184 HydrophobicContact CG1-CB 4.12Å; V65-V184 HydrophobicContact CG1-CG1 4.05Å; V65-V184 HydrophobicContact CG1-CG2 4.38Å
66	T	98.9	Very high	98.1	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	169.1	-166.2	57.4	0	0	0	0	111.2	H50 Y174 I178 Q181 R182 V184	H50-T66 PolarHBondContact N-O 2.67Å; H50-T66 PolarHBondContact ND1-OG1 3.07Å; H50-T66 PolarHBondContact O-N 2.92Å; H50-T66 PolarHBondContact O-OG1 2.89Å; T66-Y174 HydrophobicContact CG2-CD2 4.12Å; T66-Y174 HydrophobicContact CG2-CE2 3.83Å; T66-I178 HydrophobicContact CG2-CD1 3.96Å; T66-Q181 HydrophobicContact CG2-CB 4.32Å; T66-Q181 PolarHBondContact OG1-OE1 3.43Å; T66-R182 CarbonylContact C-O 3.56Å; T66-R182 VanDerWaalsContact CA-O 3.29Å; T66-R182 WeakPolarHBondContact CA-O 3.45Å; T66-V184 WeakPolarHBondContact O-CG2 3.45Å
67	G	98.8	Very high	98.1	Very high	1 Å²	1	43 Å²	43	1%	0.01	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	126.1	170.3	0	0	0	0	0	111.7	R48 R182	R48-G67 WeakPolarHBondContact O-CA 3.31Å; G67-R182 PolarHBondContact N-O 3.48Å; G67-R182 PolarHBondContact O-N 3.41Å
68	V	98.6	Very high	98.2	Very high	8 Å²	8	38.6 Å²	38.6	5%	0.048	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	146.5	176.7	-59.5	0	0	0	0	112.5	V47 R48 H50 S76 Q181	V47-V68 CarbonylContact C-O 3.59Å; V47-V68 VanDerWaalsContact CA-O 3.24Å; V47-V68 WeakPolarHBondContact CA-O 3.07Å; V47-V68 WeakPolarHBondContact CB-O 3.3Å; R48-V68 HydrophobicContact CB-CG2 4.38Å; R48-V68 PolarHBondContact N-O 2.77Å; R48-V68 PolarHBondContact O-N 3.37Å; H50-V68 HydrophobicContact CB-CB 4.32Å; H50-V68 HydrophobicContact CB-CG1 3.76Å; H50-V68 HydrophobicContact CB-CG2 3.74Å; H50-V68 VanDerWaalsContact CG-CG1 3.5Å; H50-V68 WeakPolarHBondContact ND1-CG1 3.29Å; V68-S76 WeakPolarHBondContact CG2-OG 3.32Å; V68-Q181 HydrophobicContact CG1-CG 3.94Å
69	T	97.9	Very high	98.3	Very high	99 Å²	99	37.3 Å²	37.3	61%	0.607	22%	0.223	S	C	*	.			trans	-82.6	-21.8	175.1	49.7	0	0	0	0	112.8	V47 V71	V47-T69 HydrophobicContact CG1-CG2 3.79Å; T69-V71 PolarHBondContact O-N 2.02Å
70	T	97.5	Very high	98.3	Very high	77 Å²	77	35.4 Å²	35.4	47%	0.472	20%	0.204	S	C	.	.			trans	-60	118.6	-179.5	-50	0	0	0	0	110.8	D73	T70-D73 HydrophobicContact CG2-CB 4.08Å
71	V	96.8	Very high	98.3	Very high	57 Å²	57	38.7 Å²	38.7	35%	0.345	21%	0.211	S	C	.	.	S	Bend	trans	-72.7	-44.8	-177.1	179.6	0	0	0	0	111.2	K39 T69 D73	K39-V71 PolarHBondContact NZ-O 3.1Å; T69-V71 PolarHBondContact O-N 2.02Å; V71-D73 VanDerWaalsContact C-N 3.29Å; V71-D73 PolarHBondContact O-N 3.41Å
72	E	96.4	Very high	98.2	Very high	159 Å²	159	38 Å²	38	74%	0.743	20%	0.204	S	C	*	.	S	Bend	trans	-85.7	7.9	-170.5	-58.1	-54.3	145.3	0	0	114.5	S74	E72-S74 PolarHBondContact O-N 3.34Å
73	D	97.6	Very high	98.1	Very high	39 Å²	39	36.8 Å²	36.8	21%	0.209	20%	0.199	C	C	.	.			trans	-69.2	127.9	-176.9	-159.5	-33.7	0	0	0	111.1	K39 H50 T70 V71 N75 S76	K39-D73 PolarHBondContact NZ-O 2.8Å; H50-D73 IonicContact CD2-OD2 2.91Å; H50-D73 IonicContact NE2-OD2 3.82Å; T70-D73 HydrophobicContact CG2-CB 4.08Å; V71-D73 VanDerWaalsContact C-N 3.29Å; V71-D73 PolarHBondContact O-N 3.41Å; D73-N75 VanDerWaalsContact C-N 3.31Å; D73-N75 VanDerWaalsContact OD1-CB 3.29Å; D73-N75 WeakPolarHBondContact OD1-CB 3.44Å; D73-N75 PolarHBondContact OD1-N 3.3Å; D73-S76 PolarHBondContact O-N 2.86Å
74	S	97.9	Very high	97.6	Very high	62 Å²	62	39.7 Å²	39.7	43%	0.434	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-74.8	-23.1	177.8	64.3	0	0	0	0	112.4	E72 S76 Y77 N106	E72-S74 PolarHBondContact O-N 3.34Å; S74-S76 PolarHBondContact O-N 3.36Å; S74-S76 VanDerWaalsContact O-N 3.15Å; S74-Y77 WeakPolarHBondContact O-CD2 3.13Å; S74-Y77 PolarHBondContact O-N 3.48Å; S74-N106 PolarHBondContact O-ND2 3.19Å; S74-N106 PolarHBondContact OG-ND2 3.01Å
75	N	98.7	Very high	97.1	Very high	44 Å²	44	43.2 Å²	43.2	24%	0.235	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-75.1	7.5	174	-74.3	-33.1	0	0	0	113.4	H50 S51 D73 H104 N106	H50-N75 WeakPolarHBondContact CA-O 3.4Å; H50-N75 WeakPolarHBondContact CD2-CB 3.38Å; H50-N75 PolarHBondContact CD2-O 3.15Å; H50-N75 VanDerWaalsContact CD2-O 3.29Å; H50-N75 WeakPolarHBondContact NE2-CB 3.38Å; S51-N75 PolarHBondContact N-O 3.32Å; S51-N75 VanDerWaalsContact O-CB 3.29Å; S51-N75 WeakPolarHBondContact O-CB 3.45Å; D73-N75 VanDerWaalsContact C-N 3.31Å; D73-N75 VanDerWaalsContact OD1-CB 3.29Å; D73-N75 WeakPolarHBondContact OD1-CB 3.44Å; D73-N75 PolarHBondContact OD1-N 3.3Å; N75-H104 WeakPolarHBondContact CA-NE2 3.29Å; N75-H104 PolarHBondContact O-NE2 3.12Å; N75-N106 PolarHBondContact OD1-ND2 2.77Å
76	S	98.8	Very high	96.8	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-102.9	4	172.1	-63.8	0	0	0	0	113.4	K39 L49 V68 D73 S74	K39-S76 WeakPolarHBondContact CA-O 3.5Å; K39-S76 WeakPolarHBondContact CG-O 3.44Å; L49-S76 WeakPolarHBondContact O-CA 3.49Å; L49-S76 WeakPolarHBondContact O-CB 3.5Å; V68-S76 WeakPolarHBondContact CG2-OG 3.32Å; D73-S76 PolarHBondContact O-N 2.86Å; S74-S76 PolarHBondContact O-N 3.36Å; S74-S76 VanDerWaalsContact O-N 3.15Å
77	Y	98.8	Very high	96.4	Very high	69 Å²	69	54.4 Å²	54.4	27%	0.271	32%	0.319	S	S	.	.			trans	-86.2	128.2	177.8	-75.9	-64.1	0	0	0	112.4	V37 K39 S74 H104 V105 E200	V37-Y77 HydrophobicContact CG1-CD1 3.68Å; V37-Y77 HydrophobicContact CG1-CG 4.01Å; K39-Y77 HydrophobicContact CD-CE1 4.37Å; K39-Y77 VanDerWaalsContact CE-CE1 3.47Å; K39-Y77 WeakPolarHBondContact CE-OH 3.41Å; K39-Y77 HydrophobicContact CG-CD1 3.9Å; K39-Y77 HydrophobicContact CG-CE1 3.93Å; S74-Y77 WeakPolarHBondContact O-CD2 3.13Å; S74-Y77 PolarHBondContact O-N 3.48Å; Y77-H104 PolarHBondContact O-CD2 3.21Å; Y77-V105 WeakPolarHBondContact O-CG2 3.4Å; Y77-V105 PolarHBondContact O-N 3.19Å; Y77-E200 VanDerWaalsContact CE1-O 3.25Å; Y77-E200 WeakPolarHBondContact CE1-O 3.37Å
78	W	98.9	Very high	96.1	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	126.9	178	-61.7	82.4	0	0	0	110.1	V37 V38 L49 V65 L102 T103 H104 L111	V37-W78 WeakPolarHBondContact CA-O 3.2Å; V38-W78 PolarHBondContact N-O 3.48Å; V38-W78 PolarHBondContact O-N 3.29Å; L49-W78 HydrophobicContact CD2-CD2 3.96Å; L49-W78 HydrophobicContact CD2-CG 4.34Å; L49-W78 HydrophobicContact CD2-CH2 4.41Å; L49-W78 HydrophobicContact CD2-CZ2 3.82Å; L49-W78 HydrophobicContact CG-CZ2 3.74Å; L49-W78 PolarHBondContact O-NE1 3.44Å; V65-W78 HydrophobicContact CG1-CH2 4.49Å; V65-W78 HydrophobicContact CG1-CZ2 4.41Å; V65-W78 HydrophobicContact CG2-CH2 4.18Å; W78-L102 HydrophobicContact CE3-CB 4.11Å; W78-T103 CarbonylContact C-O 3.37Å; W78-T103 WeakPolarHBondContact CA-O 3.43Å; W78-H104 HydrophobicContact CD2-CB 4.37Å; W78-H104 HydrophobicContact CE3-CB 3.9Å; W78-H104 HydrophobicContact CH2-CB 3.89Å; W78-H104 HydrophobicContact CZ2-CB 4.33Å; W78-H104 HydrophobicContact CZ3-CB 3.65Å; W78-L111 HydrophobicContact CE3-CB 4.4Å; W78-L111 HydrophobicContact CH2-CB 4.44Å; W78-L111 HydrophobicContact CH2-CD1 4.04Å; W78-L111 HydrophobicContact CZ3-CB 3.81Å; W78-L111 HydrophobicContact CZ3-CD1 4.25Å
79	S	98.5	Very high	95.9	Very high	26 Å²	26	62.8 Å²	62.8	18%	0.182	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	127.2	173.5	-178.9	0	0	0	0	110.4	T103	S79-T103 PolarHBondContact N-O 2.92Å; S79-T103 PolarHBondContact O-N 3.03Å
80	V	98.4	Very high	95.7	Very high	0 Å²	0	66.5 Å²	66.5	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	116.9	175	-179.6	0	0	0	0	109.3	V32 G35 S36 V38 I94 I100 L102 W150	V32-V80 HydrophobicContact CG1-CG2 4.1Å; G35-V80 WeakPolarHBondContact CA-O 3.32Å; G35-V80 PolarHBondContact N-O 3.07Å; S36-V80 PolarHBondContact O-N 2.81Å; V38-V80 HydrophobicContact CG2-CG2 4.05Å; V80-I94 HydrophobicContact CG1-CD1 4Å; V80-I94 HydrophobicContact CG1-CG1 3.91Å; V80-I100 HydrophobicContact CG1-CD1 4.02Å; V80-L102 HydrophobicContact CG2-CD2 4.06Å; V80-W150 HydrophobicContact CG1-CZ3 4.49Å; V80-W150 HydrophobicContact CG2-CH2 4.49Å; V80-W150 HydrophobicContact CG2-CZ3 4.21Å
81	R	97.6	Very high	95.5	Very high	100 Å²	100	62.9 Å²	62.9	38%	0.377	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	159.9	-177.5	-62.5	-179.5	70.5	157.1	-6.6	111.5	I100 R101 T103	R81-I100 WeakPolarHBondContact O-CA 3.42Å; R81-I100 WeakPolarHBondContact O-CB 3.24Å; R81-R101 HydrophobicContact CB-CB 4.45Å; R81-R101 PolarHBondContact N-O 2.89Å; R81-R101 PolarHBondContact O-N 2.87Å; R81-T103 WeakPolarHBondContact CD-OG1 3.33Å
82	G	96.7	Very high	95.4	Very high	14 Å²	14	62.3 Å²	62.3	14%	0.144	34%	0.338	C	S	.	.			trans	-71.4	169.1	167.1	0	0	0	0	0	111	C88	G82-C88 WeakPolarHBondContact CA-SG 3.34Å; G82-C88 PolarHBondContact N-SG 2.95Å
83	T	95.9	Very high	95.4	Very high	10 Å²	10	56.8 Å²	56.8	6%	0.061	32%	0.316	C	S	.	.			trans	-81.1	170.8	175.1	69.5	0	0	0	0	111.1	G85 A86 Q87 T99 E140	T83-G85 VanDerWaalsContact C-N 3.27Å; T83-G85 PolarHBondContact O-N 3.15Å; T83-A86 PolarHBondContact N-O 2.97Å; T83-A86 CarbonylContact O-C 3.48Å; T83-A86 VanDerWaalsContact O-C 3.31Å; T83-A86 PolarHBondContact O-N 2.9Å; T83-A86 PolarHBondContact OG1-N 2.78Å; T83-Q87 PolarHBondContact O-N 2.03Å; T83-T99 HydrophobicContact CG2-CG2 3.77Å; T83-E140 WeakPolarHBondContact CB-OE1 3.21Å; T83-E140 HydrophobicContact CG2-CG 3.87Å
84	S	89.2	Confident	95.4	Very high	67 Å²	67	55 Å²	55	47%	0.469	31%	0.306	S	S	.	.	S	Bend	trans	-61.8	-35.9	174.1	-69	0	0	0	0	112.1	R101	S84-R101 VanDerWaalsContact OG-CZ 3.31Å; S84-R101 PolarHBondContact OG-NH1 2.96Å; S84-R101 PolarHBondContact OG-NH2 3.48Å
85	G	88.2	Confident	95.4	Very high	76 Å²	76	58.6 Å²	58.6	78%	0.784	31%	0.314	S	S	*	.	S	Bend	trans	-84	-19.3	178.7	0	0	0	0	0	114.8	T83	T83-G85 VanDerWaalsContact C-N 3.27Å; T83-G85 PolarHBondContact O-N 3.15Å
86	A	92.1	Very high	95.3	Very high	60 Å²	60	58 Å²	58	50%	0.496	31%	0.313	S	S	.	.	S	Bend	trans	-141.4	75.7	-178.4	0	0	0	0	0	110.3	T83	T83-A86 PolarHBondContact N-O 2.97Å; T83-A86 CarbonylContact O-C 3.48Å; T83-A86 VanDerWaalsContact O-C 3.31Å; T83-A86 PolarHBondContact O-N 2.9Å; T83-A86 PolarHBondContact OG1-N 2.78Å
87	Q	90.9	Very high	95.3	Very high	174 Å²	174	60.4 Å²	60.4	81%	0.813	34%	0.338	S	S	*	.			trans	-61.8	143.9	173.4	-65.2	-173.1	-0.4	0	0	110.4	T83	T83-Q87 PolarHBondContact O-N 2.03Å
88	C	92.5	Very high	95.3	Very high	30 Å²	30	59.2 Å²	59.2	20%	0.203	34%	0.335	C	S	.	.			trans	-117.3	147.3	173.4	54	0	0	0	0	111.2	C34 G82	C34-C88 HydrophobicContact CB-CB 3.71Å; C34-C88 WeakPolarHBondContact CB-SG 3.48Å; C34-C88 WeakPolarHBondContact SG-CB 3.47Å; C34-C88 PolarHBondContact SG-O 2.86Å; C34-C88 CovalentContact SG-SG 2.03Å; C34-C88 PolarHBondContact SG-SG 3.01Å; G82-C88 WeakPolarHBondContact CA-SG 3.34Å; G82-C88 PolarHBondContact N-SG 2.95Å
89	H	93.8	Very high	95.3	Very high	155 Å²	155	61.1 Å²	61.1	72%	0.718	35%	0.347	S	S	*	.			trans	-79.6	142.6	176.3	-62.3	-59.9	0	0	0	110.8	C34 G91 T92	C34-H89 WeakPolarHBondContact CB-O 3.02Å; H89-G91 PolarHBondContact O-N 2.95Å; H89-T92 WeakPolarHBondContact O-CB 3.09Å; H89-T92 PolarHBondContact O-N 3.4Å; H89-T92 PolarHBondContact O-OG1 3.33Å
90	R	93.6	Very high	95.3	Very high	177 Å²	177	59.9 Å²	59.9	67%	0.668	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	131.4	175.2	-174.9	179.7	174.7	-178.4	-1.2	110.4	C34 T92 M204	C34-R90 CarbonylContact O-C 3.31Å; C34-R90 WeakPolarHBondContact O-CA 3.3Å; R90-T92 VanDerWaalsContact C-N 3.32Å; R90-M204 HydrophobicContact CG-CB 4.04Å; R90-M204 HydrophobicContact CG-CG 3.78Å; R90-M204 HydrophobicContact CG-SD 4.41Å; R90-M204 PolarHBondContact NE-SD 3.38Å; R90-M204 VanDerWaalsContact NH2-CE 3.31Å; R90-M204 PolarHBondContact NH2-SD 3.34Å
91	G	93.6	Very high	95.3	Very high	1 Å²	1	60.4 Å²	60.4	1%	0.01	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.7	-9.3	-177.2	0	0	0	0	0	114.7	T33 C34 H89 K205 P206	T33-G91 WeakPolarHBondContact CG2-O 3.38Å; C34-G91 PolarHBondContact O-N 2.82Å; H89-G91 PolarHBondContact O-N 2.95Å; G91-K205 WeakPolarHBondContact CA-O 3.39Å; G91-P206 WeakPolarHBondContact O-CA 3.06Å
92	T	95.3	Very high	95.4	Very high	45 Å²	45	55.7 Å²	55.7	28%	0.276	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-67.7	127.8	174	-61.7	0	0	0	0	110.1	T33 C34 H89 R90	T33-T92 CarbonylContact C-O 3.6Å; T33-T92 VanDerWaalsContact CA-O 3.22Å; T33-T92 WeakPolarHBondContact CA-O 3.4Å; T33-T92 WeakPolarHBondContact CB-O 3.48Å; C34-T92 PolarHBondContact N-O 3.23Å; H89-T92 WeakPolarHBondContact O-CB 3.09Å; H89-T92 PolarHBondContact O-N 3.4Å; H89-T92 PolarHBondContact O-OG1 3.33Å; R90-T92 VanDerWaalsContact C-N 3.32Å
93	P	96.3	Very high	95.5	Very high	44 Å²	44	55.4 Å²	55.4	29%	0.286	32%	0.318	S	S	.	.	B	Isolated β-bridge	trans	-58.3	137.4	176.2	-18.4	27.4	0	0	0	112	F31 K95 V149	F31-P93 HydrophobicContact CD2-CB 3.74Å; F31-P93 HydrophobicContact CD2-CG 4.04Å; F31-P93 HydrophobicContact CE2-CB 3.78Å; F31-P93 HydrophobicContact CE2-CG 3.53Å; F31-P93 HydrophobicContact CZ-CG 4.08Å; P93-K95 PolarHBondContact O-N 2.84Å; P93-V149 HydrophobicContact CB-CG1 4.02Å
94	I	97.7	Very high	95.6	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-79.6	120	173.1	-57.1	-56.8	0	0	0	109	V32 C34 V80 Q98 I100 V143 V149 W150	V32-I94 PolarHBondContact O-N 2.79Å; C34-I94 HydrophobicContact CB-CD1 3.96Å; V80-I94 HydrophobicContact CG1-CD1 4Å; V80-I94 HydrophobicContact CG1-CG1 3.91Å; I94-Q98 HydrophobicContact CG2-CB 4.26Å; I94-I100 HydrophobicContact CD1-CG2 4.1Å; I94-I100 HydrophobicContact CG2-CG2 3.96Å; I94-V143 HydrophobicContact CG2-CG2 4.08Å; I94-V149 CarbonylContact O-C 3.51Å; I94-V149 VanDerWaalsContact O-CA 3.28Å; I94-V149 WeakPolarHBondContact O-CA 3.38Å; I94-V149 WeakPolarHBondContact O-CB 3.4Å; I94-W150 HydrophobicContact CB-CB 4.44Å; I94-W150 HydrophobicContact CB-CE3 4.32Å; I94-W150 HydrophobicContact CG2-CE3 4.17Å; I94-W150 PolarHBondContact O-N 2.9Å
95	K	97.6	Very high	96	Very high	138 Å²	138	55 Å²	55	60%	0.6	31%	0.312	S	S	*	.	B	Isolated β-bridge	trans	-76.6	149.2	178.8	-62.9	177.9	-178.2	175.8	0	111.1	P93 G97 Q98 A148	P93-K95 PolarHBondContact O-N 2.84Å; K95-G97 PolarHBondContact O-N 3.06Å; K95-Q98 HydrophobicContact CB-CB 4.19Å; K95-Q98 WeakPolarHBondContact O-CB 3.39Å; K95-Q98 PolarHBondContact O-N 2.77Å; K95-A148 WeakPolarHBondContact CA-O 3.43Å
96	C	98	Very high	96.5	Very high	32 Å²	32	55.2 Å²	55.2	22%	0.216	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	136.4	166.6	-61.2	0	0	0	0	109.6	Q98 C145 G147 A148 V149	C96-Q98 VanDerWaalsContact C-N 3.27Å; C96-C145 WeakPolarHBondContact CA-SG 3.25Å; C96-C145 HydrophobicContact CB-CB 4.16Å; C96-C145 WeakPolarHBondContact CB-SG 3.26Å; C96-C145 WeakPolarHBondContact SG-CB 3.35Å; C96-C145 CovalentContact SG-SG 2.02Å; C96-C145 PolarHBondContact SG-SG 3.48Å; C96-G147 VanDerWaalsContact CB-O 3.3Å; C96-G147 WeakPolarHBondContact CB-O 3.49Å; C96-G147 VanDerWaalsContact SG-C 3.57Å; C96-G147 PolarHBondContact SG-O 3.06Å; C96-A148 PolarHBondContact N-O 3.05Å; C96-V149 VanDerWaalsContact SG-C 3.57Å
97	G	98.3	Very high	96.8	Very high	51 Å²	51	53.8 Å²	53.8	53%	0.526	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.2	0.1	-170.9	0	0	0	0	0	114.5	K95 V143	K95-G97 PolarHBondContact O-N 3.06Å; G97-V143 WeakPolarHBondContact CA-O 3.49Å; G97-V143 PolarHBondContact N-O 2.89Å
98	Q	98.4	Very high	97.2	Very high	43 Å²	43	46.2 Å²	46.2	20%	0.201	25%	0.249	C	C	.	.			trans	-76.6	134.5	175.3	-174.5	175.5	-28.4	0	0	110.9	I94 K95 C96 I100 V143	I94-Q98 HydrophobicContact CG2-CB 4.26Å; K95-Q98 HydrophobicContact CB-CB 4.19Å; K95-Q98 WeakPolarHBondContact O-CB 3.39Å; K95-Q98 PolarHBondContact O-N 2.77Å; C96-Q98 VanDerWaalsContact C-N 3.27Å; Q98-I100 HydrophobicContact CG-CG2 4.28Å; Q98-V143 PolarHBondContact O-N 2.76Å
99	T	98.6	Very high	97.5	Very high	41 Å²	41	47.1 Å²	47.1	25%	0.252	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	132.4	170	-48.4	0	0	0	0	110.3	T83 E140 W141 T142 A161	T83-T99 HydrophobicContact CG2-CG2 3.77Å; T99-E140 HydrophobicContact CG2-CB 3.64Å; T99-E140 HydrophobicContact CG2-CG 4.34Å; T99-W141 WeakPolarHBondContact CA-O 3.35Å; T99-T142 PolarHBondContact OG1-OG1 2.9Å; T99-A161 HydrophobicContact CG2-CB 4.15Å
100	I	98.6	Very high	97.7	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	171.3	-177.3	61.6	165.6	0	0	0	110.3	V80 R81 I94 Q98 L102 W141 V143 W150 F158	V80-I100 HydrophobicContact CG1-CD1 4.02Å; R81-I100 WeakPolarHBondContact O-CA 3.42Å; R81-I100 WeakPolarHBondContact O-CB 3.24Å; I94-I100 HydrophobicContact CD1-CG2 4.1Å; I94-I100 HydrophobicContact CG2-CG2 3.96Å; Q98-I100 HydrophobicContact CG-CG2 4.28Å; I100-L102 HydrophobicContact CD1-CD2 4.09Å; I100-L102 HydrophobicContact CD1-CG 4.24Å; I100-W141 WeakPolarHBondContact CG1-O 3.43Å; I100-W141 PolarHBondContact N-O 3.19Å; I100-W141 PolarHBondContact O-N 3.28Å; I100-V143 HydrophobicContact CD1-CG2 3.52Å; I100-V143 HydrophobicContact CG1-CG2 3.75Å; I100-V143 HydrophobicContact CG2-CG2 4.38Å; I100-W150 HydrophobicContact CD1-CZ3 4.04Å; I100-F158 HydrophobicContact CD1-CE1 4.23Å
101	R	98.6	Very high	98	Very high	11 Å²	11	31.3 Å²	31.3	4%	0.042	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	145.1	161.1	-67.3	-171.1	175.2	159.1	1	110.2	R81 S84 D136 D139	R81-R101 HydrophobicContact CB-CB 4.45Å; R81-R101 PolarHBondContact N-O 2.89Å; R81-R101 PolarHBondContact O-N 2.87Å; S84-R101 VanDerWaalsContact OG-CZ 3.31Å; S84-R101 PolarHBondContact OG-NH1 2.96Å; S84-R101 PolarHBondContact OG-NH2 3.48Å; R101-D136 PolarHBondContact NH2-O 3.14Å; R101-D139 HydrophobicContact CG-CB 4.25Å
102	L	98.8	Very high	98.2	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	107.7	171.6	-68.6	167.5	0	0	0	107.8	L40 W78 V80 I100 N110 L111 F158	L40-L102 HydrophobicContact CD1-CD1 3.64Å; L40-L102 HydrophobicContact CD1-CD2 4.2Å; W78-L102 HydrophobicContact CE3-CB 4.11Å; V80-L102 HydrophobicContact CG2-CD2 4.06Å; I100-L102 HydrophobicContact CD1-CD2 4.09Å; I100-L102 HydrophobicContact CD1-CG 4.24Å; L102-N110 CarbonylContact O-C 3.55Å; L102-N110 WeakPolarHBondContact O-CA 3.37Å; L102-L111 HydrophobicContact CB-CB 4.02Å; L102-L111 HydrophobicContact CB-CD2 4.44Å; L102-L111 HydrophobicContact CD1-CD2 3.79Å; L102-L111 PolarHBondContact O-N 2.71Å; L102-F158 HydrophobicContact CD1-CD1 4.23Å; L102-F158 HydrophobicContact CD1-CE1 4.26Å
103	T	98.8	Very high	98.4	Very high	8 Å²	8	29.3 Å²	29.3	5%	0.049	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	122.4	-178.6	-50.9	0	0	0	0	110	W78 S79 R81 V105 G108 R109 N110	W78-T103 CarbonylContact C-O 3.37Å; W78-T103 WeakPolarHBondContact CA-O 3.43Å; S79-T103 PolarHBondContact N-O 2.92Å; S79-T103 PolarHBondContact O-N 3.03Å; R81-T103 WeakPolarHBondContact CD-OG1 3.33Å; T103-V105 PolarHBondContact O-N 3.02Å; T103-G108 WeakPolarHBondContact CG2-O 3.37Å; T103-R109 CarbonylContact C-O 3.55Å; T103-R109 WeakPolarHBondContact CA-O 3Å; T103-N110 PolarHBondContact OG1-OD1 3.37Å
104	H	98.9	Very high	98.5	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	123.1	174.9	-176.9	-125.5	0	0	0	110	S51 N75 Y77 W78 N106 T107 G108 R109	S51-H104 PolarHBondContact O-CE1 2.9Å; S51-H104 PolarHBondContact O-NE2 3.45Å; N75-H104 WeakPolarHBondContact CA-NE2 3.29Å; N75-H104 PolarHBondContact O-NE2 3.12Å; Y77-H104 PolarHBondContact O-CD2 3.21Å; W78-H104 HydrophobicContact CD2-CB 4.37Å; W78-H104 HydrophobicContact CE3-CB 3.9Å; W78-H104 HydrophobicContact CH2-CB 3.89Å; W78-H104 HydrophobicContact CZ2-CB 4.33Å; W78-H104 HydrophobicContact CZ3-CB 3.65Å; H104-N106 PolarHBondContact O-N 3.4Å; H104-T107 PolarHBondContact ND1-N 2.84Å; H104-T107 PolarHBondContact ND1-OG1 2.75Å; H104-G108 WeakPolarHBondContact O-CA 3.41Å; H104-G108 PolarHBondContact O-N 2.73Å; H104-R109 WeakPolarHBondContact CB-O 3.43Å; H104-R109 PolarHBondContact N-O 3.3Å
105	V	98.6	Very high	98.5	Very high	68 Å²	68	36.8 Å²	36.8	41%	0.412	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-43.3	-168.6	170.4	0	0	0	0	112.3	V37 Y77 T103	V37-V105 HydrophobicContact CG1-CG2 3.75Å; V37-V105 HydrophobicContact CG2-CG2 4.41Å; Y77-V105 WeakPolarHBondContact O-CG2 3.4Å; Y77-V105 PolarHBondContact O-N 3.19Å; T103-V105 PolarHBondContact O-N 3.02Å
106	N	98.5	Very high	98.6	Very high	82 Å²	82	34.9 Å²	34.9	44%	0.439	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-26	-171.3	-70.4	-13.2	0	0	0	113.8	S74 N75 H104	S74-N106 PolarHBondContact O-ND2 3.19Å; S74-N106 PolarHBondContact OG-ND2 3.01Å; N75-N106 PolarHBondContact OD1-ND2 2.77Å; H104-N106 PolarHBondContact O-N 3.4Å
107	T	98.5	Very high	98.6	Very high	30 Å²	30	36.9 Å²	36.9	18%	0.184	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.6	-8.1	-179.3	64.8	0	0	0	0	113.3	Q63 H104 R109	Q63-T107 PolarHBondContact OE1-OG1 2.97Å; H104-T107 PolarHBondContact ND1-N 2.84Å; H104-T107 PolarHBondContact ND1-OG1 2.75Å; T107-R109 PolarHBondContact O-N 2.94Å; T107-R109 VanDerWaalsContact O-N 3.12Å
108	G	98.4	Very high	98.6	Very high	15 Å²	15	34.6 Å²	34.6	16%	0.155	18%	0.176	C	C	.	.			trans	67	6.5	-176.1	0	0	0	0	0	114.2	T103 H104 E132 G133	T103-G108 WeakPolarHBondContact CG2-O 3.37Å; H104-G108 WeakPolarHBondContact O-CA 3.41Å; H104-G108 PolarHBondContact O-N 2.73Å; G108-E132 CarbonylContact O-C 3.57Å; G108-E132 PolarHBondContact O-N 3.48Å; G108-E132 VanDerWaalsContact O-N 3.14Å; G108-G133 PolarHBondContact O-N 3.41Å
109	R	98.8	Very high	98.6	Very high	49 Å²	49	34.3 Å²	34.3	19%	0.185	18%	0.178	C	C	.	.	P	Polyproline II helix	trans	-88.3	144.9	-176.4	-63.8	-172.1	174.7	-99.1	-22.6	111.7	T103 H104 T107 A128 F129 G130 E131	T103-R109 CarbonylContact C-O 3.55Å; T103-R109 WeakPolarHBondContact CA-O 3Å; H104-R109 WeakPolarHBondContact CB-O 3.43Å; H104-R109 PolarHBondContact N-O 3.3Å; T107-R109 PolarHBondContact O-N 2.94Å; T107-R109 VanDerWaalsContact O-N 3.12Å; R109-A128 HydrophobicContact CB-CB 3.81Å; R109-F129 CarbonylContact C-O 3.48Å; R109-F129 WeakPolarHBondContact CA-O 3.39Å; R109-F129 WeakPolarHBondContact CB-O 3.43Å; R109-G130 WeakPolarHBondContact CG-O 3.47Å; R109-G130 VanDerWaalsContact CZ-O 3.28Å; R109-G130 PolarHBondContact NH1-O 3.05Å; R109-E131 IonicContact CZ-OE2 3.51Å; R109-E131 IonicContact NH2-OE2 3.82Å; R109-E131 PolarHBondContact NH2-OE2 3.38Å
110	N	98.9	Very high	98.6	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	145.4	176.3	-65.7	-34.7	0	0	0	111.5	L102 T103 H112 A128 F129 G133 D139	L102-N110 CarbonylContact O-C 3.55Å; L102-N110 WeakPolarHBondContact O-CA 3.37Å; T103-N110 PolarHBondContact OG1-OD1 3.37Å; N110-H112 PolarHBondContact O-N 3.38Å; N110-A128 CarbonylContact O-C 3.12Å; N110-A128 VanDerWaalsContact O-CA 3.26Å; N110-A128 WeakPolarHBondContact O-CA 3.29Å; N110-F129 PolarHBondContact N-O 3.08Å; N110-F129 PolarHBondContact O-N 2.74Å; N110-G133 PolarHBondContact ND2-O 3.17Å; N110-G133 WeakPolarHBondContact OD1-CA 3.48Å; N110-G133 PolarHBondContact OD1-O 3.15Å; N110-D139 HydrophobicContact CB-CB 3.75Å; N110-D139 VanDerWaalsContact CB-CG 3.42Å; N110-D139 WeakPolarHBondContact CB-OD2 3.5Å; N110-D139 PolarHBondContact ND2-OD2 3Å
111	L	98.9	Very high	98.5	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	123.1	165.3	-172.9	70.1	0	0	0	108.7	L49 V65 W78 L102 V126 D139 W141 L167	L49-L111 HydrophobicContact CD2-CD1 4.24Å; L49-L111 HydrophobicContact CD2-CD2 4.2Å; V65-L111 HydrophobicContact CG1-CD1 3.91Å; V65-L111 HydrophobicContact CG2-CD1 4.16Å; W78-L111 HydrophobicContact CE3-CB 4.4Å; W78-L111 HydrophobicContact CH2-CB 4.44Å; W78-L111 HydrophobicContact CH2-CD1 4.04Å; W78-L111 HydrophobicContact CZ3-CB 3.81Å; W78-L111 HydrophobicContact CZ3-CD1 4.25Å; L102-L111 HydrophobicContact CB-CB 4.02Å; L102-L111 HydrophobicContact CB-CD2 4.44Å; L102-L111 HydrophobicContact CD1-CD2 3.79Å; L102-L111 PolarHBondContact O-N 2.71Å; L111-V126 HydrophobicContact CD1-CG1 3.46Å; L111-V126 VanDerWaalsContact CD1-CG1 3.46Å; L111-V126 HydrophobicContact CG-CG1 4.19Å; L111-D139 WeakPolarHBondContact O-CA 3.33Å; L111-W141 HydrophobicContact CD2-CD2 4.17Å; L111-W141 HydrophobicContact CD2-CZ2 3.94Å; L111-W141 HydrophobicContact CG-CZ2 3.86Å; L111-W141 PolarHBondContact O-NE1 2.87Å; L111-L167 HydrophobicContact CD2-CD1 4.21Å; L111-L167 HydrophobicContact CD2-CD2 3.95Å
112	H	98.9	Very high	98.4	Very high	3 Å²	3	41.1 Å²	41.1	1%	0.014	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	150.7	-167	-174	90	0	0	0	110.9	Q62 N110 H114 V126 S127 F129 D136 L138 D139	Q62-H112 PolarHBondContact OE1-CD2 2.91Å; N110-H112 PolarHBondContact O-N 3.38Å; H112-H114 AromaticContact CD2-CE1 3.94Å; H112-H114 AromaticContact CD2-ND1 3.77Å; H112-H114 AromaticContact NE2-ND1 3.54Å; H112-V126 WeakPolarHBondContact O-CA 3.44Å; H112-S127 PolarHBondContact N-O 3.42Å; H112-S127 PolarHBondContact O-N 2.81Å; H112-F129 HydrophobicContact CB-CB 3.52Å; H112-F129 AromaticContact CE1-CD1 3.61Å; H112-F129 AromaticContact CE1-CG 3.87Å; H112-F129 VanDerWaalsContact CG-CB 3.46Å; H112-F129 AromaticContact ND1-CD1 3.6Å; H112-F129 AromaticContact ND1-CG 3.81Å; H112-D136 IonicContact CE1-OD1 3.85Å; H112-D136 PolarHBondContact CE1-OD1 3.49Å; H112-D136 IonicContact ND1-OD1 3.41Å; H112-L138 WeakPolarHBondContact CA-O 3.46Å; H112-L138 WeakPolarHBondContact CE1-CB 3.34Å; H112-L138 PolarHBondContact ND1-O 3.15Å; H112-D139 IonicContact CE1-OD1 2.73Å; H112-D139 IonicContact CG-OD1 3.82Å; H112-D139 IonicContact ND1-OD1 3.49Å; H112-D139 PolarHBondContact ND1-OD1 3.29Å
113	S	98.9	Very high	98.4	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	154.3	171.2	-160.3	0	0	0	0	112.8	Q124 E125 L138 H160	S113-Q124 PolarHBondContact OG-NE2 3.28Å; S113-E125 PolarHBondContact OG-O 2.86Å; S113-L138 PolarHBondContact N-O 3.09Å; S113-L138 VanDerWaalsContact N-O 3.15Å; S113-L138 WeakPolarHBondContact O-CB 3.05Å; S113-H160 PolarHBondContact O-CE1 3.46Å; S113-H160 PolarHBondContact O-NE2 3.06Å
114	H	98.4	Very high	98.4	Very high	16 Å²	16	44.4 Å²	44.4	7%	0.074	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.1	174.8	-169.5	50.3	-168	0	0	0	110.6	S60 Q62 H112 F116 Q124 E125 L138	S60-H114 WeakPolarHBondContact CB-CE1 3.19Å; S60-H114 PolarHBondContact OG-CE1 3.22Å; Q62-H114 PolarHBondContact OE1-CE1 2.99Å; H112-H114 AromaticContact CD2-CE1 3.94Å; H112-H114 AromaticContact CD2-ND1 3.77Å; H112-H114 AromaticContact NE2-ND1 3.54Å; H114-F116 HydrophobicContact CB-CD2 4.43Å; H114-F116 AromaticContact CD2-CD2 3.72Å; H114-F116 AromaticContact CE1-CD2 3.7Å; H114-F116 AromaticContact CG-CD2 3.66Å; H114-F116 AromaticContact ND1-CD2 3.61Å; H114-F116 AromaticContact NE2-CD2 3.74Å; H114-F116 PolarHBondContact O-N 2.89Å; H114-Q124 WeakPolarHBondContact O-CG 3.49Å; H114-E125 IonicContact CD2-OE1 3.82Å; H114-E125 IonicContact CE1-OE1 3.52Å; H114-E125 IonicContact NE2-OE1 2.72Å; H114-E125 PolarHBondContact NE2-OE1 3.02Å; H114-L138 HydrophobicContact CB-CD1 4.3Å
115	Y	98	Very high	98.4	Very high	185 Å²	185	44.4 Å²	44.4	73%	0.725	24%	0.239	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-78.7	48.9	-177.5	-62.3	-69.1	0	0	0	113.9	T163	Y115-T163 HydrophobicContact CD1-CG2 4.49Å; Y115-T163 HydrophobicContact CE1-CG2 3.87Å; Y115-T163 HydrophobicContact CE2-CG2 3.94Å
116	F	98.6	Very high	98.4	Very high	99 Å²	99	41.1 Å²	41.1	43%	0.434	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	152.3	166.2	-76.9	-90.6	0	0	0	110.3	H114 E125	H114-F116 HydrophobicContact CB-CD2 4.43Å; H114-F116 AromaticContact CD2-CD2 3.72Å; H114-F116 AromaticContact CE1-CD2 3.7Å; H114-F116 AromaticContact CG-CD2 3.66Å; H114-F116 AromaticContact ND1-CD2 3.61Å; H114-F116 AromaticContact NE2-CD2 3.74Å; H114-F116 PolarHBondContact O-N 2.89Å; F116-E125 HydrophobicContact CB-CB 3.98Å; F116-E125 WeakPolarHBondContact O-CB 3.4Å; F116-E125 PolarHBondContact O-N 3.41Å
117	S	98.5	Very high	98.5	Very high	73 Å²	73	37.2 Å²	37.2	51%	0.51	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	131.2	173.9	-62.7	0	0	0	0	111	N123	S117-N123 CarbonylContact C-O 3.54Å; S117-N123 WeakPolarHBondContact CA-O 3.34Å
118	S	98.5	Very high	98.5	Very high	3 Å²	3	35.8 Å²	35.8	2%	0.021	19%	0.19	C	C	.	.			trans	-62.1	146.5	172.3	57.4	0	0	0	0	111.5	L120 S121 S122 N123 E183	S118-L120 PolarHBondContact O-N 3.37Å; S118-S121 PolarHBondContact OG-OG 2.82Å; S118-S122 PolarHBondContact O-N 3.2Å; S118-S122 PolarHBondContact OG-N 3.23Å; S118-N123 WeakPolarHBondContact CB-O 3.47Å; S118-N123 PolarHBondContact N-O 3.41Å; S118-N123 WeakPolarHBondContact OG-CA 3.41Å; S118-N123 PolarHBondContact OG-N 2.81Å; S118-N123 PolarHBondContact OG-O 2.82Å; S118-E183 WeakPolarHBondContact CB-OE1 3.33Å
119	P	97.4	Very high	98.5	Very high	38 Å²	38	38.1 Å²	38.1	25%	0.247	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-30.4	-165.4	-25.5	34.7	0	0	0	117.2	Y56 Y174 E183	Y56-P119 HydrophobicContact CD1-CG 3.47Å; Y56-P119 VanDerWaalsContact CD1-CG 3.47Å; Y56-P119 HydrophobicContact CE1-CG 3.71Å; Y56-P119 HydrophobicContact CG-CG 3.93Å; P119-Y174 HydrophobicContact CB-CE1 4.04Å; P119-Y174 HydrophobicContact CG-CE1 4.32Å; P119-E183 WeakPolarHBondContact CD-OE1 3.38Å; P119-E183 VanDerWaalsContact N-OE1 3.15Å
120	L	98.1	Very high	98.4	Very high	74 Å²	74	36.5 Å²	36.5	39%	0.387	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-110.1	-42.2	-171.5	-51.9	-173.7	0	0	0	112.3	S118 E172 Y174 E183	S118-L120 PolarHBondContact O-N 3.37Å; L120-E172 HydrophobicContact CB-CB 4Å; L120-E172 HydrophobicContact CB-CG 4.38Å; L120-E172 HydrophobicContact CD1-CB 3.9Å; L120-Y174 HydrophobicContact CD1-CD1 3.79Å; L120-Y174 HydrophobicContact CD1-CD2 4.35Å; L120-Y174 HydrophobicContact CD1-CE1 3.81Å; L120-Y174 HydrophobicContact CD1-CE2 4.38Å; L120-Y174 HydrophobicContact CD1-CG 4.06Å; L120-Y174 HydrophobicContact CD2-CD1 3.95Å; L120-Y174 HydrophobicContact CD2-CE1 3.87Å; L120-Y174 HydrophobicContact CG-CD1 4.03Å; L120-Y174 HydrophobicContact CG-CE1 3.67Å; L120-E183 WeakPolarHBondContact CA-OE1 3.38Å; L120-E183 WeakPolarHBondContact CB-OE1 3.41Å; L120-E183 HydrophobicContact CD1-CB 4.09Å; L120-E183 HydrophobicContact CG-CB 4.47Å; L120-E183 PolarHBondContact N-OE1 3.15Å
121	S	97.4	Very high	98.4	Very high	31 Å²	31	41.3 Å²	41.3	22%	0.217	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-5.7	-173.1	63	0	0	0	0	114.7	S118 N123 E183 H185	S118-S121 PolarHBondContact OG-OG 2.82Å; S121-N123 WeakPolarHBondContact CB-ND2 3.45Å; S121-N123 PolarHBondContact O-N 3.03Å; S121-N123 VanDerWaalsContact O-N 3.12Å; S121-N123 PolarHBondContact OG-ND2 2.9Å; S121-E183 WeakPolarHBondContact CB-OE2 3.39Å; S121-E183 PolarHBondContact N-OE1 3.49Å; S121-E183 PolarHBondContact N-OE2 2.87Å; S121-E183 VanDerWaalsContact N-OE2 3.13Å; S121-E183 PolarHBondContact OG-OE2 3.43Å; S121-H185 PolarHBondContact OG-CD2 3.3Å
122	S	97.5	Very high	98.2	Very high	90 Å²	90	48.9 Å²	48.9	63%	0.629	25%	0.252	S	S	*	.			trans	59.5	16.2	-177.1	-52.2	0	0	0	0	114.8	S118	S118-S122 PolarHBondContact O-N 3.2Å; S118-S122 PolarHBondContact OG-N 3.23Å
123	N	98.4	Very high	98	Very high	48 Å²	48	48.8 Å²	48.8	26%	0.257	25%	0.252	S	S	.	.	S	Bend	trans	-68.6	-176.4	163.5	-72	-57.1	0	0	0	111.1	S117 S118 S121 E125 H185	S117-N123 CarbonylContact C-O 3.54Å; S117-N123 WeakPolarHBondContact CA-O 3.34Å; S118-N123 WeakPolarHBondContact CB-O 3.47Å; S118-N123 PolarHBondContact N-O 3.41Å; S118-N123 WeakPolarHBondContact OG-CA 3.41Å; S118-N123 PolarHBondContact OG-N 2.81Å; S118-N123 PolarHBondContact OG-O 2.82Å; S121-N123 WeakPolarHBondContact CB-ND2 3.45Å; S121-N123 PolarHBondContact O-N 3.03Å; S121-N123 VanDerWaalsContact O-N 3.12Å; S121-N123 PolarHBondContact OG-ND2 2.9Å; N123-E125 PolarHBondContact O-N 2.83Å; N123-H185 HydrophobicContact CB-CB 3.99Å; N123-H185 PolarHBondContact ND2-CE1 2.93Å
124	Q	98.8	Very high	97.8	Very high	28 Å²	28	54.3 Å²	54.3	13%	0.131	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	130.1	176.8	-170.6	-178.1	-55.3	0	0	110.9	S113 H114 T163 H185 A186	S113-Q124 PolarHBondContact OG-NE2 3.28Å; H114-Q124 WeakPolarHBondContact O-CG 3.49Å; Q124-T163 PolarHBondContact NE2-OG1 2.84Å; Q124-T163 PolarHBondContact OE1-OG1 2.88Å; Q124-T163 VanDerWaalsContact OE1-OG1 3.1Å; Q124-H185 CarbonylContact O-C 3.6Å; Q124-H185 WeakPolarHBondContact O-CA 3.44Å; Q124-H185 WeakPolarHBondContact O-CB 3.13Å; Q124-A186 HydrophobicContact CB-CB 4.14Å; Q124-A186 WeakPolarHBondContact CB-O 3.36Å; Q124-A186 PolarHBondContact N-O 3.41Å; Q124-A186 VanDerWaalsContact N-O 3.14Å; Q124-A186 PolarHBondContact O-N 2.77Å
125	E	98.9	Very high	97.6	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	134.2	-178.4	-167.7	-170.7	87	0	0	111.5	Y56 G59 S60 S113 H114 F116 N123	Y56-E125 HydrophobicContact CD2-CG 4.09Å; Y56-E125 HydrophobicContact CE2-CG 3.75Å; G59-E125 WeakPolarHBondContact CA-OE2 3.33Å; S60-E125 VanDerWaalsContact CB-OE1 3.22Å; S60-E125 WeakPolarHBondContact CB-OE1 3.5Å; S60-E125 PolarHBondContact N-OE2 2.94Å; S60-E125 PolarHBondContact OG-OE1 2.9Å; S113-E125 PolarHBondContact OG-O 2.86Å; H114-E125 IonicContact CD2-OE1 3.82Å; H114-E125 IonicContact CE1-OE1 3.52Å; H114-E125 IonicContact NE2-OE1 2.72Å; H114-E125 PolarHBondContact NE2-OE1 3.02Å; F116-E125 HydrophobicContact CB-CB 3.98Å; F116-E125 WeakPolarHBondContact O-CB 3.4Å; F116-E125 PolarHBondContact O-N 3.41Å; N123-E125 PolarHBondContact O-N 2.83Å
126	V	98.9	Very high	97.6	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	130.9	166.1	173.5	0	0	0	0	108.1	Y56 V65 L111 H112 W141 L167 V184 H185 A186	Y56-V126 WeakPolarHBondContact CE2-O 3.4Å; Y56-V126 PolarHBondContact OH-O 2.81Å; V65-V126 HydrophobicContact CB-CG1 4.34Å; V65-V126 HydrophobicContact CG1-CG1 4.31Å; L111-V126 HydrophobicContact CD1-CG1 3.46Å; L111-V126 VanDerWaalsContact CD1-CG1 3.46Å; L111-V126 HydrophobicContact CG-CG1 4.19Å; H112-V126 WeakPolarHBondContact O-CA 3.44Å; V126-W141 HydrophobicContact CG2-CH2 4.01Å; V126-L167 HydrophobicContact CB-CD1 4.45Å; V126-L167 HydrophobicContact CG1-CD1 3.85Å; V126-L167 HydrophobicContact CG2-CD1 4.06Å; V126-V184 HydrophobicContact CB-CG1 4.18Å; V126-V184 HydrophobicContact CG1-CG1 4.01Å; V126-H185 VanDerWaalsContact CG2-C 3.44Å; V126-A186 HydrophobicContact CG2-CB 3.81Å
127	S	98.9	Very high	97.6	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	176	-172.8	58.1	0	0	0	0	110.8	Q62 Q63 V65 H112	Q62-S127 PolarHBondContact OE1-OG 2.96Å; Q63-S127 WeakPolarHBondContact O-CA 3.43Å; V65-S127 WeakPolarHBondContact CG2-O 3.44Å; H112-S127 PolarHBondContact N-O 3.42Å; H112-S127 PolarHBondContact O-N 2.81Å
128	A	98.8	Very high	97.6	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	119.6	167.6	0	0	0	0	0	109.9	Q63 V65 R109 N110	Q63-A128 HydrophobicContact CB-CB 4Å; Q63-A128 WeakPolarHBondContact CB-O 3.39Å; Q63-A128 HydrophobicContact CG-CB 4.02Å; Q63-A128 PolarHBondContact O-N 2.93Å; V65-A128 HydrophobicContact CG2-CB 3.84Å; R109-A128 HydrophobicContact CB-CB 3.81Å; N110-A128 CarbonylContact O-C 3.12Å; N110-A128 VanDerWaalsContact O-CA 3.26Å; N110-A128 WeakPolarHBondContact O-CA 3.29Å
129	F	98.6	Very high	97.6	Very high	64 Å²	64	47.6 Å²	47.6	28%	0.281	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	166.3	-171.8	-178.8	-104.6	0	0	0	112.2	Q62 R109 N110 H112	Q62-F129 HydrophobicContact CG-CD2 4.33Å; Q62-F129 VanDerWaalsContact NE2-CD2 3.26Å; R109-F129 CarbonylContact C-O 3.48Å; R109-F129 WeakPolarHBondContact CA-O 3.39Å; R109-F129 WeakPolarHBondContact CB-O 3.43Å; N110-F129 PolarHBondContact N-O 3.08Å; N110-F129 PolarHBondContact O-N 2.74Å; H112-F129 HydrophobicContact CB-CB 3.52Å; H112-F129 AromaticContact CE1-CD1 3.61Å; H112-F129 AromaticContact CE1-CG 3.87Å; H112-F129 VanDerWaalsContact CG-CB 3.46Å; H112-F129 AromaticContact ND1-CD1 3.6Å; H112-F129 AromaticContact ND1-CG 3.81Å
130	G	97.9	Very high	97.7	Very high	15 Å²	15	47.6 Å²	47.6	16%	0.155	25%	0.254	C	S	.	.	S	Bend	trans	78.7	-162.6	178.9	0	0	0	0	0	113.6	R109 E134	R109-G130 WeakPolarHBondContact CG-O 3.47Å; R109-G130 VanDerWaalsContact CZ-O 3.28Å; R109-G130 PolarHBondContact NH1-O 3.05Å; G130-E134 CarbonylContact C-O 3.54Å; G130-E134 WeakPolarHBondContact CA-O 3.42Å
131	E	97.2	Very high	97.7	Very high	101 Å²	101	44.1 Å²	44.1	47%	0.472	24%	0.236	S	C	.	.	B	Isolated β-bridge	trans	-156	138.1	-177.7	-163.7	61.7	-121.8	0	0	109.3	R109 G133 E134	R109-E131 IonicContact CZ-OE2 3.51Å; R109-E131 IonicContact NH2-OE2 3.82Å; R109-E131 PolarHBondContact NH2-OE2 3.38Å; E131-G133 PolarHBondContact O-N 2.78Å; E131-E134 PolarHBondContact N-O 3.47Å; E131-E134 WeakPolarHBondContact O-CA 3.4Å; E131-E134 WeakPolarHBondContact O-CB 3.13Å; E131-E134 PolarHBondContact O-N 2.99Å
132	E	95.8	Very high	97.8	Very high	158 Å²	158	43.9 Å²	43.9	74%	0.738	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	52	25.4	179.8	-62.3	-173.6	170.8	0	0	116.6	G108 E134	G108-E132 CarbonylContact O-C 3.57Å; G108-E132 PolarHBondContact O-N 3.48Å; G108-E132 VanDerWaalsContact O-N 3.14Å; E132-E134 VanDerWaalsContact C-N 3.27Å
133	G	93.4	Very high	97.8	Very high	2 Å²	2	39.6 Å²	39.6	2%	0.021	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.9	-2.6	-176.8	0	0	0	0	0	113.8	G108 N110 E131	G108-G133 PolarHBondContact O-N 3.41Å; N110-G133 PolarHBondContact ND2-O 3.17Å; N110-G133 WeakPolarHBondContact OD1-CA 3.48Å; N110-G133 PolarHBondContact OD1-O 3.15Å; E131-G133 PolarHBondContact O-N 2.78Å
134	E	95.4	Very high	97.8	Very high	116 Å²	116	40.3 Å²	40.3	54%	0.542	21%	0.205	S	C	.	.	B	Isolated β-bridge	trans	-85	140.5	171.3	-60.5	-54.4	139.4	0	0	110.7	G130 E131 E132	G130-E134 CarbonylContact C-O 3.54Å; G130-E134 WeakPolarHBondContact CA-O 3.42Å; E131-E134 PolarHBondContact N-O 3.47Å; E131-E134 WeakPolarHBondContact O-CA 3.4Å; E131-E134 WeakPolarHBondContact O-CB 3.13Å; E131-E134 PolarHBondContact O-N 2.99Å; E132-E134 VanDerWaalsContact C-N 3.27Å
135	G	95.5	Very high	97.8	Very high	32 Å²	32	40.2 Å²	40.2	33%	0.33	21%	0.207	S	C	.	.			trans	-180	-143.6	-176.4	0	0	0	0	0	109.4	D139	G135-D139 WeakPolarHBondContact CA-OD2 3.21Å
136	D	97.3	Very high	97.5	Very high	51 Å²	51	43.9 Å²	43.9	27%	0.273	24%	0.244	S	C	.	.			trans	-129	-164.9	-171.6	65.8	24.8	0	0	0	113.3	R101 H112 L138 D139	R101-D136 PolarHBondContact NH2-O 3.14Å; H112-D136 IonicContact CE1-OD1 3.85Å; H112-D136 PolarHBondContact CE1-OD1 3.49Å; H112-D136 IonicContact ND1-OD1 3.41Å; D136-L138 PolarHBondContact O-N 3.2Å; D136-L138 WeakPolarHBondContact OD1-CA 3.44Å; D136-L138 VanDerWaalsContact OD1-CB 3.23Å; D136-L138 WeakPolarHBondContact OD1-CB 3.4Å; D136-L138 PolarHBondContact OD1-N 2.83Å; D136-D139 PolarHBondContact N-OD2 2.86Å; D136-D139 WeakPolarHBondContact O-CB 3.49Å; D136-D139 PolarHBondContact O-N 2.91Å
137	H	97.8	Very high	97.3	Very high	113 Å²	113	45.9 Å²	45.9	52%	0.523	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-76.3	-8.3	-178.4	63.3	-76.7	0	0	0	112.9	D139 S162	H137-D139 VanDerWaalsContact C-N 3.27Å; H137-S162 PolarHBondContact CD2-OG 3.15Å; H137-S162 PolarHBondContact O-OG 3.42Å
138	L	98.6	Very high	97.1	Very high	38 Å²	38	50 Å²	50	20%	0.199	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-89	3.7	175.1	-55.5	178.1	0	0	0	112.2	H112 S113 H114 D136 E140 H160	H112-L138 WeakPolarHBondContact CA-O 3.46Å; H112-L138 WeakPolarHBondContact CE1-CB 3.34Å; H112-L138 PolarHBondContact ND1-O 3.15Å; S113-L138 PolarHBondContact N-O 3.09Å; S113-L138 VanDerWaalsContact N-O 3.15Å; S113-L138 WeakPolarHBondContact O-CB 3.05Å; H114-L138 HydrophobicContact CB-CD1 4.3Å; D136-L138 PolarHBondContact O-N 3.2Å; D136-L138 WeakPolarHBondContact OD1-CA 3.44Å; D136-L138 VanDerWaalsContact OD1-CB 3.23Å; D136-L138 WeakPolarHBondContact OD1-CB 3.4Å; D136-L138 PolarHBondContact OD1-N 2.83Å; L138-E140 VanDerWaalsContact C-N 3.34Å; L138-H160 PolarHBondContact O-NE2 3.09Å
139	D	98.8	Very high	97	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-91.7	0.6	170.2	-63.3	-24.8	0	0	0	112.7	R101 N110 L111 H112 G135 D136 H137 W141	R101-D139 HydrophobicContact CG-CB 4.25Å; N110-D139 HydrophobicContact CB-CB 3.75Å; N110-D139 VanDerWaalsContact CB-CG 3.42Å; N110-D139 WeakPolarHBondContact CB-OD2 3.5Å; N110-D139 PolarHBondContact ND2-OD2 3Å; L111-D139 WeakPolarHBondContact O-CA 3.33Å; H112-D139 IonicContact CE1-OD1 2.73Å; H112-D139 IonicContact CG-OD1 3.82Å; H112-D139 IonicContact ND1-OD1 3.49Å; H112-D139 PolarHBondContact ND1-OD1 3.29Å; G135-D139 WeakPolarHBondContact CA-OD2 3.21Å; D136-D139 PolarHBondContact N-OD2 2.86Å; D136-D139 WeakPolarHBondContact O-CB 3.49Å; D136-D139 PolarHBondContact O-N 2.91Å; H137-D139 VanDerWaalsContact C-N 3.27Å; D139-W141 VanDerWaalsContact O-CD1 3.22Å
140	E	98.8	Very high	97	Very high	39 Å²	39	48.3 Å²	48.3	18%	0.182	29%	0.294	C	S	.	.			trans	-95.7	126	-166.6	-67.5	-167.5	-175.8	0	0	112.2	T83 T99 L138 H160 A161	T83-E140 WeakPolarHBondContact CB-OE1 3.21Å; T83-E140 HydrophobicContact CG2-CG 3.87Å; T99-E140 HydrophobicContact CG2-CB 3.64Å; T99-E140 HydrophobicContact CG2-CG 4.34Å; L138-E140 VanDerWaalsContact C-N 3.34Å; E140-H160 PolarHBondContact O-CD2 3.49Å; E140-A161 HydrophobicContact CB-CB 3.93Å; E140-A161 WeakPolarHBondContact O-CB 3.42Å; E140-A161 PolarHBondContact O-N 2.85Å
141	W	98.9	Very high	96.8	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	123.2	-177.3	-61.5	83	0	0	0	111	T99 I100 L111 V126 D139 F158 Q159 H160 L167	T99-W141 WeakPolarHBondContact CA-O 3.35Å; I100-W141 WeakPolarHBondContact CG1-O 3.43Å; I100-W141 PolarHBondContact N-O 3.19Å; I100-W141 PolarHBondContact O-N 3.28Å; L111-W141 HydrophobicContact CD2-CD2 4.17Å; L111-W141 HydrophobicContact CD2-CZ2 3.94Å; L111-W141 HydrophobicContact CG-CZ2 3.86Å; L111-W141 PolarHBondContact O-NE1 2.87Å; V126-W141 HydrophobicContact CG2-CH2 4.01Å; D139-W141 VanDerWaalsContact O-CD1 3.22Å; W141-F158 HydrophobicContact CB-CB 4.32Å; W141-F158 HydrophobicContact CD2-CB 4.49Å; W141-F158 HydrophobicContact CE3-CB 3.89Å; W141-Q159 CarbonylContact C-O 3.47Å; W141-Q159 WeakPolarHBondContact CA-O 3.41Å; W141-H160 HydrophobicContact CD2-CB 4.41Å; W141-H160 AromaticContact CE2-CD2 3.99Å; W141-H160 HydrophobicContact CE3-CB 3.87Å; W141-H160 HydrophobicContact CH2-CB 3.9Å; W141-H160 HydrophobicContact CZ2-CB 4.43Å; W141-H160 HydrophobicContact CZ3-CB 3.59Å; W141-L167 HydrophobicContact CE3-CB 4.33Å; W141-L167 HydrophobicContact CH2-CB 4.34Å; W141-L167 HydrophobicContact CH2-CD1 4.19Å; W141-L167 HydrophobicContact CZ3-CB 3.78Å; W141-L167 HydrophobicContact CZ3-CD1 4.46Å
142	T	98.8	Very high	96.5	Very high	26 Å²	26	47.6 Å²	47.6	16%	0.16	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	122.8	174.8	-60.6	0	0	0	0	110.4	T99 Q144 Q159	T99-T142 PolarHBondContact OG1-OG1 2.9Å; T142-Q144 PolarHBondContact O-N 2.86Å; T142-Q159 PolarHBondContact N-O 2.95Å; T142-Q159 PolarHBondContact O-N 3.12Å
143	V	98.7	Very high	96	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	115.4	178.1	-173	0	0	0	0	109.8	I94 G97 Q98 I100 W150 V156 F158	I94-V143 HydrophobicContact CG2-CG2 4.08Å; G97-V143 WeakPolarHBondContact CA-O 3.49Å; G97-V143 PolarHBondContact N-O 2.89Å; Q98-V143 PolarHBondContact O-N 2.76Å; I100-V143 HydrophobicContact CD1-CG2 3.52Å; I100-V143 HydrophobicContact CG1-CG2 3.75Å; I100-V143 HydrophobicContact CG2-CG2 4.38Å; V143-W150 HydrophobicContact CG1-CB 4.21Å; V143-W150 HydrophobicContact CG1-CD2 3.99Å; V143-W150 HydrophobicContact CG1-CE3 4.04Å; V143-W150 HydrophobicContact CG1-CG 4.08Å; V143-W150 HydrophobicContact CG2-CE3 4.21Å; V143-W150 HydrophobicContact CG2-CZ3 4.44Å; V143-V156 HydrophobicContact CG1-CB 4.41Å; V143-V156 HydrophobicContact CG1-CG2 4.45Å; V143-F158 HydrophobicContact CG1-CE1 4.42Å; V143-F158 HydrophobicContact CG2-CD1 4.16Å; V143-F158 HydrophobicContact CG2-CE1 3.99Å
144	Q	98.6	Very high	96.1	Very high	64 Å²	64	50 Å²	50	30%	0.299	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	111.9	175.1	-60.1	-175.8	-11.9	0	0	110.2	T142 V156 R157 Q159	T142-Q144 PolarHBondContact O-N 2.86Å; Q144-V156 WeakPolarHBondContact O-CA 3.29Å; Q144-V156 WeakPolarHBondContact O-CB 3.36Å; Q144-R157 HydrophobicContact CB-CB 4.16Å; Q144-R157 PolarHBondContact N-O 2.85Å; Q144-R157 PolarHBondContact O-N 3.05Å; Q144-Q159 HydrophobicContact CG-CB 4.36Å; Q144-Q159 VanDerWaalsContact NE2-CD 3.31Å
145	C	97.4	Very high	96.2	Very high	26 Å²	26	46.1 Å²	46.1	18%	0.176	28%	0.284	C	S	.	.			trans	-139.4	163.4	176.9	42.8	0	0	0	0	111.3	C96 E154 V156	C96-C145 WeakPolarHBondContact CA-SG 3.25Å; C96-C145 HydrophobicContact CB-CB 4.16Å; C96-C145 WeakPolarHBondContact CB-SG 3.26Å; C96-C145 WeakPolarHBondContact SG-CB 3.35Å; C96-C145 CovalentContact SG-SG 2.02Å; C96-C145 PolarHBondContact SG-SG 3.48Å; C145-E154 WeakPolarHBondContact CB-OE1 3.28Å; C145-V156 HydrophobicContact CB-CB 4.37Å; C145-V156 HydrophobicContact CB-CG1 3.63Å
146	G	93.9	Very high	96.4	Very high	76 Å²	76	44.6 Å²	44.6	78%	0.784	27%	0.268	S	S	*	.	S	Bend	trans	-85.5	-18.5	-172	0	0	0	0	0	114.8	E154	G146-E154 PolarHBondContact N-OE1 2.89Å
147	G	93.6	Very high	96.4	Very high	43 Å²	43	44.9 Å²	44.9	44%	0.443	27%	0.266	S	S	.	.	S	Bend	trans	-94.5	-161.5	-179	0	0	0	0	0	114.6	C96	C96-G147 VanDerWaalsContact CB-O 3.3Å; C96-G147 WeakPolarHBondContact CB-O 3.49Å; C96-G147 VanDerWaalsContact SG-C 3.57Å; C96-G147 PolarHBondContact SG-O 3.06Å
148	A	95.7	Very high	96.5	Very high	85 Å²	85	39.5 Å²	39.5	70%	0.702	24%	0.241	S	C	*	.	S	Bend	trans	-81.4	-29.3	171.1	0	0	0	0	0	112.6	K95 C96	K95-A148 WeakPolarHBondContact CA-O 3.43Å; C96-A148 PolarHBondContact N-O 3.05Å
149	V	97	Very high	96.5	Very high	30 Å²	30	39.8 Å²	39.8	18%	0.182	24%	0.241	C	C	.	.	B	Isolated β-bridge	trans	-138.4	154.8	-177.4	-61.5	0	0	0	0	110.2	F31 P93 I94 C96 Q151	F31-V149 HydrophobicContact CB-CG2 3.95Å; F31-V149 HydrophobicContact CD1-CG2 4.5Å; F31-V149 HydrophobicContact CG-CG2 4.32Å; P93-V149 HydrophobicContact CB-CG1 4.02Å; I94-V149 CarbonylContact O-C 3.51Å; I94-V149 VanDerWaalsContact O-CA 3.28Å; I94-V149 WeakPolarHBondContact O-CA 3.38Å; I94-V149 WeakPolarHBondContact O-CB 3.4Å; C96-V149 VanDerWaalsContact SG-C 3.57Å; V149-Q151 PolarHBondContact O-N 2.83Å; V149-Q151 VanDerWaalsContact O-N 3.16Å
150	W	97.3	Very high	96.5	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	24%	0.241	C	C	.	.			trans	-69.7	105.4	177.5	178.5	11.7	0	0	0	111.1	F31 V32 L40 V80 I94 I100 V143 V156 F158 A198	F31-W150 CarbonylContact C-O 3.55Å; F31-W150 VanDerWaalsContact CA-O 3.31Å; F31-W150 WeakPolarHBondContact CA-O 3.33Å; F31-W150 WeakPolarHBondContact CB-O 2.96Å; V32-W150 HydrophobicContact CB-CB 4.49Å; V32-W150 HydrophobicContact CB-CD2 3.8Å; V32-W150 HydrophobicContact CB-CE3 3.77Å; V32-W150 HydrophobicContact CB-CG 4.13Å; V32-W150 HydrophobicContact CB-CZ3 4.27Å; V32-W150 HydrophobicContact CG1-CD2 4.26Å; V32-W150 HydrophobicContact CG1-CE3 3.78Å; V32-W150 HydrophobicContact CG1-CH2 4.28Å; V32-W150 HydrophobicContact CG1-CZ3 3.79Å; V32-W150 HydrophobicContact CG2-CD2 3.66Å; V32-W150 HydrophobicContact CG2-CE3 4.07Å; V32-W150 HydrophobicContact CG2-CG 3.96Å; V32-W150 HydrophobicContact CG2-CH2 4.49Å; V32-W150 HydrophobicContact CG2-CZ2 4.15Å; V32-W150 HydrophobicContact CG2-CZ3 4.46Å; V32-W150 PolarHBondContact N-O 2.96Å; L40-W150 HydrophobicContact CD2-CH2 4.01Å; L40-W150 HydrophobicContact CD2-CZ2 3.94Å; V80-W150 HydrophobicContact CG1-CZ3 4.49Å; V80-W150 HydrophobicContact CG2-CH2 4.49Å; V80-W150 HydrophobicContact CG2-CZ3 4.21Å; I94-W150 HydrophobicContact CB-CB 4.44Å; I94-W150 HydrophobicContact CB-CE3 4.32Å; I94-W150 HydrophobicContact CG2-CE3 4.17Å; I94-W150 PolarHBondContact O-N 2.9Å; I100-W150 HydrophobicContact CD1-CZ3 4.04Å; V143-W150 HydrophobicContact CG1-CB 4.21Å; V143-W150 HydrophobicContact CG1-CD2 3.99Å; V143-W150 HydrophobicContact CG1-CE3 4.04Å; V143-W150 HydrophobicContact CG1-CG 4.08Å; V143-W150 HydrophobicContact CG2-CE3 4.21Å; V143-W150 HydrophobicContact CG2-CZ3 4.44Å; W150-V156 HydrophobicContact CG-CG1 4.22Å; W150-V156 HydrophobicContact CZ2-CG2 4.13Å; W150-F158 AromaticContact CH2-CE1 3.72Å; W150-F158 HydrophobicContact CH2-CE1 3.72Å; W150-F158 AromaticContact CH2-CZ 3.45Å; W150-F158 HydrophobicContact CH2-CZ 3.45Å; W150-F158 VanDerWaalsContact CH2-CZ 3.45Å; W150-F158 HydrophobicContact CZ2-CE1 4.17Å; W150-F158 AromaticContact CZ2-CZ 3.58Å; W150-F158 HydrophobicContact CZ2-CZ 3.58Å; W150-F158 HydrophobicContact CZ3-CE1 4Å; W150-F158 HydrophobicContact CZ3-CZ 4.2Å; W150-A198 HydrophobicContact CZ2-CB 3.78Å
151	Q	95.4	Very high	96.5	Very high	66 Å²	66	39.8 Å²	39.8	31%	0.308	25%	0.248	S	C	.	.	B	Isolated β-bridge	trans	-78.5	145.3	175.2	-56.6	-66.7	-19	0	0	110.6	S30 V149 E153 E154	S30-Q151 WeakPolarHBondContact O-CA 3.42Å; S30-Q151 PolarHBondContact O-OE1 2.91Å; S30-Q151 PolarHBondContact OG-OE1 3.43Å; V149-Q151 PolarHBondContact O-N 2.83Å; V149-Q151 VanDerWaalsContact O-N 3.16Å; Q151-E153 PolarHBondContact O-N 3.17Å; Q151-E154 HydrophobicContact CB-CB 3.89Å; Q151-E154 PolarHBondContact O-N 2.98Å
152	R	89.9	Confident	96.5	Very high	34 Å²	34	42 Å²	42	13%	0.128	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-44.4	-173.3	-68.7	179.4	-173.9	179.6	5.3	113.4	L29 S30 F31 V32 E154 Y203	L29-R152 WeakPolarHBondContact O-CD 3.15Å; L29-R152 PolarHBondContact O-NE 3.08Å; L29-R152 PolarHBondContact O-NH1 2.98Å; L29-R152 VanDerWaalsContact O-NH1 3.08Å; L29-R152 PolarHBondContact O-NH2 3.2Å; S30-R152 PolarHBondContact O-N 3Å; F31-R152 PolarHBondContact O-NE 3.49Å; F31-R152 VanDerWaalsContact O-NE 3.08Å; F31-R152 PolarHBondContact O-NH2 3.13Å; V32-R152 HydrophobicContact CG2-CG 4.12Å; R152-E154 VanDerWaalsContact C-N 3.34Å; R152-Y203 HydrophobicContact CG-CD1 4.18Å; R152-Y203 HydrophobicContact CG-CE1 3.65Å; R152-Y203 VanDerWaalsContact CZ-CD1 3.48Å; R152-Y203 VanDerWaalsContact CZ-CD2 3.41Å; R152-Y203 VanDerWaalsContact NH2-CG 3.27Å
153	E	85.7	Confident	96.5	Very high	165 Å²	165	41.2 Å²	41.2	77%	0.771	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-6.4	-174.7	-57.9	-173.5	163.5	0	0	113.2	Q151 R197	Q151-E153 PolarHBondContact O-N 3.17Å; E153-R197 WeakPolarHBondContact O-CD 3.34Å; E153-R197 PolarHBondContact O-NE 3.32Å
154	E	95	Very high	96.5	Very high	45 Å²	45	45.7 Å²	45.7	21%	0.21	28%	0.282	C	S	.	.	S	Bend	trans	-71.8	137.6	177.9	-178	-178.7	-174.1	0	0	110.7	C145 G146 Q151 R152 V156	C145-E154 WeakPolarHBondContact CB-OE1 3.28Å; G146-E154 PolarHBondContact N-OE1 2.89Å; Q151-E154 HydrophobicContact CB-CB 3.89Å; Q151-E154 PolarHBondContact O-N 2.98Å; R152-E154 VanDerWaalsContact C-N 3.34Å; E154-V156 HydrophobicContact CB-CG1 4.45Å; E154-V156 HydrophobicContact CG-CG1 4.14Å; E154-V156 PolarHBondContact O-N 3.2Å
155	A	97.9	Very high	96.5	Very high	36 Å²	36	42.7 Å²	42.7	30%	0.298	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	119.4	169	0	0	0	0	0	109.1	V43 L195 W196	V43-A155 HydrophobicContact CG2-CB 4.11Å; A155-L195 HydrophobicContact CB-CB 4.48Å; A155-L195 HydrophobicContact CB-CD2 4.12Å; A155-W196 CarbonylContact C-O 3.49Å; A155-W196 WeakPolarHBondContact CA-O 3.44Å
156	V	98.6	Very high	96.5	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	170.9	-178	-54.3	0	0	0	0	110.7	V143 Q144 C145 W150 E154 F158 W196	V143-V156 HydrophobicContact CG1-CB 4.41Å; V143-V156 HydrophobicContact CG1-CG2 4.45Å; Q144-V156 WeakPolarHBondContact O-CA 3.29Å; Q144-V156 WeakPolarHBondContact O-CB 3.36Å; C145-V156 HydrophobicContact CB-CB 4.37Å; C145-V156 HydrophobicContact CB-CG1 3.63Å; W150-V156 HydrophobicContact CG-CG1 4.22Å; W150-V156 HydrophobicContact CZ2-CG2 4.13Å; E154-V156 HydrophobicContact CB-CG1 4.45Å; E154-V156 HydrophobicContact CG-CG1 4.14Å; E154-V156 PolarHBondContact O-N 3.2Å; V156-F158 HydrophobicContact CG2-CE1 4.43Å; V156-F158 HydrophobicContact CG2-CE2 3.97Å; V156-F158 HydrophobicContact CG2-CZ 3.81Å; V156-W196 PolarHBondContact N-O 3.14Å; V156-W196 PolarHBondContact O-N 3.39Å
157	R	98.8	Very high	96.8	Very high	57 Å²	57	38.1 Å²	38.1	22%	0.215	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	154.1	166.9	-48.5	-170.9	163	76.9	2.5	110.6	Q144 L166 S191 S194 L195	Q144-R157 HydrophobicContact CB-CB 4.16Å; Q144-R157 PolarHBondContact N-O 2.85Å; Q144-R157 PolarHBondContact O-N 3.05Å; R157-L166 HydrophobicContact CB-CD2 3.88Å; R157-S191 PolarHBondContact NH2-O 3.45Å; R157-S191 VanDerWaalsContact NH2-O 3.09Å; R157-S194 WeakPolarHBondContact CG-O 3.43Å; R157-S194 PolarHBondContact NE-OG 3.3Å; R157-S194 VanDerWaalsContact NE-OG 3.15Å; R157-L195 HydrophobicContact CG-CD2 4.1Å
158	F	98.9	Very high	97	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	111.2	171.2	-59.5	-78.9	0	0	0	107.8	L40 I100 L102 W141 V143 W150 V156 L166 L167 W196	L40-F158 HydrophobicContact CD1-CE2 3.8Å; L40-F158 HydrophobicContact CD1-CZ 3.96Å; L40-F158 HydrophobicContact CD2-CE2 3.95Å; L40-F158 HydrophobicContact CD2-CZ 3.81Å; L40-F158 HydrophobicContact CG-CE2 4.45Å; I100-F158 HydrophobicContact CD1-CE1 4.23Å; L102-F158 HydrophobicContact CD1-CD1 4.23Å; L102-F158 HydrophobicContact CD1-CE1 4.26Å; W141-F158 HydrophobicContact CB-CB 4.32Å; W141-F158 HydrophobicContact CD2-CB 4.49Å; W141-F158 HydrophobicContact CE3-CB 3.89Å; V143-F158 HydrophobicContact CG1-CE1 4.42Å; V143-F158 HydrophobicContact CG2-CD1 4.16Å; V143-F158 HydrophobicContact CG2-CE1 3.99Å; W150-F158 AromaticContact CH2-CE1 3.72Å; W150-F158 HydrophobicContact CH2-CE1 3.72Å; W150-F158 AromaticContact CH2-CZ 3.45Å; W150-F158 HydrophobicContact CH2-CZ 3.45Å; W150-F158 VanDerWaalsContact CH2-CZ 3.45Å; W150-F158 HydrophobicContact CZ2-CE1 4.17Å; W150-F158 AromaticContact CZ2-CZ 3.58Å; W150-F158 HydrophobicContact CZ2-CZ 3.58Å; W150-F158 HydrophobicContact CZ3-CE1 4Å; W150-F158 HydrophobicContact CZ3-CZ 4.2Å; V156-F158 HydrophobicContact CG2-CE1 4.43Å; V156-F158 HydrophobicContact CG2-CE2 3.97Å; V156-F158 HydrophobicContact CG2-CZ 3.81Å; F158-L166 WeakPolarHBondContact O-CA 3.37Å; F158-L167 HydrophobicContact CB-CB 4.09Å; F158-L167 HydrophobicContact CB-CD2 4.4Å; F158-L167 HydrophobicContact CD2-CD2 4.04Å; F158-L167 PolarHBondContact O-N 2.73Å; F158-W196 HydrophobicContact CD2-CB 4.18Å; F158-W196 HydrophobicContact CD2-CG 4.14Å; F158-W196 HydrophobicContact CE2-CB 3.74Å; F158-W196 HydrophobicContact CE2-CG 4.14Å
159	Q	98.9	Very high	97.1	Very high	43 Å²	43	32 Å²	32	20%	0.201	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	122.9	176	-169.8	-176	17.4	0	0	108.9	W141 T142 Q144 A161 D164 L166	W141-Q159 CarbonylContact C-O 3.47Å; W141-Q159 WeakPolarHBondContact CA-O 3.41Å; T142-Q159 PolarHBondContact N-O 2.95Å; T142-Q159 PolarHBondContact O-N 3.12Å; Q144-Q159 HydrophobicContact CG-CB 4.36Å; Q144-Q159 VanDerWaalsContact NE2-CD 3.31Å; Q159-A161 PolarHBondContact O-N 3.33Å; Q159-D164 WeakPolarHBondContact CG-O 3.23Å; Q159-D164 PolarHBondContact NE2-O 2.87Å; Q159-D164 VanDerWaalsContact NE2-O 3.13Å; Q159-D164 PolarHBondContact NE2-OD1 2.9Å; Q159-D164 VanDerWaalsContact NE2-OD1 3.11Å; Q159-L166 HydrophobicContact CB-CD2 3.66Å; Q159-L166 HydrophobicContact CG-CD2 4.02Å
160	H	98.9	Very high	97	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64	122.1	174.9	-174.8	-124.5	0	0	0	109.6	S113 L138 E140 W141 S162 T163 D164 A165	S113-H160 PolarHBondContact O-CE1 3.46Å; S113-H160 PolarHBondContact O-NE2 3.06Å; L138-H160 PolarHBondContact O-NE2 3.09Å; E140-H160 PolarHBondContact O-CD2 3.49Å; W141-H160 HydrophobicContact CD2-CB 4.41Å; W141-H160 AromaticContact CE2-CD2 3.99Å; W141-H160 HydrophobicContact CE3-CB 3.87Å; W141-H160 HydrophobicContact CH2-CB 3.9Å; W141-H160 HydrophobicContact CZ2-CB 4.43Å; W141-H160 HydrophobicContact CZ3-CB 3.59Å; H160-S162 VanDerWaalsContact C-N 3.27Å; H160-S162 PolarHBondContact O-N 2.87Å; H160-T163 WeakPolarHBondContact ND1-CG2 3.32Å; H160-T163 PolarHBondContact ND1-OG1 2.87Å; H160-T163 PolarHBondContact O-N 3.04Å; H160-D164 WeakPolarHBondContact O-CA 3.45Å; H160-D164 PolarHBondContact O-N 2.78Å; H160-A165 WeakPolarHBondContact CB-O 3.43Å; H160-A165 PolarHBondContact N-O 3.23Å
161	A	98.5	Very high	96.8	Very high	39 Å²	39	33 Å²	33	32%	0.322	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-30.6	-167.6	0	0	0	0	0	113.3	T99 E140 Q159	T99-A161 HydrophobicContact CG2-CB 4.15Å; E140-A161 HydrophobicContact CB-CB 3.93Å; E140-A161 WeakPolarHBondContact O-CB 3.42Å; E140-A161 PolarHBondContact O-N 2.85Å; Q159-A161 PolarHBondContact O-N 3.33Å
162	S	98.5	Very high	96.9	Very high	47 Å²	47	33.2 Å²	33.2	33%	0.329	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-17.6	-175.1	-63.8	0	0	0	0	114.5	H137 H160	H137-S162 PolarHBondContact CD2-OG 3.15Å; H137-S162 PolarHBondContact O-OG 3.42Å; H160-S162 VanDerWaalsContact C-N 3.27Å; H160-S162 PolarHBondContact O-N 2.87Å
163	T	98.5	Very high	97.3	Very high	10 Å²	10	36.7 Å²	36.7	6%	0.061	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-127.5	-1.1	-175.9	72.9	0	0	0	0	114	Y115 Q124 H160 A165	Y115-T163 HydrophobicContact CD1-CG2 4.49Å; Y115-T163 HydrophobicContact CE1-CG2 3.87Å; Y115-T163 HydrophobicContact CE2-CG2 3.94Å; Q124-T163 PolarHBondContact NE2-OG1 2.84Å; Q124-T163 PolarHBondContact OE1-OG1 2.88Å; Q124-T163 VanDerWaalsContact OE1-OG1 3.1Å; H160-T163 WeakPolarHBondContact ND1-CG2 3.32Å; H160-T163 PolarHBondContact ND1-OG1 2.87Å; H160-T163 PolarHBondContact O-N 3.04Å; T163-A165 PolarHBondContact O-N 3.06Å
164	D	98.6	Very high	97.9	Very high	93 Å²	93	30.1 Å²	30.1	50%	0.497	17%	0.166	S	C	.	.			trans	59.7	1.7	-176	-66.3	-51.4	0	0	0	116	Q159 H160 M188	Q159-D164 WeakPolarHBondContact CG-O 3.23Å; Q159-D164 PolarHBondContact NE2-O 2.87Å; Q159-D164 VanDerWaalsContact NE2-O 3.13Å; Q159-D164 PolarHBondContact NE2-OD1 2.9Å; Q159-D164 VanDerWaalsContact NE2-OD1 3.11Å; H160-D164 WeakPolarHBondContact O-CA 3.45Å; H160-D164 PolarHBondContact O-N 2.78Å; D164-M188 HydrophobicContact CB-CE 4.34Å
165	A	98.7	Very high	98.1	Very high	1 Å²	1	30 Å²	30	1%	0.008	18%	0.177	C	C	.	.	P	Polyproline II helix	trans	-75.2	146.4	-179.1	0	0	0	0	0	111.3	H160 T163 A186 M188	H160-A165 WeakPolarHBondContact CB-O 3.43Å; H160-A165 PolarHBondContact N-O 3.23Å; T163-A165 PolarHBondContact O-N 3.06Å; A165-A186 HydrophobicContact CB-CB 3.63Å; A165-M188 HydrophobicContact CB-SD 4.06Å
166	L	98.9	Very high	97.9	Very high	6 Å²	6	39.6 Å²	39.6	3%	0.031	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	130.2	-175.8	-66.2	162.8	0	0	0	110.8	R157 F158 Q159 S168 A186 M187 G189 P190	R157-L166 HydrophobicContact CB-CD2 3.88Å; F158-L166 WeakPolarHBondContact O-CA 3.37Å; Q159-L166 HydrophobicContact CB-CD2 3.66Å; Q159-L166 HydrophobicContact CG-CD2 4.02Å; L166-S168 PolarHBondContact O-N 2.78Å; L166-S168 PolarHBondContact O-OG 2.95Å; L166-A186 VanDerWaalsContact O-CA 3.32Å; L166-A186 WeakPolarHBondContact O-CA 3.35Å; L166-M187 PolarHBondContact N-O 3.24Å; L166-M187 PolarHBondContact O-N 3.04Å; L166-G189 WeakPolarHBondContact CD1-O 3.18Å; L166-P190 VanDerWaalsContact CD1-CA 3.48Å; L166-P190 HydrophobicContact CD1-CB 3.99Å
167	L	98.9	Very high	97.8	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-53.3	123.8	173.7	-175.7	68.1	0	0	0	110.2	L49 L111 V126 W141 F158 V184 S194 W196	L49-L167 HydrophobicContact CD1-CD2 4.49Å; L49-L167 HydrophobicContact CD2-CD2 4.37Å; L111-L167 HydrophobicContact CD2-CD1 4.21Å; L111-L167 HydrophobicContact CD2-CD2 3.95Å; V126-L167 HydrophobicContact CB-CD1 4.45Å; V126-L167 HydrophobicContact CG1-CD1 3.85Å; V126-L167 HydrophobicContact CG2-CD1 4.06Å; W141-L167 HydrophobicContact CE3-CB 4.33Å; W141-L167 HydrophobicContact CH2-CB 4.34Å; W141-L167 HydrophobicContact CH2-CD1 4.19Å; W141-L167 HydrophobicContact CZ3-CB 3.78Å; W141-L167 HydrophobicContact CZ3-CD1 4.46Å; F158-L167 HydrophobicContact CB-CB 4.09Å; F158-L167 HydrophobicContact CB-CD2 4.4Å; F158-L167 HydrophobicContact CD2-CD2 4.04Å; F158-L167 PolarHBondContact O-N 2.73Å; L167-V184 HydrophobicContact CD1-CG1 3.49Å; L167-V184 VanDerWaalsContact CD1-CG1 3.49Å; L167-V184 HydrophobicContact CG-CG1 4.44Å; L167-S194 VanDerWaalsContact O-CA 3.29Å; L167-S194 WeakPolarHBondContact O-CA 3.33Å; L167-S194 WeakPolarHBondContact O-CB 3.5Å; L167-W196 HydrophobicContact CD2-CD2 4.27Å; L167-W196 HydrophobicContact CD2-CH2 4.48Å; L167-W196 HydrophobicContact CD2-CZ2 3.9Å; L167-W196 HydrophobicContact CG-CZ2 3.7Å; L167-W196 PolarHBondContact O-NE1 2.84Å
168	S	98.8	Very high	97.7	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	160.1	-165.8	-64.5	0	0	0	0	113.1	L166 H185 H193 S194	L166-S168 PolarHBondContact O-N 2.78Å; L166-S168 PolarHBondContact O-OG 2.95Å; S168-H185 PolarHBondContact N-O 2.78Å; S168-H185 PolarHBondContact O-N 2.65Å; S168-H185 VanDerWaalsContact O-O 3.07Å; S168-H193 WeakPolarHBondContact CA-O 3.33Å; S168-S194 WeakPolarHBondContact OG-CB 3.45Å
169	I	98.4	Very high	97.6	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.265	C	S	.	.			trans	-137.6	128	167.4	-63.9	-177	0	0	0	108.3	N42 H45 V47 R182 V184 H193 W196	N42-I169 HydrophobicContact CB-CD1 4.05Å; H45-I169 HydrophobicContact CB-CG2 4.26Å; H45-I169 PolarHBondContact CD2-O 3.37Å; H45-I169 PolarHBondContact NE2-O 2.94Å; V47-I169 HydrophobicContact CG2-CD1 3.3Å; I169-R182 HydrophobicContact CG2-CB 4Å; I169-V184 HydrophobicContact CD1-CG2 3.73Å; I169-V184 HydrophobicContact CG1-CB 4.48Å; I169-V184 HydrophobicContact CG1-CG2 3.76Å; I169-H193 PolarHBondContact N-O 3.27Å; I169-H193 WeakPolarHBondContact O-CB 3.3Å; I169-H193 PolarHBondContact O-ND1 2.71Å; I169-W196 HydrophobicContact CD1-CH2 3.59Å; I169-W196 HydrophobicContact CD1-CZ2 4.21Å; I169-W196 HydrophobicContact CD1-CZ3 4.37Å; I169-W196 HydrophobicContact CG1-CH2 3.87Å; I169-W196 HydrophobicContact CG1-CZ2 3.99Å
170	T	93.3	Very high	97.6	Very high	34 Å²	34	49.3 Å²	49.3	21%	0.209	27%	0.27	C	S	.	.			trans	-105.2	-20.9	178.8	41.4	0	0	0	0	114.4	H45 E172 H185 M187 H193	H45-T170 PolarHBondContact CE1-O 2.88Å; H45-T170 PolarHBondContact NE2-O 2.91Å; T170-E172 WeakPolarHBondContact CB-OE2 3.43Å; T170-E172 VanDerWaalsContact OG1-CD 3.28Å; T170-E172 PolarHBondContact OG1-OE1 2.53Å; T170-E172 PolarHBondContact OG1-OE2 2.81Å; T170-H185 PolarHBondContact OG1-CE1 3.34Å; T170-H185 PolarHBondContact OG1-NE2 3.29Å; T170-M187 HydrophobicContact CG2-CE 4.34Å; T170-M187 HydrophobicContact CG2-SD 3.55Å; T170-M187 VanDerWaalsContact CG2-SD 3.55Å; T170-H193 HydrophobicContact CG2-CB 4.43Å
171	G	93.9	Very high	97.5	Very high	17 Å²	17	51 Å²	51	18%	0.175	28%	0.278	C	S	.	.	S	Bend	trans	129.9	-8.3	165.9	0	0	0	0	0	115.5	R182	G171-R182 PolarHBondContact O-NH1 2.93Å
172	E	98.3	Very high	97.6	Very high	71 Å²	71	51.9 Å²	51.9	33%	0.332	27%	0.273	S	S	.	.			trans	-54.2	141.6	172.8	-62.3	73.6	-166.5	0	0	109.9	L120 T170 R182 E183	L120-E172 HydrophobicContact CB-CB 4Å; L120-E172 HydrophobicContact CB-CG 4.38Å; L120-E172 HydrophobicContact CD1-CB 3.9Å; T170-E172 WeakPolarHBondContact CB-OE2 3.43Å; T170-E172 VanDerWaalsContact OG1-CD 3.28Å; T170-E172 PolarHBondContact OG1-OE1 2.53Å; T170-E172 PolarHBondContact OG1-OE2 2.81Å; E172-R182 CarbonylContact O-C 3.53Å; E172-R182 VanDerWaalsContact O-CA 3.23Å; E172-R182 WeakPolarHBondContact O-CA 3.47Å; E172-E183 HydrophobicContact CB-CB 4.25Å; E172-E183 PolarHBondContact O-N 3.45Å
173	Q	98.3	Very high	97.6	Very high	107 Å²	107	49.6 Å²	49.6	50%	0.5	26%	0.257	S	S	.	.	B	Isolated β-bridge	trans	-127.6	140.8	-174.6	-76.5	170	71.7	0	0	110.8	G180 Q181 R182	Q173-G180 PolarHBondContact OE1-O 2.58Å; Q173-Q181 CarbonylContact C-O 3.53Å; Q173-Q181 VanDerWaalsContact CA-O 3.28Å; Q173-Q181 WeakPolarHBondContact CA-O 3.47Å; Q173-R182 HydrophobicContact CG-CG 3.98Å
174	Y	98.3	Very high	97.6	Very high	27 Å²	27	49.1 Å²	49.1	11%	0.106	25%	0.254	C	S	.	.			trans	-75.4	151	174.7	-66.5	-78.4	0	0	0	111.8	Y56 T66 P119 L120 I178 H179 G180 Q181 E183	Y56-Y174 WeakPolarHBondContact CE1-OH 2.97Å; T66-Y174 HydrophobicContact CG2-CD2 4.12Å; T66-Y174 HydrophobicContact CG2-CE2 3.83Å; P119-Y174 HydrophobicContact CB-CE1 4.04Å; P119-Y174 HydrophobicContact CG-CE1 4.32Å; L120-Y174 HydrophobicContact CD1-CD1 3.79Å; L120-Y174 HydrophobicContact CD1-CD2 4.35Å; L120-Y174 HydrophobicContact CD1-CE1 3.81Å; L120-Y174 HydrophobicContact CD1-CE2 4.38Å; L120-Y174 HydrophobicContact CD1-CG 4.06Å; L120-Y174 HydrophobicContact CD2-CD1 3.95Å; L120-Y174 HydrophobicContact CD2-CE1 3.87Å; L120-Y174 HydrophobicContact CG-CD1 4.03Å; L120-Y174 HydrophobicContact CG-CE1 3.67Å; Y174-I178 HydrophobicContact CD1-CD1 4.13Å; Y174-I178 HydrophobicContact CD2-CD1 3.6Å; Y174-I178 HydrophobicContact CD2-CG1 4.48Å; Y174-I178 HydrophobicContact CE2-CD1 4.22Å; Y174-I178 HydrophobicContact CG-CD1 3.55Å; Y174-I178 HydrophobicContact CG-CG1 4.09Å; Y174-H179 WeakPolarHBondContact O-CA 3.46Å; Y174-G180 PolarHBondContact O-N 2.94Å; Y174-Q181 WeakPolarHBondContact CD2-O 3.23Å; Y174-Q181 PolarHBondContact N-O 3.44Å; Y174-E183 HydrophobicContact CE2-CB 4.09Å
175	G	97.5	Very high	97.6	Very high	41 Å²	41	44.7 Å²	44.7	42%	0.423	23%	0.231	S	C	.	.			trans	-83.9	-150.5	163.8	0	0	0	0	0	111.7	I178 H179	G175-I178 CarbonylContact O-C 3.56Å; G175-I178 PolarHBondContact O-N 3.11Å; G175-I178 VanDerWaalsContact O-N 3.13Å; G175-H179 WeakPolarHBondContact O-CA 3.36Å; G175-H179 PolarHBondContact O-N 2.96Å
176	R	95.3	Very high	97.6	Very high	239 Å²	239	44.7 Å²	44.7	90%	0.902	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.8	148.3	175.3	-66.8	-178.7	-179.8	-86.5	-0.2	111.3
177	P	95.1	Very high	97.6	Very high	107 Å²	107	46.7 Å²	46.7	70%	0.695	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	cis	-82.1	-9.2	-0.4	32.8	-34.5	0	0	0	114.4	V54 H179	V54-P177 HydrophobicContact CG1-CG 4.28Å; V54-P177 HydrophobicContact CG2-CG 4.45Å; P177-H179 PolarHBondContact O-N 3.48Å
178	I	97.1	Very high	97.5	Very high	18 Å²	18	53.2 Å²	53.2	9%	0.092	27%	0.272	C	S	.	.	S	Bend	trans	-106.6	49.4	-172	50.6	160.2	0	0	0	111.9	H52 V54 T66 Y174 G175 G180 Q181	H52-I178 WeakPolarHBondContact NE2-CG2 3.44Å; V54-I178 HydrophobicContact CG2-CG2 4.28Å; T66-I178 HydrophobicContact CG2-CD1 3.96Å; Y174-I178 HydrophobicContact CD1-CD1 4.13Å; Y174-I178 HydrophobicContact CD2-CD1 3.6Å; Y174-I178 HydrophobicContact CD2-CG1 4.48Å; Y174-I178 HydrophobicContact CE2-CD1 4.22Å; Y174-I178 HydrophobicContact CG-CD1 3.55Å; Y174-I178 HydrophobicContact CG-CG1 4.09Å; G175-I178 CarbonylContact O-C 3.56Å; G175-I178 PolarHBondContact O-N 3.11Å; G175-I178 VanDerWaalsContact O-N 3.13Å; I178-G180 PolarHBondContact O-N 3.13Å; I178-Q181 HydrophobicContact CB-CG 4.16Å; I178-Q181 WeakPolarHBondContact O-CB 3.31Å; I178-Q181 WeakPolarHBondContact O-CG 3.32Å; I178-Q181 PolarHBondContact O-N 2.89Å
179	H	97.3	Very high	97.3	Very high	149 Å²	149	55 Å²	55	69%	0.69	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	128.4	-169.6	173.6	-78.2	0	0	0	112.4	Y174 G175 P177 Q181	Y174-H179 WeakPolarHBondContact O-CA 3.46Å; G175-H179 WeakPolarHBondContact O-CA 3.36Å; G175-H179 PolarHBondContact O-N 2.96Å; P177-H179 PolarHBondContact O-N 3.48Å; H179-Q181 VanDerWaalsContact C-N 3.26Å; H179-Q181 PolarHBondContact O-N 2.92Å
180	G	97.6	Very high	97.2	Very high	29 Å²	29	59.5 Å²	59.5	30%	0.299	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	82	-4.9	175.4	0	0	0	0	0	114.7	Q173 Y174 I178	Q173-G180 PolarHBondContact OE1-O 2.58Å; Y174-G180 PolarHBondContact O-N 2.94Å; I178-G180 PolarHBondContact O-N 3.13Å
181	Q	98.6	Very high	97.4	Very high	36 Å²	36	59.6 Å²	59.6	17%	0.168	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-69.4	139.6	170.3	-57.7	-169.4	11.6	0	0	109.5	H50 H52 T66 V68 Q173 Y174 I178 H179	H50-Q181 PolarHBondContact ND1-OE1 3.38Å; H52-Q181 PolarHBondContact CE1-OE1 2.73Å; T66-Q181 HydrophobicContact CG2-CB 4.32Å; T66-Q181 PolarHBondContact OG1-OE1 3.43Å; V68-Q181 HydrophobicContact CG1-CG 3.94Å; Q173-Q181 CarbonylContact C-O 3.53Å; Q173-Q181 VanDerWaalsContact CA-O 3.28Å; Q173-Q181 WeakPolarHBondContact CA-O 3.47Å; Y174-Q181 WeakPolarHBondContact CD2-O 3.23Å; Y174-Q181 PolarHBondContact N-O 3.44Å; I178-Q181 HydrophobicContact CB-CG 4.16Å; I178-Q181 WeakPolarHBondContact O-CB 3.31Å; I178-Q181 WeakPolarHBondContact O-CG 3.32Å; I178-Q181 PolarHBondContact O-N 2.89Å; H179-Q181 VanDerWaalsContact C-N 3.26Å; H179-Q181 PolarHBondContact O-N 2.92Å
182	R	98.8	Very high	97.6	Very high	57 Å²	57	64.6 Å²	64.6	22%	0.215	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	145.7	-178.8	-63.4	-171.5	-171.6	-84.9	3	111.5	V47 T66 G67 I169 G171 E172 Q173 V184	V47-R182 HydrophobicContact CG1-CG 4.32Å; T66-R182 CarbonylContact C-O 3.56Å; T66-R182 VanDerWaalsContact CA-O 3.29Å; T66-R182 WeakPolarHBondContact CA-O 3.45Å; G67-R182 PolarHBondContact N-O 3.48Å; G67-R182 PolarHBondContact O-N 3.41Å; I169-R182 HydrophobicContact CG2-CB 4Å; G171-R182 PolarHBondContact O-NH1 2.93Å; E172-R182 CarbonylContact O-C 3.53Å; E172-R182 VanDerWaalsContact O-CA 3.23Å; E172-R182 WeakPolarHBondContact O-CA 3.47Å; Q173-R182 HydrophobicContact CG-CG 3.98Å; R182-V184 PolarHBondContact O-N 2.7Å
183	E	98.8	Very high	97.6	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	129.5	170.1	-174.6	179.1	-123.9	0	0	110.8	S118 P119 L120 S121 E172 Y174 H185	S118-E183 WeakPolarHBondContact CB-OE1 3.33Å; P119-E183 WeakPolarHBondContact CD-OE1 3.38Å; P119-E183 VanDerWaalsContact N-OE1 3.15Å; L120-E183 WeakPolarHBondContact CA-OE1 3.38Å; L120-E183 WeakPolarHBondContact CB-OE1 3.41Å; L120-E183 HydrophobicContact CD1-CB 4.09Å; L120-E183 HydrophobicContact CG-CB 4.47Å; L120-E183 PolarHBondContact N-OE1 3.15Å; S121-E183 WeakPolarHBondContact CB-OE2 3.39Å; S121-E183 PolarHBondContact N-OE1 3.49Å; S121-E183 PolarHBondContact N-OE2 2.87Å; S121-E183 VanDerWaalsContact N-OE2 3.13Å; S121-E183 PolarHBondContact OG-OE2 3.43Å; E172-E183 HydrophobicContact CB-CB 4.25Å; E172-E183 PolarHBondContact O-N 3.45Å; Y174-E183 HydrophobicContact CE2-CB 4.09Å; E183-H185 IonicContact OE2-CD2 4Å; E183-H185 PolarHBondContact OE2-CD2 2.98Å
184	V	98.9	Very high	97.6	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-103.3	132.6	164.9	175.2	0	0	0	0	107.5	L49 V65 T66 V126 L167 I169 R182 W196	L49-V184 HydrophobicContact CD1-CB 4.47Å; L49-V184 HydrophobicContact CD1-CG1 3.88Å; L49-V184 HydrophobicContact CD1-CG2 3.96Å; V65-V184 HydrophobicContact CG1-CB 4.12Å; V65-V184 HydrophobicContact CG1-CG1 4.05Å; V65-V184 HydrophobicContact CG1-CG2 4.38Å; T66-V184 WeakPolarHBondContact O-CG2 3.45Å; V126-V184 HydrophobicContact CB-CG1 4.18Å; V126-V184 HydrophobicContact CG1-CG1 4.01Å; L167-V184 HydrophobicContact CD1-CG1 3.49Å; L167-V184 VanDerWaalsContact CD1-CG1 3.49Å; L167-V184 HydrophobicContact CG-CG1 4.44Å; I169-V184 HydrophobicContact CD1-CG2 3.73Å; I169-V184 HydrophobicContact CG1-CB 4.48Å; I169-V184 HydrophobicContact CG1-CG2 3.76Å; R182-V184 PolarHBondContact O-N 2.7Å; V184-W196 HydrophobicContact CG2-CH2 4.47Å
185	H	98.9	Very high	97.6	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	-179.8	-179.8	55.9	79.1	0	0	0	109.4	S121 N123 Q124 V126 S168 T170 E183 M187	S121-H185 PolarHBondContact OG-CD2 3.3Å; N123-H185 HydrophobicContact CB-CB 3.99Å; N123-H185 PolarHBondContact ND2-CE1 2.93Å; Q124-H185 CarbonylContact O-C 3.6Å; Q124-H185 WeakPolarHBondContact O-CA 3.44Å; Q124-H185 WeakPolarHBondContact O-CB 3.13Å; V126-H185 VanDerWaalsContact CG2-C 3.44Å; S168-H185 PolarHBondContact N-O 2.78Å; S168-H185 PolarHBondContact O-N 2.65Å; S168-H185 VanDerWaalsContact O-O 3.07Å; T170-H185 PolarHBondContact OG1-CE1 3.34Å; T170-H185 PolarHBondContact OG1-NE2 3.29Å; E183-H185 IonicContact OE2-CD2 4Å; E183-H185 PolarHBondContact OE2-CD2 2.98Å; H185-M187 VanDerWaalsContact CE1-CG 3.49Å; H185-M187 WeakPolarHBondContact CE1-CG 3.46Å; H185-M187 VanDerWaalsContact CE1-SD 3.59Å; H185-M187 WeakPolarHBondContact ND1-CG 3.47Å
186	A	98.7	Very high	97.7	Very high	1 Å²	1	56.4 Å²	56.4	1%	0.008	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	137.4	173.9	0	0	0	0	0	110.9	Q124 V126 A165 L166	Q124-A186 HydrophobicContact CB-CB 4.14Å; Q124-A186 WeakPolarHBondContact CB-O 3.36Å; Q124-A186 PolarHBondContact N-O 3.41Å; Q124-A186 VanDerWaalsContact N-O 3.14Å; Q124-A186 PolarHBondContact O-N 2.77Å; V126-A186 HydrophobicContact CG2-CB 3.81Å; A165-A186 HydrophobicContact CB-CB 3.63Å; L166-A186 VanDerWaalsContact O-CA 3.32Å; L166-A186 WeakPolarHBondContact O-CA 3.35Å
187	M	98.3	Very high	97.8	Very high	48 Å²	48	48.7 Å²	48.7	24%	0.236	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	148	-178.7	-64.4	-179.9	71.5	0	0	111.1	L166 T170 H185	L166-M187 PolarHBondContact N-O 3.24Å; L166-M187 PolarHBondContact O-N 3.04Å; T170-M187 HydrophobicContact CG2-CE 4.34Å; T170-M187 HydrophobicContact CG2-SD 3.55Å; T170-M187 VanDerWaalsContact CG2-SD 3.55Å; H185-M187 VanDerWaalsContact CE1-CG 3.49Å; H185-M187 WeakPolarHBondContact CE1-CG 3.46Å; H185-M187 VanDerWaalsContact CE1-SD 3.59Å; H185-M187 WeakPolarHBondContact ND1-CG 3.47Å
188	M	96.9	Very high	97.9	Very high	136 Å²	136	43.7 Å²	43.7	67%	0.67	23%	0.232	S	C	*	.	S	Bend	trans	-73.8	134.1	169.4	-65.3	-56	-69.5	0	0	110.6	D164 A165	D164-M188 HydrophobicContact CB-CE 4.34Å; A165-M188 HydrophobicContact CB-SD 4.06Å
189	G	94.1	Very high	97.7	Very high	39 Å²	39	45.5 Å²	45.5	40%	0.402	24%	0.241	S	C	.	.	S	Bend	trans	82	146.3	175	0	0	0	0	0	114.3	L166	L166-G189 WeakPolarHBondContact CD1-O 3.18Å
190	P	97.3	Very high	97.2	Very high	94 Å²	94	41.7 Å²	41.7	61%	0.61	22%	0.223	S	C	*	.			trans	-72.8	143.1	-177	29.9	-34.9	0	0	0	112	L166	L166-P190 VanDerWaalsContact CD1-CA 3.48Å; L166-P190 HydrophobicContact CD1-CB 3.99Å
191	S	97.3	Very high	96.6	Very high	35 Å²	35	41.5 Å²	41.5	25%	0.245	22%	0.222	C	C	.	.			trans	-146.3	-174.4	172	73.8	0	0	0	0	110.4	R157 H193 S194	R157-S191 PolarHBondContact NH2-O 3.45Å; R157-S191 VanDerWaalsContact NH2-O 3.09Å; S191-H193 WeakPolarHBondContact OG-CB 3.35Å; S191-H193 PolarHBondContact OG-N 2.56Å; S191-H193 VanDerWaalsContact OG-N 3.09Å; S191-S194 PolarHBondContact N-OG 2.85Å; S191-S194 VanDerWaalsContact N-OG 3.15Å; S191-S194 PolarHBondContact O-OG 2.96Å
192	Q	97.9	Very high	96.2	Very high	123 Å²	123	44.4 Å²	44.4	58%	0.575	24%	0.241	S	C	*	.	S	Bend	trans	-72.1	-20.8	170.1	-62.4	-60.2	-48.6	0	0	112	K44 S194	K44-Q192 WeakPolarHBondContact CB-O 3.46Å; Q192-S194 VanDerWaalsContact C-N 3.29Å; Q192-S194 PolarHBondContact O-N 2.87Å
193	H	98.2	Very high	95.7	Very high	53 Å²	53	43.7 Å²	43.7	25%	0.245	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-20	179.1	-63.1	-59.8	0	0	0	113.3	N42 H45 S168 I169 T170 S191	N42-H193 PolarHBondContact ND2-O 3.13Å; H45-H193 AromaticContact CD2-ND1 3.82Å; H45-H193 AromaticContact NE2-CE1 3.59Å; H45-H193 AromaticContact NE2-ND1 3.08Å; H45-H193 PolarHBondContact NE2-ND1 3.42Å; S168-H193 WeakPolarHBondContact CA-O 3.33Å; I169-H193 PolarHBondContact N-O 3.27Å; I169-H193 WeakPolarHBondContact O-CB 3.3Å; I169-H193 PolarHBondContact O-ND1 2.71Å; T170-H193 HydrophobicContact CG2-CB 4.43Å; S191-H193 WeakPolarHBondContact OG-CB 3.35Å; S191-H193 PolarHBondContact OG-N 2.56Å; S191-H193 VanDerWaalsContact OG-N 3.09Å
194	S	98.7	Very high	95.2	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.6	8.7	-179.2	58	0	0	0	0	114.7	R157 L167 S168 S191 Q192	R157-S194 WeakPolarHBondContact CG-O 3.43Å; R157-S194 PolarHBondContact NE-OG 3.3Å; R157-S194 VanDerWaalsContact NE-OG 3.15Å; L167-S194 VanDerWaalsContact O-CA 3.29Å; L167-S194 WeakPolarHBondContact O-CA 3.33Å; L167-S194 WeakPolarHBondContact O-CB 3.5Å; S168-S194 WeakPolarHBondContact OG-CB 3.45Å; S191-S194 PolarHBondContact N-OG 2.85Å; S191-S194 VanDerWaalsContact N-OG 3.15Å; S191-S194 PolarHBondContact O-OG 2.96Å; Q192-S194 VanDerWaalsContact C-N 3.29Å; Q192-S194 PolarHBondContact O-N 2.87Å
195	L	98.7	Very high	94.5	Very high	21 Å²	21	53.3 Å²	53.3	11%	0.11	28%	0.282	C	S	.	.			trans	-89	124.9	176.7	-72.8	172.5	0	0	0	111	V43 A155 R157	V43-L195 HydrophobicContact CB-CB 4.15Å; V43-L195 HydrophobicContact CG2-CB 4.16Å; V43-L195 PolarHBondContact N-O 2.93Å; A155-L195 HydrophobicContact CB-CB 4.48Å; A155-L195 HydrophobicContact CB-CD2 4.12Å; R157-L195 HydrophobicContact CG-CD2 4.1Å
196	W	98.8	Very high	93.6	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	149.4	-179.7	-61.6	86.6	0	0	0	110.7	L40 L41 N42 L49 A155 V156 F158 L167 I169 V184	L40-W196 HydrophobicContact CB-CE3 3.98Å; L41-W196 CarbonylContact O-C 3.57Å; L41-W196 VanDerWaalsContact O-CA 3.25Å; L41-W196 WeakPolarHBondContact O-CA 3.35Å; N42-W196 HydrophobicContact CB-CD2 4.29Å; N42-W196 HydrophobicContact CB-CE3 3.88Å; N42-W196 HydrophobicContact CB-CH2 3.96Å; N42-W196 HydrophobicContact CB-CZ2 4.32Å; N42-W196 HydrophobicContact CB-CZ3 3.71Å; N42-W196 VanDerWaalsContact N-CE3 3.33Å; L49-W196 HydrophobicContact CB-CH2 4.44Å; L49-W196 HydrophobicContact CB-CZ3 3.94Å; L49-W196 HydrophobicContact CD1-CH2 4.03Å; L49-W196 HydrophobicContact CD1-CZ3 4.36Å; A155-W196 CarbonylContact C-O 3.49Å; A155-W196 WeakPolarHBondContact CA-O 3.44Å; V156-W196 PolarHBondContact N-O 3.14Å; V156-W196 PolarHBondContact O-N 3.39Å; F158-W196 HydrophobicContact CD2-CB 4.18Å; F158-W196 HydrophobicContact CD2-CG 4.14Å; F158-W196 HydrophobicContact CE2-CB 3.74Å; F158-W196 HydrophobicContact CE2-CG 4.14Å; L167-W196 HydrophobicContact CD2-CD2 4.27Å; L167-W196 HydrophobicContact CD2-CH2 4.48Å; L167-W196 HydrophobicContact CD2-CZ2 3.9Å; L167-W196 HydrophobicContact CG-CZ2 3.7Å; L167-W196 PolarHBondContact O-NE1 2.84Å; I169-W196 HydrophobicContact CD1-CH2 3.59Å; I169-W196 HydrophobicContact CD1-CZ2 4.21Å; I169-W196 HydrophobicContact CD1-CZ3 4.37Å; I169-W196 HydrophobicContact CG1-CH2 3.87Å; I169-W196 HydrophobicContact CG1-CZ2 3.99Å; V184-W196 HydrophobicContact CG2-CH2 4.47Å
197	R	98.3	Very high	92.3	Very high	76 Å²	76	58.1 Å²	58.1	29%	0.287	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	137.6	174.8	-172.8	-178.8	-69.5	131.2	2.4	109.8	L41 V43 E153 M199	L41-R197 PolarHBondContact N-O 2.92Å; L41-R197 PolarHBondContact O-N 2.83Å; V43-R197 HydrophobicContact CG2-CB 4.22Å; E153-R197 WeakPolarHBondContact O-CD 3.34Å; E153-R197 PolarHBondContact O-NE 3.32Å; R197-M199 HydrophobicContact CB-CG 4.45Å; R197-M199 WeakPolarHBondContact CD-SD 3.39Å; R197-M199 HydrophobicContact CG-CG 4.28Å; R197-M199 HydrophobicContact CG-SD 3.84Å; R197-M199 PolarHBondContact O-N 3.1Å
198	A	97.1	Very high	90.6	Very high	2 Å²	2	65.2 Å²	65.2	2%	0.017	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	123.5	170.3	0	0	0	0	0	109.2	V32 V38 W150	V32-A198 HydrophobicContact CG2-CB 4Å; V38-A198 HydrophobicContact CB-CB 4.44Å; V38-A198 HydrophobicContact CG1-CB 4.44Å; W150-A198 HydrophobicContact CZ2-CB 3.78Å
199	M	92.6	Very high	88.2	Confident	57 Å²	57	62.7 Å²	62.7	28%	0.281	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	161.9	-179.2	-61.1	-66.1	-67.3	0	0	109.5	K39 L41 R197 G201	K39-M199 PolarHBondContact N-O 2.92Å; K39-M199 PolarHBondContact O-N 2.94Å; L41-M199 HydrophobicContact CB-CG 3.75Å; L41-M199 HydrophobicContact CD2-CG 4.06Å; R197-M199 HydrophobicContact CB-CG 4.45Å; R197-M199 WeakPolarHBondContact CD-SD 3.39Å; R197-M199 HydrophobicContact CG-CG 4.28Å; R197-M199 HydrophobicContact CG-SD 3.84Å; R197-M199 PolarHBondContact O-N 3.1Å; M199-G201 PolarHBondContact O-N 3.37Å
200	E	86.3	Confident	86.1	Confident	68 Å²	68	66.3 Å²	66.3	32%	0.318	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	45.1	63.6	161.9	-66.2	146.4	-152	0	0	113	K39 R48 Y77	K39-E200 HydrophobicContact CB-CB 4.49Å; K39-E200 HydrophobicContact CD-CB 4.09Å; K39-E200 HydrophobicContact CG-CB 4.23Å; R48-E200 IonicContact CZ-OE1 3.7Å; R48-E200 IonicContact CZ-OE2 2.71Å; R48-E200 IonicContact NE-OE1 3.23Å; R48-E200 IonicContact NE-OE2 3.89Å; R48-E200 PolarHBondContact NE-OE2 3.26Å; R48-E200 VanDerWaalsContact NH2-CD 3.35Å; R48-E200 IonicContact NH2-OE1 3.37Å; R48-E200 PolarHBondContact NH2-OE1 3.43Å; R48-E200 IonicContact NH2-OE2 3.66Å; R48-E200 PolarHBondContact NH2-OE2 3.2Å; Y77-E200 VanDerWaalsContact CE1-O 3.25Å; Y77-E200 WeakPolarHBondContact CE1-O 3.37Å
201	G	85.1	Confident	84	Confident	26 Å²	26	70.4 Å²	70.4	27%	0.268	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	163.1	-171.7	0	0	0	0	0	114.5	V37 M199 Y203	V37-G201 CarbonylContact O-C 3.53Å; V37-G201 WeakPolarHBondContact O-CA 3.49Å; M199-G201 PolarHBondContact O-N 3.37Å; G201-Y203 WeakPolarHBondContact O-CD2 3.36Å; G201-Y203 WeakPolarHBondContact O-CE2 3.44Å
202	V	90.5	Very high	81.2	Confident	96 Å²	96	71.5 Å²	71.5	58%	0.582	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.8	111	164.8	179.9	0	0	0	0	107.5	S36 V37	S36-V202 WeakPolarHBondContact CA-O 3.22Å; V37-V202 PolarHBondContact N-O 3.25Å; V37-V202 PolarHBondContact O-N 3.19Å
203	Y	88.7	Confident	78.8	Confident	43 Å²	43	73.1 Å²	73.1	17%	0.169	40%	0.404	C	S	.	.			trans	-105.1	136.4	-174.9	-57.6	-93.1	0	0	0	112.3	V32 V38 R152 G201	V32-Y203 HydrophobicContact CG2-CE1 4.2Å; V38-Y203 HydrophobicContact CG1-CD1 4.08Å; V38-Y203 HydrophobicContact CG1-CE1 3.51Å; R152-Y203 HydrophobicContact CG-CD1 4.18Å; R152-Y203 HydrophobicContact CG-CE1 3.65Å; R152-Y203 VanDerWaalsContact CZ-CD1 3.48Å; R152-Y203 VanDerWaalsContact CZ-CD2 3.41Å; R152-Y203 VanDerWaalsContact NH2-CG 3.27Å; G201-Y203 WeakPolarHBondContact O-CD2 3.36Å; G201-Y203 WeakPolarHBondContact O-CE2 3.44Å
204	M	87.9	Confident	76	Confident	28 Å²	28	79.3 Å²	79.3	14%	0.138	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-80.1	132.8	-176.3	-54.8	-55.4	-179.2	0	0	110.6	T33 G35 S36 R90	T33-M204 WeakPolarHBondContact OG1-CB 3.22Å; T33-M204 PolarHBondContact OG1-N 3.34Å; T33-M204 PolarHBondContact OG1-O 2.72Å; G35-M204 WeakPolarHBondContact O-CE 3.34Å; G35-M204 WeakPolarHBondContact O-CG 3.2Å; S36-M204 PolarHBondContact OG-N 2.52Å; R90-M204 HydrophobicContact CG-CB 4.04Å; R90-M204 HydrophobicContact CG-CG 3.78Å; R90-M204 HydrophobicContact CG-SD 4.41Å; R90-M204 PolarHBondContact NE-SD 3.38Å; R90-M204 VanDerWaalsContact NH2-CE 3.31Å; R90-M204 PolarHBondContact NH2-SD 3.34Å
205	K	84.6	Confident	73.1	Confident	173 Å²	173	85.2 Å²	85.2	75%	0.752	46%	0.462	S	S	*	.	P	Polyproline II helix	trans	-57.3	137	172.2	-74	-175.9	177.9	-174.3	0	109.9	L29 G91 S207	L29-K205 HydrophobicContact CD1-CB 4.42Å; L29-K205 HydrophobicContact CD1-CG 3.99Å; G91-K205 WeakPolarHBondContact CA-O 3.39Å; K205-S207 PolarHBondContact O-N 3Å
206	P	80.1	Confident	70.5	Confident	44 Å²	44	94.8 Å²	94.8	29%	0.286	50%	0.503	S	S	.	.	P	Polyproline II helix	trans	-54.6	134.5	171.9	-23.8	33.2	0	0	0	110	L29 F31 G91 E208	L29-P206 HydrophobicContact CD2-CG 3.72Å; F31-P206 HydrophobicContact CE2-CB 4.4Å; F31-P206 HydrophobicContact CE2-CG 3.65Å; F31-P206 HydrophobicContact CZ-CB 4.26Å; F31-P206 HydrophobicContact CZ-CG 3.48Å; F31-P206 VanDerWaalsContact CZ-CG 3.48Å; G91-P206 WeakPolarHBondContact O-CA 3.06Å; P206-E208 PolarHBondContact O-N 3.48Å
207	S	72.3	Confident	67.9	Low	58 Å²	58	99 Å²	99	41%	0.406	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-66.5	125.3	169.7	51.1	0	0	0	0	108.9	K205 S209	K205-S207 PolarHBondContact O-N 3Å; S207-S209 PolarHBondContact O-N 2.8Å
208	E	60.6	Low	65.2	Low	197 Å²	197	104.1 Å²	104.1	92%	0.921	56%	0.559	S	S	*	*	S	Bend	trans	-70.2	10.3	-179.7	-67.8	-168.5	162.5	0	0	114.7	P206 P210	P206-E208 PolarHBondContact O-N 3.48Å; E208-P210 WeakPolarHBondContact O-CD 3.43Å
209	S	47.5	Very low	62.8	Low	84 Å²	84	109.2 Å²	109.2	59%	0.587	59%	0.593	S	S	*	*			trans	-111	92	-177.1	57.9	0	0	0	0	112.8	S207 L211	S207-S209 PolarHBondContact O-N 2.8Å; S209-L211 PolarHBondContact O-N 3.47Å
210	P	50.7	Low	60.5	Low	114 Å²	114	114.4 Å²	114.4	74%	0.74	62%	0.62	S	S	*	*	S	Bend	trans	-80.3	107.7	156.7	30.9	-24.6	0	0	0	107.7	E208	E208-P210 WeakPolarHBondContact O-CD 3.43Å
211	L	53.4	Low	58.3	Low	181 Å²	181	119 Å²	119	95%	0.948	64%	0.642	S	S	*	*			trans	67.8	105.5	-179.8	-59.3	155.6	0	0	0	114.9	S209	S209-L211 PolarHBondContact O-N 3.47Å
212	G	37	Very low	56.8	Low	58 Å²	58	123.4 Å²	123.4	60%	0.598	66%	0.663	S	S	*	*			trans	-145	89.1	167.5	0	0	0	0	0	108.9	K214	G212-K214 PolarHBondContact O-N 2.87Å
213	N	47.1	Very low	54.8	Low	156 Å²	156	126 Å²	126	83%	0.834	67%	0.669	S	S	*	*			trans	-55.5	95.8	159.9	-160.7	38.7	0	0	0	106.6
214	K	39.5	Very low	53	Low	184 Å²	184	137.2 Å²	137.2	80%	0.8	72%	0.719	S	S	*	*			trans	-96.6	97.2	167.8	-80.5	-169.3	175.6	-177.5	0	106	G212 F216	G212-K214 PolarHBondContact O-N 2.87Å; K214-F216 PolarHBondContact O-N 3.27Å
215	D	39.4	Very low	51.2	Low	124 Å²	124	142.7 Å²	142.7	66%	0.663	75%	0.748	S	S	*	*			trans	-43.5	122.9	158.7	-88.1	-41.4	0	0	0	108.7	S217	D215-S217 PolarHBondContact O-N 3.29Å
216	F	44	Very low	49.5	Very low	221 Å²	221	141.1 Å²	141.1	97%	0.969	75%	0.748	S	S	*	*			trans	-73.6	74.9	164	-77.2	-86.9	0	0	0	108.2	K214	K214-F216 PolarHBondContact O-N 3.27Å
217	S	44	Very low	47.8	Very low	89 Å²	89	146.5 Å²	146.5	62%	0.622	77%	0.774	S	S	*	*			trans	-128.8	70	165.7	57.1	0	0	0	0	109.3	D215	D215-S217 PolarHBondContact O-N 3.29Å
218	H	40.8	Very low	46.3	Very low	183 Å²	183	151.7 Å²	151.7	85%	0.847	80%	0.796	S	S	*	*			trans	-111.9	125.1	152.3	-88.1	-60.1	0	0	0	109.5
219	P	46.8	Very low	45.4	Very low	110 Å²	110	148.9 Å²	148.9	71%	0.714	79%	0.788	S	S	*	*			trans	-69.8	151.9	178.5	29.4	-32.2	0	0	0	110.4	H221	P219-H221 PolarHBondContact O-N 2.73Å
220	L	43.7	Very low	45.3	Very low	165 Å²	165	153.2 Å²	153.2	86%	0.864	80%	0.801	S	S	*	*			trans	-49.7	111.1	170.1	-92.3	105.4	0	0	0	109.9	T222	L220-T222 PolarHBondContact O-N 3.12Å
221	H	39.8	Very low	44.9	Very low	166 Å²	166	156 Å²	156	77%	0.769	81%	0.805	S	S	*	*			trans	-74.7	107	160.1	-126.6	-74.2	0	0	0	106.8	P219 E223	P219-H221 PolarHBondContact O-N 2.73Å; H221-E223 IonicContact CE1-OE1 3.59Å; H221-E223 IonicContact ND1-OE1 2.66Å
222	T	53.9	Low	44.3	Very low	117 Å²	117	154.1 Å²	154.1	72%	0.718	79%	0.794	S	S	*	*			trans	-91.5	120.2	166.5	-32.5	0	0	0	0	105.3	L220	L220-T222 PolarHBondContact O-N 3.12Å
223	E	48.9	Very low	44.9	Very low	152 Å²	152	162.1 Å²	162.1	71%	0.71	81%	0.811	S	S	*	*			trans	-130.2	120.9	158.5	-70.1	-159.5	170.4	0	0	109	H221	H221-E223 IonicContact CE1-OE1 3.59Å; H221-E223 IonicContact ND1-OE1 2.66Å
224	F	50.5	Low	44.7	Very low	278 Å²	278	162.6 Å²	162.6	100%	1.219	81%	0.809	S	S	*	*			trans	1.8	0	166.6	-59.1	-85.4	0	0	0	120.1

Retrieved 224 of 224 residues in 100.8 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).