A0A060W3K0_ONCMY Loading...

Protein Wnt

Ligand for members of the frizzled family of seven transmembrane receptors.

AlphaFold DB , UniProt , Accession A0A060W3K0, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110491490, Length 355 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	31.9	Very low	33.4	Very low	223 Å²	223	158.5 Å²	158.5	100%	1.099	82%	0.815	S	S	*	*				0	78.8	0	-72.5	166	72.2	0	0	105.9
2	D	33.9	Very low	33.4	Very low	139 Å²	139	156.6 Å²	156.6	74%	0.743	82%	0.816	S	S	*	*				75.9	133.5	87.7	-68.8	-36.1	0	0	0	109.7
3	L	34.1	Very low	33.2	Very low	133 Å²	133	161.5 Å²	161.5	70%	0.696	82%	0.817	S	S	*	*			cis	-169.8	140.1	11.3	-124.2	122.3	0	0	0	105.4
4	Y	34.8	Very low	33.1	Very low	197 Å²	197	161.2 Å²	161.2	77%	0.773	82%	0.818	S	S	*	*			trans	56.7	126.1	130.3	-80.3	-104	0	0	0	125.6
5	L	35.3	Very low	33.1	Very low	132 Å²	132	156.9 Å²	156.9	69%	0.691	81%	0.808	S	S	*	*				81.1	110.8	123.6	-108.3	75.3	0	0	0	124.7
6	I	36.2	Very low	33.1	Very low	154 Å²	154	153.8 Å²	153.8	79%	0.79	80%	0.804	S	S	*	*				53.7	127.1	125.3	-59.5	171.7	0	0	0	121.2
7	G	32.2	Very low	33	Very low	75 Å²	75	158.1 Å²	158.1	77%	0.773	81%	0.808	S	S	*	*			trans	176.2	107.8	153.5	0	0	0	0	0	115.2
8	Y	32.4	Very low	33	Very low	219 Å²	219	161.4 Å²	161.4	86%	0.859	81%	0.809	S	S	*	*			trans	-53.5	142.1	178.3	-99.8	-115.1	0	0	0	116.2
9	M	32.6	Very low	33.1	Very low	188 Å²	188	159.3 Å²	159.3	93%	0.926	80%	0.804	S	S	*	*				-168	146.8	121.9	-111.2	-169.6	83.2	0	0	113.4
10	M	31.4	Very low	33.4	Very low	162 Å²	162	160 Å²	160	80%	0.798	81%	0.809	S	S	*	*			trans	-69.8	173	-166.4	-76.7	171	141.9	0	0	117.2
11	C	32.2	Very low	33.3	Very low	121 Å²	121	156.2 Å²	156.2	82%	0.818	81%	0.811	S	S	*	*			trans	90.8	119.7	161.6	-62.3	0	0	0	0	113.2
12	V	34.4	Very low	33.6	Very low	136 Å²	136	148.9 Å²	148.9	82%	0.824	79%	0.792	S	S	*	*			cis	-155.5	135.5	33.2	167.1	0	0	0	0	109
13	W	30.2	Very low	33.5	Very low	220 Å²	220	153.1 Å²	153.1	83%	0.833	80%	0.799	S	S	*	*			trans	-63.1	142	166.3	-76.6	52	0	0	0	110.2
14	L	31.9	Very low	33.9	Very low	158 Å²	158	151.8 Å²	151.8	83%	0.827	80%	0.799	S	S	*	*				-167.6	148.1	82.5	-92.4	162.2	0	0	0	112.6
15	S	33.2	Very low	34.2	Very low	96 Å²	96	149.6 Å²	149.6	67%	0.671	80%	0.799	S	S	*	*			trans	-83.7	159.7	-168.5	44	0	0	0	0	115.5
16	S	32.2	Very low	34.6	Very low	107 Å²	107	153.9 Å²	153.9	75%	0.748	81%	0.806	S	S	*	*			trans	-67.9	160.9	163	-81.2	0	0	0	0	114.3
17	W	31.5	Very low	34.7	Very low	227 Å²	227	157.8 Å²	157.8	86%	0.86	81%	0.811	S	S	*	*			trans	100.7	109.2	150.8	-76.8	14.1	0	0	0	121.3
18	R	33.2	Very low	35.1	Very low	219 Å²	219	159.6 Å²	159.6	83%	0.826	81%	0.812	S	S	*	*				42.3	128.8	127.4	-54.9	-170.9	175.6	-154.7	-0.6	120.3
19	V	34.8	Very low	35.6	Very low	120 Å²	120	157.9 Å²	157.9	73%	0.727	82%	0.817	S	S	*	*				144.3	118.8	115.5	171.8	0	0	0	0	111.8
20	L	40.6	Very low	36	Very low	173 Å²	173	153.3 Å²	153.3	91%	0.906	81%	0.808	S	S	*	*			trans	54.1	123.7	147.9	-56.2	166.9	0	0	0	121.8
21	G	30.5	Very low	36.3	Very low	81 Å²	81	154 Å²	154	84%	0.835	81%	0.814	S	S	*	*			trans	-174.4	97.5	158.3	0	0	0	0	0	110.5
22	G	38.3	Very low	36.4	Very low	69 Å²	69	151.6 Å²	151.6	71%	0.711	81%	0.81	S	S	*	*			trans	-83.7	147.3	176.8	0	0	0	0	0	113
23	Y	32.4	Very low	36.4	Very low	228 Å²	228	152.9 Å²	152.9	89%	0.894	81%	0.808	S	S	*	*			trans	-146.7	157.3	156.1	-90.6	-75.7	0	0	0	107.9
24	P	41.1	Very low	36.6	Very low	105 Å²	105	150.8 Å²	150.8	68%	0.682	81%	0.807	S	S	*	*			trans	-102.3	131.7	-136.3	29.4	-14	0	0	0	111.3	W26	P24-W26 PolarHBondContact O-N 2.82Å
25	I	41.6	Very low	36.8	Very low	152 Å²	152	152.9 Å²	152.9	78%	0.779	81%	0.805	S	S	*	*			trans	-99	88	170.2	-56.2	171.8	0	0	0	106.4
26	W	44.8	Very low	37	Very low	222 Å²	222	153.1 Å²	153.1	84%	0.841	81%	0.807	S	S	*	*			trans	-60.6	145.7	150.1	-86.8	25.8	0	0	0	107.5	P24	P24-W26 PolarHBondContact O-N 2.82Å
27	W	37.8	Very low	37.4	Very low	235 Å²	235	153.5 Å²	153.5	89%	0.89	81%	0.81	S	S	*	*			trans	87.3	70.6	-175.8	-51.5	89.9	0	0	0	116
28	S	39.6	Very low	38	Very low	113 Å²	113	151.4 Å²	151.4	79%	0.79	81%	0.814	S	S	*	*			trans	-161.8	68.1	147.7	-76.2	0	0	0	0	110.4
29	L	42.8	Very low	38.6	Very low	184 Å²	184	144.4 Å²	144.4	96%	0.963	81%	0.81	S	S	*	*			trans	-112.2	86.9	162.9	-77.2	173	0	0	0	108
30	A	41.1	Very low	39.3	Very low	91 Å²	91	144 Å²	144	75%	0.752	81%	0.812	S	S	*	*			trans	-176.6	59.9	157.4	0	0	0	0	0	110.5
31	L	38.7	Very low	40	Very low	176 Å²	176	144.2 Å²	144.2	92%	0.921	81%	0.809	S	S	*	*			trans	-129.5	79.3	153.1	-75.4	172.3	0	0	0	105.9	Q33	L31-Q33 PolarHBondContact O-N 2.92Å
32	G	33.1	Very low	41.5	Very low	71 Å²	71	146.3 Å²	146.3	73%	0.732	81%	0.807	S	S	*	*			trans	-56.7	124.8	166.1	0	0	0	0	0	107.9	Q34	G32-Q34 PolarHBondContact O-N 3.26Å
33	Q	34.8	Very low	42.9	Very low	164 Å²	164	146.4 Å²	146.4	77%	0.766	79%	0.791	S	S	*	*			trans	-54.4	106.6	163.2	-81.2	166.2	-67.8	0	0	107.2	L31 Y35	L31-Q33 PolarHBondContact O-N 2.92Å; Q33-Y35 PolarHBondContact O-N 2.76Å
34	Q	34.8	Very low	45.1	Very low	176 Å²	176	141.7 Å²	141.7	82%	0.822	78%	0.78	S	S	*	*			trans	-61	97.3	159.3	-82.5	175.7	-20.8	0	0	106.2	G32 S36	G32-Q34 PolarHBondContact O-N 3.26Å; Q34-S36 PolarHBondContact O-N 3.39Å
35	Y	36.7	Very low	47	Very low	202 Å²	202	137.1 Å²	137.1	79%	0.792	75%	0.751	S	S	*	*			trans	-63	88.7	151.9	-82.3	-90.9	0	0	0	105.9	Q33 S37	Q33-Y35 PolarHBondContact O-N 2.76Å; Y35-S37 VanDerWaalsContact C-N 3.29Å; Y35-S37 PolarHBondContact O-N 2.78Å
36	S	36.8	Very low	48.6	Very low	100 Å²	100	132.9 Å²	132.9	70%	0.699	75%	0.745	S	S	*	*			trans	-59.8	101.1	161.5	-57.2	0	0	0	0	106	Q34 L38	Q34-S36 PolarHBondContact O-N 3.39Å; S36-L38 PolarHBondContact O-N 2.81Å
37	S	41.4	Very low	50.1	Low	116 Å²	116	126.3 Å²	126.3	81%	0.811	73%	0.733	S	S	*	*			trans	-59.4	114	170.3	55.5	0	0	0	0	107.4	Y35 G39	Y35-S37 VanDerWaalsContact C-N 3.29Å; Y35-S37 PolarHBondContact O-N 2.78Å; S37-G39 PolarHBondContact O-N 2.92Å
38	L	44.2	Very low	51.8	Low	183 Å²	183	116.1 Å²	116.1	96%	0.958	70%	0.695	S	S	*	*			trans	-72.3	109.5	168.1	-142.8	82.6	0	0	0	106.6	S36	S36-L38 PolarHBondContact O-N 2.81Å
39	G	45.6	Very low	53.3	Low	71 Å²	71	115 Å²	115	73%	0.732	69%	0.686	S	S	*	*			trans	122.7	75.3	152.3	0	0	0	0	0	118.3	S37	S37-G39 PolarHBondContact O-N 2.92Å
40	S	49.8	Very low	54.6	Low	111 Å²	111	108.4 Å²	108.4	78%	0.776	66%	0.662	S	S	*	*			trans	-163.4	116	132.5	49.4	0	0	0	0	107.5
41	Q	55.3	Low	56.6	Low	179 Å²	179	105.1 Å²	105.1	84%	0.836	63%	0.631	S	S	*	*			trans	-54.1	140.4	168.1	-72	-162.1	-24.5	0	0	108.6	I43	Q41-I43 PolarHBondContact O-N 2.92Å
42	P	61	Low	58.8	Low	124 Å²	124	98.5 Å²	98.5	81%	0.805	60%	0.598	S	S	*	*			trans	-55.8	120.4	178.6	21.8	-31.1	0	0	0	108.4	L44	P42-L44 PolarHBondContact O-N 3.16Å
43	I	66.8	Low	61.5	Low	71 Å²	71	100.3 Å²	100.3	36%	0.364	60%	0.597	S	S	.	*			trans	-59.3	115.7	178.9	-64.2	174.3	0	0	0	106.9	Q41 C45 I48 I63 P67	Q41-I43 PolarHBondContact O-N 2.92Å; I43-C45 PolarHBondContact O-N 2.03Å; I43-I48 HydrophobicContact CG2-CD1 3.97Å; I43-I48 HydrophobicContact CG2-CG1 4.23Å; I43-I63 HydrophobicContact CB-CD1 4.25Å; I43-I63 VanDerWaalsContact O-CD1 3.32Å; I43-I63 WeakPolarHBondContact O-CD1 3.06Å; I43-P67 HydrophobicContact CD1-CG 3.87Å
44	L	78.8	Confident	64.1	Low	129 Å²	129	97.6 Å²	97.6	68%	0.675	58%	0.583	S	S	*	*			trans	-79.2	111.7	172.4	-153.1	82.2	0	0	0	106.8	P42 G46 S47	P42-L44 PolarHBondContact O-N 3.16Å; L44-G46 PolarHBondContact O-N 3.32Å; L44-S47 PolarHBondContact O-N 3.04Å; L44-S47 PolarHBondContact O-OG 3.19Å
45	C	81.5	Confident	66.7	Low	10 Å²	10	89.3 Å²	89.3	7%	0.068	54%	0.544	C	S	.	.	G	3₁₀ helix	trans	-50.6	-28.2	178.9	-67.8	0	0	0	0	113.8	I43 S47 I48 L56 C59	I43-C45 PolarHBondContact O-N 2.03Å; C45-S47 VanDerWaalsContact C-N 3.33Å; C45-I48 PolarHBondContact O-N 3.22Å; C45-L56 HydrophobicContact CB-CD2 4.14Å; C45-L56 VanDerWaalsContact O-CD2 3.25Å; C45-L56 WeakPolarHBondContact O-CD2 3.26Å; C45-C59 VanDerWaalsContact CA-SG 3.56Å; C45-C59 HydrophobicContact CB-CB 3.79Å; C45-C59 WeakPolarHBondContact CB-SG 3.38Å; C45-C59 WeakPolarHBondContact SG-CB 3.43Å; C45-C59 PolarHBondContact SG-O 3.13Å; C45-C59 CovalentContact SG-SG 2.03Å; C45-C59 PolarHBondContact SG-SG 2.87Å
46	G	75.7	Confident	69.2	Low	63 Å²	63	81.8 Å²	81.8	65%	0.649	52%	0.517	S	S	*	.	G	3₁₀ helix	trans	-73.4	-15.5	176.7	0	0	0	0	0	115.3	L44	L44-G46 PolarHBondContact O-N 3.32Å
47	S	76.1	Confident	71.9	Confident	83 Å²	83	85.7 Å²	85.7	58%	0.58	52%	0.517	S	S	*	.	G	3₁₀ helix	trans	-87.6	-8	174.1	67.1	0	0	0	0	113.1	L44 C45 P49	L44-S47 PolarHBondContact O-N 3.04Å; L44-S47 PolarHBondContact O-OG 3.19Å; C45-S47 VanDerWaalsContact C-N 3.33Å; S47-P49 VanDerWaalsContact O-CD 3.24Å; S47-P49 WeakPolarHBondContact O-CD 3.4Å
48	I	72.5	Confident	74.3	Confident	21 Å²	21	80.9 Å²	80.9	11%	0.108	48%	0.481	C	S	.	.	S	Bend	trans	-77.5	111.3	175.4	-58.2	174.8	0	0	0	108.3	I43 C45 L51 M66 L98	I43-I48 HydrophobicContact CG2-CD1 3.97Å; I43-I48 HydrophobicContact CG2-CG1 4.23Å; C45-I48 PolarHBondContact O-N 3.22Å; I48-L51 HydrophobicContact CB-CD1 3.75Å; I48-L51 HydrophobicContact CB-CG 3.96Å; I48-L51 HydrophobicContact CD1-CD1 4Å; I48-L51 HydrophobicContact CG1-CD1 4.43Å; I48-L51 HydrophobicContact CG2-CD1 3.84Å; I48-L51 HydrophobicContact CG2-CD2 4.07Å; I48-L51 HydrophobicContact CG2-CG 3.66Å; I48-M66 HydrophobicContact CD1-CE 4.32Å; I48-L98 HydrophobicContact CG2-CB 4.15Å; I48-L98 HydrophobicContact CG2-CD1 3.89Å; I48-L98 HydrophobicContact CG2-CG 4.4Å
49	P	71.2	Confident	76.5	Confident	91 Å²	91	72.2 Å²	72.2	59%	0.591	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	139.5	-178.1	28.2	-33.9	0	0	0	110.5	S47	S47-P49 VanDerWaalsContact O-CD 3.24Å; S47-P49 WeakPolarHBondContact O-CD 3.4Å
50	G	71.7	Confident	78.6	Confident	44 Å²	44	77.7 Å²	77.7	45%	0.454	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.5	4.3	170.6	0	0	0	0	0	116.6	R176	G50-R176 PolarHBondContact O-NH1 3.17Å; G50-R176 VanDerWaalsContact O-NH1 3.14Å
51	L	81.5	Confident	80.6	Confident	22 Å²	22	77.6 Å²	77.6	12%	0.115	43%	0.425	C	S	.	.			trans	-73.7	133.3	172.6	-63.9	-171	0	0	0	112.2	I48 Q55 L56 C59 F172	I48-L51 HydrophobicContact CB-CD1 3.75Å; I48-L51 HydrophobicContact CB-CG 3.96Å; I48-L51 HydrophobicContact CD1-CD1 4Å; I48-L51 HydrophobicContact CG1-CD1 4.43Å; I48-L51 HydrophobicContact CG2-CD1 3.84Å; I48-L51 HydrophobicContact CG2-CD2 4.07Å; I48-L51 HydrophobicContact CG2-CG 3.66Å; L51-Q55 HydrophobicContact CB-CB 4.21Å; L51-Q55 HydrophobicContact CD2-CB 4.07Å; L51-L56 HydrophobicContact CB-CD2 4Å; L51-L56 HydrophobicContact CB-CG 4.01Å; L51-L56 HydrophobicContact CD1-CD2 4.05Å; L51-C59 HydrophobicContact CD1-CB 4.39Å; L51-F172 HydrophobicContact CD2-CE2 3.93Å; L51-F172 HydrophobicContact CD2-CZ 3.63Å
52	V	85.4	Confident	82.3	Confident	38 Å²	38	72.7 Å²	72.7	23%	0.23	40%	0.399	C	S	.	.			trans	-81.8	161.3	171.4	-59.5	0	0	0	0	111.4	K54 Q55 L56 R176	V52-K54 HydrophobicContact CG2-CB 4.42Å; V52-K54 PolarHBondContact O-N 3.42Å; V52-Q55 HydrophobicContact CG2-CB 4.12Å; V52-Q55 HydrophobicContact CG2-CG 3.76Å; V52-Q55 VanDerWaalsContact N-OE1 3.12Å; V52-Q55 WeakPolarHBondContact O-CA 3.4Å; V52-Q55 WeakPolarHBondContact O-CB 3.34Å; V52-Q55 PolarHBondContact O-N 2.92Å; V52-L56 PolarHBondContact O-N 3.42Å; V52-R176 HydrophobicContact CB-CG 4.25Å; V52-R176 HydrophobicContact CG1-CG 3.73Å; V52-R176 HydrophobicContact CG2-CG 3.49Å; V52-R176 VanDerWaalsContact CG2-CG 3.49Å
53	P	89.6	Confident	83.6	Confident	108 Å²	108	70 Å²	70	70%	0.701	38%	0.377	S	S	*	.	H	α-helix	trans	-51.7	-35.3	-179.4	-30.8	37	0	0	0	115.5	L56 R57	P53-L56 PolarHBondContact O-N 2.7Å; P53-R57 PolarHBondContact O-N 3.04Å; P53-R57 VanDerWaalsContact O-N 3.14Å
54	K	89.2	Confident	84.7	Confident	107 Å²	107	71.3 Å²	71.3	47%	0.465	38%	0.382	S	S	.	.	H	α-helix	trans	-67.5	-41.7	176	-169.8	175.6	174.2	-169.6	0	111.9	V52 R57 F58 A175	V52-K54 HydrophobicContact CG2-CB 4.42Å; V52-K54 PolarHBondContact O-N 3.42Å; K54-R57 PolarHBondContact O-N 3.45Å; K54-F58 PolarHBondContact O-N 2.86Å; K54-F58 VanDerWaalsContact O-N 3.1Å; K54-A175 HydrophobicContact CB-CB 4.11Å; K54-A175 HydrophobicContact CD-CB 3.86Å; K54-A175 HydrophobicContact CG-CB 3.86Å
55	Q	89.9	Confident	85.3	Confident	2 Å²	2	65.2 Å²	65.2	1%	0.009	35%	0.35	C	S	.	.	H	α-helix	trans	-68.8	-35.1	174.3	-69.3	175.3	-42.4	0	0	112.3	L51 V52 R57 F58 C59 F172 A175 R176	L51-Q55 HydrophobicContact CB-CB 4.21Å; L51-Q55 HydrophobicContact CD2-CB 4.07Å; V52-Q55 HydrophobicContact CG2-CB 4.12Å; V52-Q55 HydrophobicContact CG2-CG 3.76Å; V52-Q55 VanDerWaalsContact N-OE1 3.12Å; V52-Q55 WeakPolarHBondContact O-CA 3.4Å; V52-Q55 WeakPolarHBondContact O-CB 3.34Å; V52-Q55 PolarHBondContact O-N 2.92Å; Q55-R57 VanDerWaalsContact C-N 3.29Å; Q55-R57 PolarHBondContact O-N 3.31Å; Q55-F58 WeakPolarHBondContact O-CB 3.31Å; Q55-F58 PolarHBondContact O-N 2.87Å; Q55-C59 WeakPolarHBondContact O-CB 3.26Å; Q55-C59 PolarHBondContact O-N 2.9Å; Q55-F172 HydrophobicContact CB-CD2 4.43Å; Q55-F172 HydrophobicContact CB-CE2 4.08Å; Q55-F172 HydrophobicContact CG-CD2 4.28Å; Q55-F172 HydrophobicContact CG-CE2 4.21Å; Q55-F172 PolarHBondContact NE2-O 2.83Å; Q55-A175 HydrophobicContact CG-CB 3.63Å; Q55-R176 VanDerWaalsContact OE1-CD 3.31Å
56	L	90.4	Very high	85.7	Confident	45 Å²	45	65 Å²	65	24%	0.236	35%	0.348	C	S	.	.	H	α-helix	trans	-61.9	-38.7	173.8	-74.9	171.3	0	0	0	111.8	C45 L51 V52 P53 R60	C45-L56 HydrophobicContact CB-CD2 4.14Å; C45-L56 VanDerWaalsContact O-CD2 3.25Å; C45-L56 WeakPolarHBondContact O-CD2 3.26Å; L51-L56 HydrophobicContact CB-CD2 4Å; L51-L56 HydrophobicContact CB-CG 4.01Å; L51-L56 HydrophobicContact CD1-CD2 4.05Å; V52-L56 PolarHBondContact O-N 3.42Å; P53-L56 PolarHBondContact O-N 2.7Å; L56-R60 WeakPolarHBondContact O-CG 3.26Å; L56-R60 PolarHBondContact O-N 3.02Å; L56-R60 VanDerWaalsContact O-N 3.1Å
57	R	91.6	Very high	86.4	Confident	182 Å²	182	65 Å²	65	69%	0.687	34%	0.337	S	S	*	.	H	α-helix	trans	-65.9	-44.7	174.1	-169.1	-178.6	-60.5	174.8	0.7	111.4	P53 K54 Q55 R60 N61	P53-R57 PolarHBondContact O-N 3.04Å; P53-R57 VanDerWaalsContact O-N 3.14Å; K54-R57 PolarHBondContact O-N 3.45Å; Q55-R57 VanDerWaalsContact C-N 3.29Å; Q55-R57 PolarHBondContact O-N 3.31Å; R57-R60 PolarHBondContact O-N 2.04Å; R57-N61 PolarHBondContact O-N 3.27Å
58	F	91.8	Very high	87.2	Confident	15 Å²	15	61.9 Å²	61.9	7%	0.066	32%	0.315	C	S	.	.	H	α-helix	trans	-56.5	-51.4	173.9	-179	-85.6	0	0	0	111.3	K54 Q55 R60 N61 Y62 M66 V168 E171 F172	K54-F58 PolarHBondContact O-N 2.86Å; K54-F58 VanDerWaalsContact O-N 3.1Å; Q55-F58 WeakPolarHBondContact O-CB 3.31Å; Q55-F58 PolarHBondContact O-N 2.87Å; F58-R60 VanDerWaalsContact C-N 3.28Å; F58-R60 PolarHBondContact O-N 3.02Å; F58-N61 PolarHBondContact O-N 3.47Å; F58-Y62 HydrophobicContact CD1-CD2 4.28Å; F58-Y62 AromaticContact CD2-CD2 3.61Å; F58-Y62 HydrophobicContact CD2-CD2 3.61Å; F58-Y62 AromaticContact CD2-CE2 3.91Å; F58-Y62 HydrophobicContact CD2-CE2 3.91Å; F58-Y62 HydrophobicContact CE1-CD2 4.08Å; F58-Y62 HydrophobicContact CE1-CG 4.26Å; F58-Y62 AromaticContact CE2-CD2 3.37Å; F58-Y62 HydrophobicContact CE2-CD2 3.37Å; F58-Y62 AromaticContact CE2-CE2 3.63Å; F58-Y62 HydrophobicContact CE2-CE2 3.63Å; F58-Y62 HydrophobicContact CE2-CG 4.12Å; F58-Y62 HydrophobicContact CG-CD2 4.05Å; F58-Y62 AromaticContact CZ-CD2 3.6Å; F58-Y62 HydrophobicContact CZ-CD2 3.6Å; F58-Y62 HydrophobicContact CZ-CE2 4.24Å; F58-Y62 AromaticContact CZ-CG 3.89Å; F58-Y62 HydrophobicContact CZ-CG 3.89Å; F58-Y62 WeakPolarHBondContact O-CD2 3.23Å; F58-Y62 PolarHBondContact O-N 3.26Å; F58-M66 HydrophobicContact CD1-SD 4.12Å; F58-M66 HydrophobicContact CE1-SD 4.09Å; F58-V168 HydrophobicContact CE1-CG1 4.42Å; F58-V168 HydrophobicContact CZ-CB 4.41Å; F58-V168 HydrophobicContact CZ-CG1 3.89Å; F58-V168 HydrophobicContact CZ-CG2 4.43Å; F58-E171 HydrophobicContact CD2-CB 3.72Å; F58-E171 HydrophobicContact CE2-CB 3.51Å; F58-E171 HydrophobicContact CE2-CG 4.39Å; F58-F172 HydrophobicContact CD1-CB 4.31Å; F58-F172 AromaticContact CD1-CD2 3.68Å; F58-F172 HydrophobicContact CD1-CD2 3.68Å; F58-F172 HydrophobicContact CD1-CG 4.45Å; F58-F172 HydrophobicContact CE1-CB 4.2Å; F58-F172 HydrophobicContact CE1-CD2 4.14Å; F58-F172 HydrophobicContact CG-CD2 4.38Å
59	C	90.8	Very high	88.2	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-57.2	-39.6	-179.6	177.5	0	0	0	0	112.5	C45 L51 Q55 Y62 I63 M66	C45-C59 VanDerWaalsContact CA-SG 3.56Å; C45-C59 HydrophobicContact CB-CB 3.79Å; C45-C59 WeakPolarHBondContact CB-SG 3.38Å; C45-C59 WeakPolarHBondContact SG-CB 3.43Å; C45-C59 PolarHBondContact SG-O 3.13Å; C45-C59 CovalentContact SG-SG 2.03Å; C45-C59 PolarHBondContact SG-SG 2.87Å; L51-C59 HydrophobicContact CD1-CB 4.39Å; Q55-C59 WeakPolarHBondContact O-CB 3.26Å; Q55-C59 PolarHBondContact O-N 2.9Å; C59-Y62 CarbonylContact O-C 3.56Å; C59-Y62 PolarHBondContact O-N 3.3Å; C59-I63 WeakPolarHBondContact O-CA 3.42Å; C59-I63 WeakPolarHBondContact O-CB 2.99Å; C59-I63 PolarHBondContact O-N 2.93Å; C59-M66 HydrophobicContact CB-CE 4.23Å; C59-M66 HydrophobicContact CB-CG 4.22Å; C59-M66 HydrophobicContact CB-SD 3.99Å
60	R	91	Very high	89.1	Confident	187 Å²	187	58 Å²	58	71%	0.706	29%	0.294	S	S	*	.	H	α-helix	trans	-66.5	-37.8	176.4	-72.9	174.4	-176.7	178.7	1.2	112.7	L56 R57 F58	L56-R60 WeakPolarHBondContact O-CG 3.26Å; L56-R60 PolarHBondContact O-N 3.02Å; L56-R60 VanDerWaalsContact O-N 3.1Å; R57-R60 PolarHBondContact O-N 2.04Å; F58-R60 VanDerWaalsContact C-N 3.28Å; F58-R60 PolarHBondContact O-N 3.02Å
61	N	90.7	Very high	90	Very high	108 Å²	108	60.1 Å²	60.1	58%	0.578	29%	0.292	S	S	*	.	H	α-helix	trans	-76.2	-28.4	-179.7	-68	-4.4	0	0	0	112.5	R57 F58	R57-N61 PolarHBondContact O-N 3.27Å; F58-N61 PolarHBondContact O-N 3.47Å
62	Y	90.3	Very high	90.6	Very high	77 Å²	77	59 Å²	59	30%	0.302	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.2	35.4	-171.9	-67.5	-74.6	0	0	0	112.1	F58 C59 E64 I65 M66	F58-Y62 HydrophobicContact CD1-CD2 4.28Å; F58-Y62 AromaticContact CD2-CD2 3.61Å; F58-Y62 HydrophobicContact CD2-CD2 3.61Å; F58-Y62 AromaticContact CD2-CE2 3.91Å; F58-Y62 HydrophobicContact CD2-CE2 3.91Å; F58-Y62 HydrophobicContact CE1-CD2 4.08Å; F58-Y62 HydrophobicContact CE1-CG 4.26Å; F58-Y62 AromaticContact CE2-CD2 3.37Å; F58-Y62 HydrophobicContact CE2-CD2 3.37Å; F58-Y62 AromaticContact CE2-CE2 3.63Å; F58-Y62 HydrophobicContact CE2-CE2 3.63Å; F58-Y62 HydrophobicContact CE2-CG 4.12Å; F58-Y62 HydrophobicContact CG-CD2 4.05Å; F58-Y62 AromaticContact CZ-CD2 3.6Å; F58-Y62 HydrophobicContact CZ-CD2 3.6Å; F58-Y62 HydrophobicContact CZ-CE2 4.24Å; F58-Y62 AromaticContact CZ-CG 3.89Å; F58-Y62 HydrophobicContact CZ-CG 3.89Å; F58-Y62 WeakPolarHBondContact O-CD2 3.23Å; F58-Y62 PolarHBondContact O-N 3.26Å; C59-Y62 CarbonylContact O-C 3.56Å; C59-Y62 PolarHBondContact O-N 3.3Å; Y62-E64 VanDerWaalsContact C-N 3.25Å; Y62-E64 PolarHBondContact O-N 2.86Å; Y62-I65 HydrophobicContact CD1-CD1 3.95Å; Y62-I65 HydrophobicContact CG-CD1 4.18Å; Y62-I65 WeakPolarHBondContact O-CG1 3.29Å; Y62-I65 PolarHBondContact O-N 2.91Å; Y62-I65 VanDerWaalsContact O-N 3.13Å; Y62-M66 WeakPolarHBondContact O-CG 3.06Å; Y62-M66 PolarHBondContact O-N 3.46Å
63	I	88.9	Confident	90.8	Very high	67 Å²	67	57.2 Å²	57.2	34%	0.344	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-59.2	-35	-170.7	-171.6	63.5	0	0	0	113.3	I43 C59 I65 M66	I43-I63 HydrophobicContact CB-CD1 4.25Å; I43-I63 VanDerWaalsContact O-CD1 3.32Å; I43-I63 WeakPolarHBondContact O-CD1 3.06Å; C59-I63 WeakPolarHBondContact O-CA 3.42Å; C59-I63 WeakPolarHBondContact O-CB 2.99Å; C59-I63 PolarHBondContact O-N 2.93Å; I63-I65 VanDerWaalsContact C-N 3.29Å; I63-I65 PolarHBondContact O-N 2.97Å; I63-M66 HydrophobicContact CD1-CG 4.48Å; I63-M66 PolarHBondContact O-N 3.49Å
64	E	89.4	Confident	90.9	Very high	98 Å²	98	55.4 Å²	55.4	46%	0.458	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-63	-32.6	-179.7	-67.6	-174.2	-165.5	0	0	113	Y62 P67 T137	Y62-E64 VanDerWaalsContact C-N 3.25Å; Y62-E64 PolarHBondContact O-N 2.86Å; E64-P67 WeakPolarHBondContact O-CD 3.32Å; E64-T137 PolarHBondContact OE1-OG1 3.46Å; E64-T137 PolarHBondContact OE2-N 2.74Å; E64-T137 PolarHBondContact OE2-OG1 3.08Å
65	I	91.5	Very high	91.2	Very high	2 Å²	2	52.2 Å²	52.2	1%	0.01	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-96.1	-6.3	-177.6	62.6	168.1	0	0	0	113.2	Y62 I63 P67 S68 V69 S136 F164 V168	Y62-I65 HydrophobicContact CD1-CD1 3.95Å; Y62-I65 HydrophobicContact CG-CD1 4.18Å; Y62-I65 WeakPolarHBondContact O-CG1 3.29Å; Y62-I65 PolarHBondContact O-N 2.91Å; Y62-I65 VanDerWaalsContact O-N 3.13Å; I63-I65 VanDerWaalsContact C-N 3.29Å; I63-I65 PolarHBondContact O-N 2.97Å; I65-P67 VanDerWaalsContact C-CD 3.42Å; I65-S68 WeakPolarHBondContact O-CB 2.99Å; I65-S68 PolarHBondContact O-N 2.83Å; I65-V69 PolarHBondContact O-N 2.78Å; I65-V69 VanDerWaalsContact O-N 3.07Å; I65-S136 WeakPolarHBondContact CG2-OG 3.05Å; I65-F164 HydrophobicContact CD1-CE1 4.36Å; I65-F164 HydrophobicContact CD1-CZ 4.25Å; I65-V168 HydrophobicContact CD1-CB 4.42Å; I65-V168 HydrophobicContact CD1-CG1 3.93Å; I65-V168 HydrophobicContact CD1-CG2 3.59Å
66	M	90.9	Very high	91.4	Very high	5 Å²	5	52.1 Å²	52.1	3%	0.025	24%	0.244	C	C	.	.	H	α-helix	trans	-59.8	-34.7	179	-73.1	-57.8	-53.1	0	0	114.8	I48 F58 C59 Y62 I63 S68 V69 A70 F172	I48-M66 HydrophobicContact CD1-CE 4.32Å; F58-M66 HydrophobicContact CD1-SD 4.12Å; F58-M66 HydrophobicContact CE1-SD 4.09Å; C59-M66 HydrophobicContact CB-CE 4.23Å; C59-M66 HydrophobicContact CB-CG 4.22Å; C59-M66 HydrophobicContact CB-SD 3.99Å; Y62-M66 WeakPolarHBondContact O-CG 3.06Å; Y62-M66 PolarHBondContact O-N 3.46Å; I63-M66 HydrophobicContact CD1-CG 4.48Å; I63-M66 PolarHBondContact O-N 3.49Å; M66-S68 VanDerWaalsContact C-N 3.26Å; M66-S68 PolarHBondContact O-N 2.89Å; M66-V69 HydrophobicContact CE-CB 4.35Å; M66-V69 HydrophobicContact CE-CG1 4.31Å; M66-V69 PolarHBondContact O-N 3.44Å; M66-V69 HydrophobicContact SD-CB 4.49Å; M66-V69 HydrophobicContact SD-CG2 4.33Å; M66-A70 PolarHBondContact O-N 3.48Å; M66-F172 HydrophobicContact CE-CE2 3.81Å; M66-F172 HydrophobicContact CE-CZ 4.1Å; M66-F172 HydrophobicContact SD-CE2 4.47Å
67	P	90.1	Very high	91.4	Very high	63 Å²	63	50.1 Å²	50.1	41%	0.409	23%	0.233	S	C	.	.	H	α-helix	trans	-56.5	-41.6	170.8	-24.8	34.2	0	0	0	112.4	I43 E64 I65 A70 E71	I43-P67 HydrophobicContact CD1-CG 3.87Å; E64-P67 WeakPolarHBondContact O-CD 3.32Å; I65-P67 VanDerWaalsContact C-CD 3.42Å; P67-A70 PolarHBondContact O-N 3.06Å; P67-E71 PolarHBondContact O-N 2.79Å
68	S	93.6	Very high	91.6	Very high	17 Å²	17	46.1 Å²	46.1	12%	0.119	22%	0.222	C	C	.	.	H	α-helix	trans	-70.8	-34.5	179.4	-43	0	0	0	0	111.8	I65 M66 G72 A126 S130	I65-S68 WeakPolarHBondContact O-CB 2.99Å; I65-S68 PolarHBondContact O-N 2.83Å; M66-S68 VanDerWaalsContact C-N 3.26Å; M66-S68 PolarHBondContact O-N 2.89Å; S68-G72 PolarHBondContact O-N 3.04Å; S68-A126 WeakPolarHBondContact O-CB 3.38Å; S68-S130 VanDerWaalsContact OG-CB 3.25Å; S68-S130 WeakPolarHBondContact OG-CB 3.3Å; S68-S130 PolarHBondContact OG-OG 3.41Å
69	V	92.5	Very high	91.8	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-60.8	-47.8	169.7	175.4	0	0	0	0	110.6	I65 M66 G72 V73 V123 V127 V168 F172	I65-V69 PolarHBondContact O-N 2.78Å; I65-V69 VanDerWaalsContact O-N 3.07Å; M66-V69 HydrophobicContact CE-CB 4.35Å; M66-V69 HydrophobicContact CE-CG1 4.31Å; M66-V69 PolarHBondContact O-N 3.44Å; M66-V69 HydrophobicContact SD-CB 4.49Å; M66-V69 HydrophobicContact SD-CG2 4.33Å; V69-G72 PolarHBondContact O-N 3.29Å; V69-V73 WeakPolarHBondContact O-CG2 3.14Å; V69-V73 PolarHBondContact O-N 2.02Å; V69-V73 VanDerWaalsContact O-N 3.09Å; V69-V123 HydrophobicContact CB-CG1 4.4Å; V69-V123 HydrophobicContact CG1-CG1 4.03Å; V69-V123 HydrophobicContact CG1-CG2 4.18Å; V69-V123 HydrophobicContact CG2-CG1 4.18Å; V69-V127 HydrophobicContact CG2-CG2 3.83Å; V69-V168 HydrophobicContact CG2-CG1 3.92Å; V69-F172 HydrophobicContact CG1-CD1 3.71Å; V69-F172 HydrophobicContact CG1-CE1 3.69Å; V69-F172 HydrophobicContact CG1-CG 4.18Å; V69-F172 HydrophobicContact CG1-CZ 4.17Å
70	A	89.3	Confident	92.1	Very high	31 Å²	31	46 Å²	46	26%	0.256	22%	0.222	S	C	.	.	H	α-helix	trans	-63.2	-44.9	179.5	0	0	0	0	0	112.5	M66 P67 G72 V73 K74 L98	M66-A70 PolarHBondContact O-N 3.48Å; P67-A70 PolarHBondContact O-N 3.06Å; A70-G72 VanDerWaalsContact C-N 3.29Å; A70-G72 PolarHBondContact O-N 2.88Å; A70-V73 PolarHBondContact O-N 2.81Å; A70-K74 PolarHBondContact O-N 3.08Å; A70-L98 HydrophobicContact CB-CD2 3.86Å
71	E	90.9	Very high	92.2	Very high	88 Å²	88	40.3 Å²	40.3	41%	0.411	20%	0.203	S	C	.	.	H	α-helix	trans	-64.8	-35.8	175.7	-169.4	60.6	-153.8	0	0	111.3	P67 V73 K74 L75	P67-E71 PolarHBondContact O-N 2.79Å; E71-V73 PolarHBondContact O-N 3.47Å; E71-K74 VanDerWaalsContact CD-NZ 3.3Å; E71-K74 PolarHBondContact O-N 2.92Å; E71-K74 IonicContact OE1-NZ 2.92Å; E71-K74 PolarHBondContact OE1-NZ 2.9Å; E71-K74 IonicContact OE2-NZ 3.13Å; E71-K74 PolarHBondContact OE2-NZ 3.42Å; E71-L75 VanDerWaalsContact O-CB 3.32Å; E71-L75 WeakPolarHBondContact O-CB 3.37Å; E71-L75 PolarHBondContact O-N 3.32Å
72	G	94.3	Very high	92.5	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-62.1	-41.3	176	0	0	0	0	0	113.7	S68 V69 A70 L75 G76 G122	S68-G72 PolarHBondContact O-N 3.04Å; V69-G72 PolarHBondContact O-N 3.29Å; A70-G72 VanDerWaalsContact C-N 3.29Å; A70-G72 PolarHBondContact O-N 2.88Å; G72-L75 PolarHBondContact O-N 2.81Å; G72-G76 PolarHBondContact O-N 3.5Å; G72-G122 VanDerWaalsContact CA-C 3.45Å; G72-G122 WeakPolarHBondContact CA-O 3.19Å; G72-G122 CarbonylContact O-C 3.56Å; G72-G122 VanDerWaalsContact O-C 3.29Å; G72-G122 VanDerWaalsContact O-CA 3.3Å; G72-G122 WeakPolarHBondContact O-CA 3.47Å
73	V	91.1	Very high	92.8	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-63.2	-46.6	173.9	-178.6	0	0	0	0	110.9	V69 A70 E71 L75 G76 I77 N97 I100 F101 V123	V69-V73 WeakPolarHBondContact O-CG2 3.14Å; V69-V73 PolarHBondContact O-N 2.02Å; V69-V73 VanDerWaalsContact O-N 3.09Å; A70-V73 PolarHBondContact O-N 2.81Å; E71-V73 PolarHBondContact O-N 3.47Å; V73-L75 VanDerWaalsContact C-N 3.34Å; V73-L75 PolarHBondContact O-N 3.3Å; V73-G76 PolarHBondContact O-N 2.88Å; V73-I77 PolarHBondContact O-N 3.32Å; V73-N97 WeakPolarHBondContact CG1-O 3.49Å; V73-I100 HydrophobicContact CG1-CB 3.98Å; V73-I100 HydrophobicContact CG1-CD1 3.3Å; V73-I100 HydrophobicContact CG1-CG1 4.25Å; V73-I100 HydrophobicContact CG1-CG2 4.26Å; V73-F101 HydrophobicContact CG2-CD2 4.31Å; V73-F101 HydrophobicContact CG2-CE2 3.29Å; V73-F101 HydrophobicContact CG2-CZ 3.76Å; V73-V123 HydrophobicContact CG2-CG2 3.58Å
74	K	90.6	Very high	93.1	Very high	69 Å²	69	31.9 Å²	31.9	30%	0.3	16%	0.162	S	C	.	.	H	α-helix	trans	-60.8	-43.1	178.8	177.8	-174.9	156.9	-137.6	0	111.6	A70 E71 G76 I77 Q78	A70-K74 PolarHBondContact O-N 3.08Å; E71-K74 VanDerWaalsContact CD-NZ 3.3Å; E71-K74 PolarHBondContact O-N 2.92Å; E71-K74 IonicContact OE1-NZ 2.92Å; E71-K74 PolarHBondContact OE1-NZ 2.9Å; E71-K74 IonicContact OE2-NZ 3.13Å; E71-K74 PolarHBondContact OE2-NZ 3.42Å; K74-G76 VanDerWaalsContact C-N 3.33Å; K74-G76 PolarHBondContact O-N 3.2Å; K74-I77 PolarHBondContact O-N 3.43Å; K74-Q78 WeakPolarHBondContact O-CB 3.32Å; K74-Q78 VanDerWaalsContact O-CG 3.32Å; K74-Q78 WeakPolarHBondContact O-CG 3.07Å; K74-Q78 PolarHBondContact O-N 3.37Å
75	L	94.9	Very high	93.2	Very high	41 Å²	41	33.9 Å²	33.9	22%	0.215	17%	0.165	C	C	.	.	H	α-helix	trans	-57.8	-46.4	173.8	176.6	64.5	0	0	0	111	E71 G72 V73 I77 Q78 E79 F125 F227	E71-L75 VanDerWaalsContact O-CB 3.32Å; E71-L75 WeakPolarHBondContact O-CB 3.37Å; E71-L75 PolarHBondContact O-N 3.32Å; G72-L75 PolarHBondContact O-N 2.81Å; V73-L75 VanDerWaalsContact C-N 3.34Å; V73-L75 PolarHBondContact O-N 3.3Å; L75-I77 PolarHBondContact O-N 3.45Å; L75-Q78 PolarHBondContact O-N 2.89Å; L75-E79 PolarHBondContact O-N 3.07Å; L75-F125 HydrophobicContact CD2-CD1 3.46Å; L75-F125 VanDerWaalsContact CD2-CD1 3.46Å; L75-F125 HydrophobicContact CD2-CE1 3.87Å; L75-F125 HydrophobicContact CD2-CG 4.39Å; L75-F227 HydrophobicContact CD1-CB 4.45Å; L75-F227 HydrophobicContact CD1-CD1 3.83Å; L75-F227 HydrophobicContact CD1-CE1 4.4Å; L75-F227 HydrophobicContact CD1-CG 4.26Å; L75-F227 HydrophobicContact CD2-CB 4.26Å; L75-F227 HydrophobicContact CD2-CD1 3.98Å; L75-F227 HydrophobicContact CD2-CD2 4Å; L75-F227 HydrophobicContact CD2-CE1 4.31Å; L75-F227 HydrophobicContact CD2-CE2 4.36Å; L75-F227 HydrophobicContact CD2-CG 3.81Å; L75-F227 HydrophobicContact CD2-CZ 4.5Å; L75-F227 HydrophobicContact CG-CD1 3.6Å; L75-F227 HydrophobicContact CG-CD2 4.48Å; L75-F227 HydrophobicContact CG-CE1 3.78Å; L75-F227 HydrophobicContact CG-CG 3.97Å; L75-F227 HydrophobicContact CG-CZ 4.32Å
76	G	94.9	Very high	93.1	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-58	-43.9	176	0	0	0	0	0	113.2	G72 V73 K74 E79 C80 I118	G72-G76 PolarHBondContact O-N 3.5Å; V73-G76 PolarHBondContact O-N 2.88Å; K74-G76 VanDerWaalsContact C-N 3.33Å; K74-G76 PolarHBondContact O-N 3.2Å; G76-E79 PolarHBondContact O-N 3.47Å; G76-C80 WeakPolarHBondContact O-CB 3.3Å; G76-C80 PolarHBondContact O-N 3.42Å; G76-I118 WeakPolarHBondContact O-CG1 3.01Å
77	I	91.3	Very high	93.2	Very high	3 Å²	3	37.5 Å²	37.5	2%	0.015	18%	0.181	C	C	.	.	H	α-helix	trans	-71.4	-38.9	178.4	-62.9	-50.1	0	0	0	112.7	V73 K74 L75 E79 C80 Q81 I94 I100 V115	V73-I77 PolarHBondContact O-N 3.32Å; K74-I77 PolarHBondContact O-N 3.43Å; L75-I77 PolarHBondContact O-N 3.45Å; I77-E79 VanDerWaalsContact C-N 3.27Å; I77-E79 PolarHBondContact O-N 2Å; I77-C80 WeakPolarHBondContact O-CB 3.06Å; I77-C80 PolarHBondContact O-N 3.12Å; I77-Q81 HydrophobicContact CG2-CG 4.42Å; I77-Q81 WeakPolarHBondContact O-CG 3.35Å; I77-Q81 PolarHBondContact O-N 2.6Å; I77-I94 HydrophobicContact CD1-CB 4.49Å; I77-I94 HydrophobicContact CD1-CD1 3.79Å; I77-I94 HydrophobicContact CD1-CG2 3.9Å; I77-I94 HydrophobicContact CG1-CG2 4.14Å; I77-I94 HydrophobicContact CG2-CB 4.48Å; I77-I94 HydrophobicContact CG2-CG2 4.44Å; I77-I100 HydrophobicContact CD1-CD1 3.77Å; I77-I100 HydrophobicContact CD1-CG1 4.29Å; I77-I100 HydrophobicContact CD1-CG2 4.38Å; I77-I100 HydrophobicContact CG1-CD1 3.35Å; I77-I100 HydrophobicContact CG1-CG1 4.37Å; I77-V115 HydrophobicContact CD1-CG1 4.35Å
78	Q	94	Very high	93.3	Very high	97 Å²	97	38.5 Å²	38.5	45%	0.453	18%	0.177	S	C	.	.	H	α-helix	trans	-60	-42.5	174.4	-75.1	179	-7.4	0	0	110.9	K74 L75 Q81 H82	K74-Q78 WeakPolarHBondContact O-CB 3.32Å; K74-Q78 VanDerWaalsContact O-CG 3.32Å; K74-Q78 WeakPolarHBondContact O-CG 3.07Å; K74-Q78 PolarHBondContact O-N 3.37Å; L75-Q78 PolarHBondContact O-N 2.89Å; Q78-Q81 PolarHBondContact O-N 2.85Å; Q78-H82 WeakPolarHBondContact O-CB 3.38Å; Q78-H82 PolarHBondContact O-N 3.19Å
79	E	97.7	Very high	93.2	Very high	12 Å²	12	38.3 Å²	38.3	6%	0.056	17%	0.174	C	C	.	.	H	α-helix	trans	-69.2	-36.3	175.7	-169.1	51.9	-140.8	0	0	111.7	L75 G76 I77 Q81 H82 Q83 I118 F227 R228	L75-E79 PolarHBondContact O-N 3.07Å; G76-E79 PolarHBondContact O-N 3.47Å; I77-E79 VanDerWaalsContact C-N 3.27Å; I77-E79 PolarHBondContact O-N 2Å; E79-Q81 PolarHBondContact O-N 3.21Å; E79-H82 WeakPolarHBondContact O-CB 3.27Å; E79-H82 PolarHBondContact O-N 2.93Å; E79-H82 IonicContact OE1-CG 2.67Å; E79-H82 IonicContact OE1-ND1 2.76Å; E79-H82 PolarHBondContact OE1-ND1 2.79Å; E79-H82 VanDerWaalsContact OE1-ND1 3.09Å; E79-H82 IonicContact OE2-ND1 3.73Å; E79-Q83 HydrophobicContact CG-CG 4.36Å; E79-Q83 WeakPolarHBondContact O-CB 3.33Å; E79-Q83 VanDerWaalsContact O-CG 3.3Å; E79-Q83 WeakPolarHBondContact O-CG 3.2Å; E79-Q83 PolarHBondContact O-N 2.86Å; E79-Q83 WeakPolarHBondContact OE1-CG 3.29Å; E79-Q83 PolarHBondContact OE1-NE2 3.3Å; E79-I118 HydrophobicContact CB-CG1 4.42Å; E79-I118 HydrophobicContact CG-CD1 4.29Å; E79-F227 HydrophobicContact CB-CD1 3.83Å; E79-F227 HydrophobicContact CB-CE1 3.57Å; E79-F227 HydrophobicContact CG-CD1 3.99Å; E79-F227 HydrophobicContact CG-CE1 3.96Å; E79-R228 VanDerWaalsContact CD-NE 3.28Å; E79-R228 VanDerWaalsContact OE1-CD 3.31Å; E79-R228 WeakPolarHBondContact OE1-CD 3.26Å; E79-R228 IonicContact OE1-CZ 2.69Å; E79-R228 IonicContact OE1-NE 3.09Å; E79-R228 PolarHBondContact OE1-NE 2.85Å; E79-R228 IonicContact OE2-CZ 2.93Å; E79-R228 IonicContact OE2-NE 3.95Å; E79-R228 PolarHBondContact OE2-NE 2.81Å; E79-R228 IonicContact OE2-NH2 2.74Å; E79-R228 PolarHBondContact OE2-NH2 3.06Å; E79-R228 VanDerWaalsContact OE2-NH2 3.13Å
80	C	95.6	Very high	93.1	Very high	0 Å²	0	40 Å²	40	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-59.2	-47	172	-175.6	0	0	0	0	112.6	G76 I77 H82 Q83 F84 C91 F114 I118	G76-C80 WeakPolarHBondContact O-CB 3.3Å; G76-C80 PolarHBondContact O-N 3.42Å; I77-C80 WeakPolarHBondContact O-CB 3.06Å; I77-C80 PolarHBondContact O-N 3.12Å; C80-H82 VanDerWaalsContact C-N 3.27Å; C80-H82 PolarHBondContact O-N 2.76Å; C80-Q83 PolarHBondContact O-N 3.33Å; C80-F84 WeakPolarHBondContact O-CB 3.4Å; C80-F84 WeakPolarHBondContact O-CD2 2.97Å; C80-F84 PolarHBondContact O-N 3.49Å; C80-C91 HydrophobicContact CB-CB 3.95Å; C80-C91 WeakPolarHBondContact CB-SG 3.05Å; C80-C91 WeakPolarHBondContact SG-CB 2.95Å; C80-C91 CovalentContact SG-SG 2.03Å; C80-C91 PolarHBondContact SG-SG 2.67Å; C80-F114 HydrophobicContact CB-CE1 3.96Å; C80-I118 HydrophobicContact CB-CG2 4.12Å
81	Q	93.9	Very high	93.1	Very high	69 Å²	69	38.6 Å²	38.6	32%	0.322	17%	0.171	S	C	.	.	H	α-helix	trans	-62.3	-37.8	175.1	-70.4	172.3	3.8	0	0	111.5	I77 Q78 E79 R85 C91 T92	I77-Q81 HydrophobicContact CG2-CG 4.42Å; I77-Q81 WeakPolarHBondContact O-CG 3.35Å; I77-Q81 PolarHBondContact O-N 2.6Å; Q78-Q81 PolarHBondContact O-N 2.85Å; E79-Q81 PolarHBondContact O-N 3.21Å; Q81-R85 WeakPolarHBondContact O-CA 3.32Å; Q81-R85 WeakPolarHBondContact O-CB 3.17Å; Q81-R85 PolarHBondContact O-N 3.21Å; Q81-C91 HydrophobicContact CG-CB 4.03Å; Q81-T92 HydrophobicContact CG-CG2 4.27Å
82	H	96.3	Very high	92.7	Very high	46 Å²	46	36.9 Å²	36.9	21%	0.213	17%	0.166	C	C	.	.	H	α-helix	trans	-61.8	-53	173.6	173.1	-95	0	0	0	111.5	Q78 E79 C80 F84 R85 R228	Q78-H82 WeakPolarHBondContact O-CB 3.38Å; Q78-H82 PolarHBondContact O-N 3.19Å; E79-H82 WeakPolarHBondContact O-CB 3.27Å; E79-H82 PolarHBondContact O-N 2.93Å; E79-H82 IonicContact OE1-CG 2.67Å; E79-H82 IonicContact OE1-ND1 2.76Å; E79-H82 PolarHBondContact OE1-ND1 2.79Å; E79-H82 VanDerWaalsContact OE1-ND1 3.09Å; E79-H82 IonicContact OE2-ND1 3.73Å; C80-H82 VanDerWaalsContact C-N 3.27Å; C80-H82 PolarHBondContact O-N 2.76Å; H82-F84 VanDerWaalsContact C-N 3.25Å; H82-F84 PolarHBondContact O-N 3.31Å; H82-R85 PolarHBondContact CE1-NH1 3.14Å; H82-R85 VanDerWaalsContact CE1-NH1 3.31Å; H82-R85 PolarHBondContact NE2-NH1 3.32Å; H82-R85 WeakPolarHBondContact O-CD 3.46Å; H82-R85 VanDerWaalsContact O-CG 3.26Å; H82-R85 WeakPolarHBondContact O-CG 3.41Å; H82-R85 PolarHBondContact O-N 3.3Å; H82-R85 PolarHBondContact O-NH1 2.04Å; H82-R228 PolarHBondContact CD2-NH2 2.95Å; H82-R228 PolarHBondContact CE1-NE 3.35Å; H82-R228 VanDerWaalsContact CE1-NE 3.29Å; H82-R228 PolarHBondContact CE1-NH1 2.94Å; H82-R228 VanDerWaalsContact CG-NH2 3.3Å; H82-R228 PolarHBondContact ND1-NE 2.66Å; H82-R228 PolarHBondContact ND1-NH2 2.76Å; H82-R228 VanDerWaalsContact NE2-CZ 3.31Å; H82-R228 PolarHBondContact NE2-NH1 3.35Å
83	Q	97.3	Very high	91.6	Very high	26 Å²	26	38.3 Å²	38.3	12%	0.121	18%	0.175	C	C	.	.	H	α-helix	trans	-62.3	-31.6	-177.6	-69.8	-59.5	-22	0	0	112.9	E79 C80 F114 D232 K235	E79-Q83 HydrophobicContact CG-CG 4.36Å; E79-Q83 WeakPolarHBondContact O-CB 3.33Å; E79-Q83 VanDerWaalsContact O-CG 3.3Å; E79-Q83 WeakPolarHBondContact O-CG 3.2Å; E79-Q83 PolarHBondContact O-N 2.86Å; E79-Q83 WeakPolarHBondContact OE1-CG 3.29Å; E79-Q83 PolarHBondContact OE1-NE2 3.3Å; C80-Q83 PolarHBondContact O-N 3.33Å; Q83-F114 HydrophobicContact CB-CZ 4.23Å; Q83-F114 HydrophobicContact CG-CZ 4.16Å; Q83-D232 PolarHBondContact NE2-OD1 3.06Å; Q83-K235 HydrophobicContact CB-CD 4.23Å; Q83-K235 HydrophobicContact CB-CG 4.42Å; Q83-K235 HydrophobicContact CG-CB 4.26Å
84	F	94.4	Very high	90.5	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.009	18%	0.177	C	C	.	.	H	α-helix	trans	-105	8.3	-176.9	-72.8	-96	0	0	0	114.5	C80 H82 G86 R87 W89 N90 F114 K235 Y238	C80-F84 WeakPolarHBondContact O-CB 3.4Å; C80-F84 WeakPolarHBondContact O-CD2 2.97Å; C80-F84 PolarHBondContact O-N 3.49Å; H82-F84 VanDerWaalsContact C-N 3.25Å; H82-F84 PolarHBondContact O-N 3.31Å; F84-G86 PolarHBondContact O-N 2.93Å; F84-R87 HydrophobicContact CB-CB 4.44Å; F84-R87 HydrophobicContact CD1-CB 4.04Å; F84-R87 HydrophobicContact CD1-CG 3.91Å; F84-R87 PolarHBondContact O-N 3.49Å; F84-W89 HydrophobicContact CB-CE3 4.24Å; F84-W89 HydrophobicContact CB-CZ3 4.27Å; F84-W89 AromaticContact CD1-CE3 3.52Å; F84-W89 HydrophobicContact CD1-CE3 3.52Å; F84-W89 AromaticContact CD1-CZ3 3.67Å; F84-W89 HydrophobicContact CD1-CZ3 3.67Å; F84-W89 HydrophobicContact CD2-CE3 4.49Å; F84-W89 AromaticContact CD2-CZ3 3.86Å; F84-W89 HydrophobicContact CD2-CZ3 3.86Å; F84-W89 AromaticContact CE1-CE3 3.93Å; F84-W89 HydrophobicContact CE1-CE3 3.93Å; F84-W89 AromaticContact CE1-CZ3 3.88Å; F84-W89 HydrophobicContact CE1-CZ3 3.88Å; F84-W89 HydrophobicContact CE2-CZ3 4.08Å; F84-W89 AromaticContact CG-CE3 3.83Å; F84-W89 HydrophobicContact CG-CE3 3.83Å; F84-W89 AromaticContact CG-CZ3 3.66Å; F84-W89 HydrophobicContact CG-CZ3 3.66Å; F84-W89 HydrophobicContact CZ-CZ3 4.08Å; F84-N90 WeakPolarHBondContact O-CA 3.14Å; F84-F114 HydrophobicContact CD2-CD1 4.33Å; F84-F114 HydrophobicContact CD2-CE1 4.13Å; F84-F114 AromaticContact CE2-CD1 3.5Å; F84-F114 HydrophobicContact CE2-CD1 3.5Å; F84-F114 VanDerWaalsContact CE2-CD1 3.5Å; F84-F114 HydrophobicContact CE2-CD2 4.26Å; F84-F114 AromaticContact CE2-CE1 3.57Å; F84-F114 HydrophobicContact CE2-CE1 3.57Å; F84-F114 HydrophobicContact CE2-CE2 4.3Å; F84-F114 AromaticContact CE2-CG 3.87Å; F84-F114 HydrophobicContact CE2-CG 3.87Å; F84-F114 AromaticContact CE2-CZ 3.98Å; F84-F114 HydrophobicContact CE2-CZ 3.98Å; F84-F114 HydrophobicContact CZ-CD1 4.24Å; F84-F114 HydrophobicContact CZ-CG 4.23Å; F84-K235 HydrophobicContact CE2-CD 3.96Å; F84-K235 HydrophobicContact CZ-CD 4.02Å; F84-Y238 HydrophobicContact CE1-CD1 4.35Å; F84-Y238 HydrophobicContact CE1-CD2 4.48Å; F84-Y238 AromaticContact CE1-CE1 3.81Å; F84-Y238 HydrophobicContact CE1-CE1 3.81Å; F84-Y238 AromaticContact CE1-CE2 3.93Å; F84-Y238 HydrophobicContact CE1-CE2 3.93Å; F84-Y238 AromaticContact CE1-CZ 3.58Å; F84-Y238 AromaticContact CZ-CD1 3.94Å; F84-Y238 HydrophobicContact CZ-CD1 3.94Å; F84-Y238 AromaticContact CZ-CD2 3.84Å; F84-Y238 HydrophobicContact CZ-CD2 3.84Å; F84-Y238 AromaticContact CZ-CE1 3.86Å; F84-Y238 HydrophobicContact CZ-CE1 3.86Å; F84-Y238 AromaticContact CZ-CE2 3.73Å; F84-Y238 HydrophobicContact CZ-CE2 3.73Å; F84-Y238 AromaticContact CZ-CG 3.94Å; F84-Y238 HydrophobicContact CZ-CG 3.94Å; F84-Y238 AromaticContact CZ-CZ 3.76Å
85	R	92.1	Very high	88.9	Confident	141 Å²	141	42.6 Å²	42.6	53%	0.532	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.1	-36	-174.8	67.1	-168.7	179.7	-85	1.5	114.9	Q81 H82 R298	Q81-R85 WeakPolarHBondContact O-CA 3.32Å; Q81-R85 WeakPolarHBondContact O-CB 3.17Å; Q81-R85 PolarHBondContact O-N 3.21Å; H82-R85 PolarHBondContact CE1-NH1 3.14Å; H82-R85 VanDerWaalsContact CE1-NH1 3.31Å; H82-R85 PolarHBondContact NE2-NH1 3.32Å; H82-R85 WeakPolarHBondContact O-CD 3.46Å; H82-R85 VanDerWaalsContact O-CG 3.26Å; H82-R85 WeakPolarHBondContact O-CG 3.41Å; H82-R85 PolarHBondContact O-N 3.3Å; H82-R85 PolarHBondContact O-NH1 2.04Å; R85-R298 PolarHBondContact O-NH2 2.97Å
86	G	89.8	Confident	87	Confident	10 Å²	10	46.2 Å²	46.2	10%	0.103	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.9	1.7	179.7	0	0	0	0	0	115.5	F84 E308	F84-G86 PolarHBondContact O-N 2.93Å; G86-E308 WeakPolarHBondContact CA-OE1 3.37Å; G86-E308 WeakPolarHBondContact O-CA 3.46Å
87	R	92.7	Very high	85.2	Confident	72 Å²	72	49.9 Å²	49.9	27%	0.272	23%	0.233	S	C	.	.	S	Bend	trans	-90.7	156.4	178	-65.3	-74.5	-176.8	140	-0.3	110.5	F84 W89 D239 R298 I307	F84-R87 HydrophobicContact CB-CB 4.44Å; F84-R87 HydrophobicContact CD1-CB 4.04Å; F84-R87 HydrophobicContact CD1-CG 3.91Å; F84-R87 PolarHBondContact O-N 3.49Å; R87-W89 VanDerWaalsContact C-N 3.31Å; R87-W89 VanDerWaalsContact CB-O 3.27Å; R87-W89 WeakPolarHBondContact CB-O 3.35Å; R87-W89 CarbonylContact O-C 3.56Å; R87-W89 PolarHBondContact O-N 3.04Å; R87-D239 IonicContact NH2-OD1 2.98Å; R87-R298 PolarHBondContact O-NH1 3.22Å; R87-R298 PolarHBondContact O-NH2 3.34Å; R87-I307 VanDerWaalsContact CZ-CD1 3.44Å
88	R	93.1	Very high	83.4	Confident	85 Å²	85	52 Å²	52	32%	0.321	24%	0.244	S	C	.	.	S	Bend	trans	-57.5	-40.2	178.2	-63	-177.8	-176.7	154.1	-0	113.1	F283 T295 R298 L312 L313 C315	R88-F283 HydrophobicContact CB-CB 3.79Å; R88-T295 HydrophobicContact CB-CG2 3.81Å; R88-T295 HydrophobicContact CG-CG2 3.96Å; R88-R298 PolarHBondContact O-NH1 3.44Å; R88-L312 VanDerWaalsContact CZ-O 3.26Å; R88-L312 PolarHBondContact NE-O 2.98Å; R88-L312 PolarHBondContact NH2-O 3.39Å; R88-L313 HydrophobicContact CG-CD1 4.13Å; R88-C315 PolarHBondContact NE-SG 3.36Å; R88-C315 VanDerWaalsContact NE-SG 3.44Å
89	W	91.3	Very high	81.7	Confident	13 Å²	13	48.7 Å²	48.7	5%	0.049	23%	0.234	C	C	.	.	S	Bend	trans	-92.6	123.2	162.1	179.7	84.6	0	0	0	108.7	F84 R87 C91 T93 L105 E111 V115 F283	F84-W89 HydrophobicContact CB-CE3 4.24Å; F84-W89 HydrophobicContact CB-CZ3 4.27Å; F84-W89 AromaticContact CD1-CE3 3.52Å; F84-W89 HydrophobicContact CD1-CE3 3.52Å; F84-W89 AromaticContact CD1-CZ3 3.67Å; F84-W89 HydrophobicContact CD1-CZ3 3.67Å; F84-W89 HydrophobicContact CD2-CE3 4.49Å; F84-W89 AromaticContact CD2-CZ3 3.86Å; F84-W89 HydrophobicContact CD2-CZ3 3.86Å; F84-W89 AromaticContact CE1-CE3 3.93Å; F84-W89 HydrophobicContact CE1-CE3 3.93Å; F84-W89 AromaticContact CE1-CZ3 3.88Å; F84-W89 HydrophobicContact CE1-CZ3 3.88Å; F84-W89 HydrophobicContact CE2-CZ3 4.08Å; F84-W89 AromaticContact CG-CE3 3.83Å; F84-W89 HydrophobicContact CG-CE3 3.83Å; F84-W89 AromaticContact CG-CZ3 3.66Å; F84-W89 HydrophobicContact CG-CZ3 3.66Å; F84-W89 HydrophobicContact CZ-CZ3 4.08Å; R87-W89 VanDerWaalsContact C-N 3.31Å; R87-W89 VanDerWaalsContact CB-O 3.27Å; R87-W89 WeakPolarHBondContact CB-O 3.35Å; R87-W89 CarbonylContact O-C 3.56Å; R87-W89 PolarHBondContact O-N 3.04Å; W89-C91 HydrophobicContact CE3-CB 4.47Å; W89-C91 HydrophobicContact CH2-CB 3.57Å; W89-C91 WeakPolarHBondContact CH2-SG 3Å; W89-C91 HydrophobicContact CZ2-CB 3.9Å; W89-C91 HydrophobicContact CZ3-CB 3.89Å; W89-T93 PolarHBondContact NE1-OG1 2.99Å; W89-L105 HydrophobicContact CZ2-CD1 4.23Å; W89-E111 HydrophobicContact CD2-CB 4.09Å; W89-E111 HydrophobicContact CD2-CG 3.73Å; W89-E111 HydrophobicContact CE3-CB 3.98Å; W89-E111 HydrophobicContact CE3-CG 3.54Å; W89-E111 HydrophobicContact CG-CG 4.19Å; W89-E111 HydrophobicContact CH2-CB 4.02Å; W89-E111 HydrophobicContact CH2-CG 4.49Å; W89-E111 HydrophobicContact CZ2-CB 4.14Å; W89-E111 HydrophobicContact CZ3-CB 3.94Å; W89-E111 HydrophobicContact CZ3-CG 3.95Å; W89-V115 HydrophobicContact CH2-CG2 3.61Å; W89-V115 HydrophobicContact CZ2-CG2 4Å; W89-F283 HydrophobicContact CB-CB 4.46Å; W89-F283 HydrophobicContact CB-CD1 3.85Å; W89-F283 HydrophobicContact CB-CD2 3.82Å; W89-F283 HydrophobicContact CB-CE1 3.93Å; W89-F283 HydrophobicContact CB-CE2 3.89Å; W89-F283 HydrophobicContact CB-CG 3.79Å; W89-F283 HydrophobicContact CB-CZ 3.94Å; W89-F283 AromaticContact CD1-CE1 3.71Å; W89-F283 HydrophobicContact CG-CD1 4.3Å; W89-F283 HydrophobicContact CG-CE1 4.01Å; W89-F283 HydrophobicContact CG-CZ 4.15Å
90	N	90.3	Very high	79.8	Confident	36 Å²	36	48.2 Å²	48.2	19%	0.193	23%	0.232	C	C	.	.			trans	-116.9	17.2	-172.2	68.5	-17.8	0	0	0	113.3	F84 T92	F84-N90 WeakPolarHBondContact O-CA 3.14Å; N90-T92 WeakPolarHBondContact ND2-CG2 3.46Å; N90-T92 PolarHBondContact ND2-OG1 3.28Å; N90-T92 PolarHBondContact O-N 3Å; N90-T92 VanDerWaalsContact O-N 3.1Å; N90-T92 PolarHBondContact OD1-N 2.61Å; N90-T92 PolarHBondContact OD1-OG1 2.67Å
91	C	89.4	Confident	77.9	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	23%	0.232	C	C	.	.	S	Bend	trans	62.6	11.7	178.9	-154.3	0	0	0	0	116.2	C80 Q81 W89 T93	C80-C91 HydrophobicContact CB-CB 3.95Å; C80-C91 WeakPolarHBondContact CB-SG 3.05Å; C80-C91 WeakPolarHBondContact SG-CB 2.95Å; C80-C91 CovalentContact SG-SG 2.03Å; C80-C91 PolarHBondContact SG-SG 2.67Å; Q81-C91 HydrophobicContact CG-CB 4.03Å; W89-C91 HydrophobicContact CE3-CB 4.47Å; W89-C91 HydrophobicContact CH2-CB 3.57Å; W89-C91 WeakPolarHBondContact CH2-SG 3Å; W89-C91 HydrophobicContact CZ2-CB 3.9Å; W89-C91 HydrophobicContact CZ3-CB 3.89Å; C91-T93 VanDerWaalsContact C-N 3.3Å; C91-T93 PolarHBondContact O-N 3.1Å
92	T	82.7	Confident	76	Confident	52 Å²	52	45.5 Å²	45.5	32%	0.319	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-2.9	177.3	62.5	0	0	0	0	114.1	Q81 N90 I94	Q81-T92 HydrophobicContact CG-CG2 4.27Å; N90-T92 WeakPolarHBondContact ND2-CG2 3.46Å; N90-T92 PolarHBondContact ND2-OG1 3.28Å; N90-T92 PolarHBondContact O-N 3Å; N90-T92 VanDerWaalsContact O-N 3.1Å; N90-T92 PolarHBondContact OD1-N 2.61Å; N90-T92 PolarHBondContact OD1-OG1 2.67Å; T92-I94 PolarHBondContact O-N 2.93Å
93	T	70.8	Confident	73.8	Confident	30 Å²	30	47.9 Å²	47.9	18%	0.184	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-14.6	175.6	57.3	0	0	0	0	112.5	W89 C91 K95 G291 F293	W89-T93 PolarHBondContact NE1-OG1 2.99Å; C91-T93 VanDerWaalsContact C-N 3.3Å; C91-T93 PolarHBondContact O-N 3.1Å; T93-K95 PolarHBondContact O-N 3.35Å; T93-G291 WeakPolarHBondContact CG2-O 3.23Å; T93-F293 HydrophobicContact CG2-CD2 3.61Å; T93-F293 HydrophobicContact CG2-CE2 3.72Å
94	I	66.9	Low	71.7	Confident	6 Å²	6	48.7 Å²	48.7	3%	0.031	25%	0.247	C	C	.	.			trans	-92.6	84.3	-178.9	-53.3	-177.2	0	0	0	108.2	I77 T92 I100 V104 V115	I77-I94 HydrophobicContact CD1-CB 4.49Å; I77-I94 HydrophobicContact CD1-CD1 3.79Å; I77-I94 HydrophobicContact CD1-CG2 3.9Å; I77-I94 HydrophobicContact CG1-CG2 4.14Å; I77-I94 HydrophobicContact CG2-CB 4.48Å; I77-I94 HydrophobicContact CG2-CG2 4.44Å; T92-I94 PolarHBondContact O-N 2.93Å; I94-I100 HydrophobicContact CG2-CD1 3.58Å; I94-I100 HydrophobicContact CG2-CG1 3.36Å; I94-V104 HydrophobicContact CB-CG1 4.29Å; I94-V104 HydrophobicContact CD1-CG1 4.34Å; I94-V104 HydrophobicContact CG1-CG1 3.86Å; I94-V104 HydrophobicContact CG2-CG1 3.9Å; I94-V115 HydrophobicContact CD1-CB 4.32Å; I94-V115 HydrophobicContact CD1-CG1 3.6Å; I94-V115 HydrophobicContact CD1-CG2 3.67Å
95	K	56.8	Low	70.5	Confident	153 Å²	153	49.6 Å²	49.6	67%	0.665	25%	0.252	S	S	*	.			trans	-86.3	-21.5	-176.8	-74.9	-174.8	176.8	-180	0	114.3	T93	T93-K95 PolarHBondContact O-N 3.35Å
96	D	56.7	Low	69.5	Low	118 Å²	118	48.9 Å²	48.9	63%	0.631	26%	0.258	S	S	*	.			trans	-108.6	100.3	-175.4	-68.5	-26.5	0	0	0	112.1	L98 A99	D96-L98 PolarHBondContact O-N 2.59Å; D96-A99 HydrophobicContact CB-CB 3.89Å; D96-A99 PolarHBondContact O-N 3.44Å; D96-A99 VanDerWaalsContact O-N 3.17Å
97	N	56.2	Low	69.4	Low	77 Å²	77	52.4 Å²	52.4	41%	0.412	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-12.3	-173.1	-70.4	-19.8	0	0	0	116.5	V73	V73-N97 WeakPolarHBondContact CG1-O 3.49Å
98	L	53.8	Low	69.4	Low	46 Å²	46	49 Å²	49	24%	0.241	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.9	-13.6	-178.8	-71.4	160.4	0	0	0	113.2	I48 A70 D96 I100	I48-L98 HydrophobicContact CG2-CB 4.15Å; I48-L98 HydrophobicContact CG2-CD1 3.89Å; I48-L98 HydrophobicContact CG2-CG 4.4Å; A70-L98 HydrophobicContact CB-CD2 3.86Å; D96-L98 PolarHBondContact O-N 2.59Å; L98-I100 PolarHBondContact O-N 3Å
99	A	58.3	Low	69.4	Low	28 Å²	28	45.3 Å²	45.3	23%	0.231	25%	0.245	C	C	.	.	G	3₁₀ helix	trans	-80.3	-4.7	176.4	0	0	0	0	0	112.8	D96 F101 G102 V104	D96-A99 HydrophobicContact CB-CB 3.89Å; D96-A99 PolarHBondContact O-N 3.44Å; D96-A99 VanDerWaalsContact O-N 3.17Å; A99-F101 VanDerWaalsContact C-N 3.27Å; A99-F101 PolarHBondContact O-N 3.4Å; A99-G102 VanDerWaalsContact O-CA 3.27Å; A99-G102 WeakPolarHBondContact O-CA 3.03Å; A99-G102 PolarHBondContact O-N 2.71Å; A99-V104 VanDerWaalsContact C-CG2 3.44Å; A99-V104 HydrophobicContact CB-CG2 4.49Å; A99-V104 WeakPolarHBondContact O-CG2 3.48Å
100	I	57.4	Low	69.7	Low	3 Å²	3	47.5 Å²	47.5	2%	0.015	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-57.5	-30.7	-176.1	-71	150.2	0	0	0	114.4	V73 I77 I94 L98 G102 V104 V115 A119	V73-I100 HydrophobicContact CG1-CB 3.98Å; V73-I100 HydrophobicContact CG1-CD1 3.3Å; V73-I100 HydrophobicContact CG1-CG1 4.25Å; V73-I100 HydrophobicContact CG1-CG2 4.26Å; I77-I100 HydrophobicContact CD1-CD1 3.77Å; I77-I100 HydrophobicContact CD1-CG1 4.29Å; I77-I100 HydrophobicContact CD1-CG2 4.38Å; I77-I100 HydrophobicContact CG1-CD1 3.35Å; I77-I100 HydrophobicContact CG1-CG1 4.37Å; I94-I100 HydrophobicContact CG2-CD1 3.58Å; I94-I100 HydrophobicContact CG2-CG1 3.36Å; L98-I100 PolarHBondContact O-N 3Å; I100-G102 PolarHBondContact O-N 2.67Å; I100-V104 HydrophobicContact CG1-CG2 4.49Å; I100-V115 HydrophobicContact CG2-CG1 4.24Å; I100-A119 HydrophobicContact CG2-CB 3.9Å
101	F	56.2	Low	69.8	Low	4 Å²	4	46.3 Å²	46.3	2%	0.018	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-77	7.2	171.4	-61.2	-64.1	0	0	0	113	V73 A99 A119 V123 F172 A173 R176	V73-F101 HydrophobicContact CG2-CD2 4.31Å; V73-F101 HydrophobicContact CG2-CE2 3.29Å; V73-F101 HydrophobicContact CG2-CZ 3.76Å; A99-F101 VanDerWaalsContact C-N 3.27Å; A99-F101 PolarHBondContact O-N 3.4Å; F101-A119 HydrophobicContact CE1-CB 4.28Å; F101-A119 HydrophobicContact CZ-CB 4.37Å; F101-V123 HydrophobicContact CE2-CG2 4.13Å; F101-V123 HydrophobicContact CZ-CG2 3.76Å; F101-F172 AromaticContact CD2-CD1 3.85Å; F101-F172 HydrophobicContact CD2-CD1 3.85Å; F101-F172 AromaticContact CD2-CE1 3.44Å; F101-F172 HydrophobicContact CD2-CE1 3.44Å; F101-F172 VanDerWaalsContact CD2-CE1 3.44Å; F101-F172 AromaticContact CE2-CD1 3.69Å; F101-F172 HydrophobicContact CE2-CD1 3.69Å; F101-F172 AromaticContact CE2-CE1 3.52Å; F101-F172 HydrophobicContact CE2-CE1 3.52Å; F101-F172 HydrophobicContact CG-CE1 4.47Å; F101-F172 HydrophobicContact CZ-CD1 4.44Å; F101-A173 HydrophobicContact CD1-CB 3.67Å; F101-A173 HydrophobicContact CE1-CB 3.49Å; F101-A173 VanDerWaalsContact CE1-CB 3.49Å; F101-A173 HydrophobicContact CZ-CB 4.22Å; F101-R176 WeakPolarHBondContact O-CD 3.2Å; F101-R176 VanDerWaalsContact O-CZ 3.29Å; F101-R176 PolarHBondContact O-NE 3.25Å; F101-R176 PolarHBondContact O-NH1 3.46Å
102	G	53.5	Low	70	Confident	8 Å²	8	46.3 Å²	46.3	8%	0.082	25%	0.247	C	C	.	.	S	Bend	trans	-108.9	-169.6	171.8	0	0	0	0	0	115.7	A99 I100 V104 R176	A99-G102 VanDerWaalsContact O-CA 3.27Å; A99-G102 WeakPolarHBondContact O-CA 3.03Å; A99-G102 PolarHBondContact O-N 2.71Å; I100-G102 PolarHBondContact O-N 2.67Å; G102-V104 PolarHBondContact O-N 2.94Å; G102-R176 VanDerWaalsContact N-NH1 3.18Å
103	P	51	Low	70.6	Confident	95 Å²	95	43.9 Å²	43.9	62%	0.617	23%	0.232	S	C	*	.	S	Bend	trans	-69	77.2	176.7	28.7	-32.7	0	0	0	109	D106	P103-D106 VanDerWaalsContact CB-OD1 3.3Å; P103-D106 WeakPolarHBondContact CB-OD1 3.45Å
104	V	53.7	Low	71.9	Confident	43 Å²	43	42.4 Å²	42.4	26%	0.261	22%	0.223	S	C	.	.	S	Bend	trans	-92.8	-25.8	177.6	172.9	0	0	0	0	110.8	I94 A99 I100 G102	I94-V104 HydrophobicContact CB-CG1 4.29Å; I94-V104 HydrophobicContact CD1-CG1 4.34Å; I94-V104 HydrophobicContact CG1-CG1 3.86Å; I94-V104 HydrophobicContact CG2-CG1 3.9Å; A99-V104 VanDerWaalsContact C-CG2 3.44Å; A99-V104 HydrophobicContact CB-CG2 4.49Å; A99-V104 WeakPolarHBondContact O-CG2 3.48Å; I100-V104 HydrophobicContact CG1-CG2 4.49Å; G102-V104 PolarHBondContact O-N 2.94Å
105	L	68.1	Low	73.2	Confident	22 Å²	22	42.4 Å²	42.4	12%	0.115	22%	0.223	C	C	.	.	S	Bend	trans	-135.8	98.7	166.8	-66.3	170.6	0	0	0	107.1	W89 K107 S112 V115 R183	W89-L105 HydrophobicContact CZ2-CD1 4.23Å; L105-K107 PolarHBondContact O-N 2.91Å; L105-K107 VanDerWaalsContact O-N 3.15Å; L105-S112 WeakPolarHBondContact CB-OG 3.07Å; L105-V115 HydrophobicContact CD1-CG2 4.08Å; L105-R183 VanDerWaalsContact O-CZ 3.25Å; L105-R183 PolarHBondContact O-NH1 2.73Å; L105-R183 PolarHBondContact O-NH2 2.88Å
106	D	71.1	Confident	75	Confident	125 Å²	125	35.4 Å²	35.4	67%	0.668	19%	0.193	S	C	*	.			trans	-57.2	-31.8	-175	-69.9	-19.4	0	0	0	112.5	P103 R183	P103-D106 VanDerWaalsContact CB-OD1 3.3Å; P103-D106 WeakPolarHBondContact CB-OD1 3.45Å; D106-R183 PolarHBondContact O-NH1 2.81Å
107	K	86.8	Confident	76.9	Confident	84 Å²	84	29.8 Å²	29.8	37%	0.365	16%	0.163	S	C	.	.	S	Bend	trans	-85.6	139.1	-179.3	-62.1	-169.5	178.5	-173	0	112.9	L105 T109 S112 R183 E278	L105-K107 PolarHBondContact O-N 2.91Å; L105-K107 VanDerWaalsContact O-N 3.15Å; K107-T109 HydrophobicContact CB-CG2 3.73Å; K107-T109 PolarHBondContact O-N 2.99Å; K107-S112 WeakPolarHBondContact O-CB 3.47Å; K107-S112 PolarHBondContact O-OG 3.29Å; K107-R183 PolarHBondContact O-NH1 3.15Å; K107-E278 WeakPolarHBondContact CA-OE2 3.37Å; K107-E278 WeakPolarHBondContact CB-OE2 3.36Å
108	A	93.3	Very high	78.9	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.143	C	C	.	.			trans	-80.5	52.8	179.4	0	0	0	0	0	112	M186 Y277 E278	A108-M186 HydrophobicContact CB-CE 4.2Å; A108-M186 HydrophobicContact CB-SD 3.61Å; A108-Y277 HydrophobicContact CB-CD1 3.72Å; A108-Y277 HydrophobicContact CB-CD2 3.98Å; A108-Y277 HydrophobicContact CB-CE1 3.28Å; A108-Y277 HydrophobicContact CB-CE2 3.56Å; A108-Y277 HydrophobicContact CB-CG 4.05Å; A108-Y277 PolarHBondContact O-N 2.98Å; A108-E278 HydrophobicContact CB-CB 4.33Å; A108-E278 HydrophobicContact CB-CG 4.08Å; A108-E278 PolarHBondContact N-OE2 3.26Å; A108-E278 PolarHBondContact O-N 2.88Å
109	T	94.3	Very high	80.9	Confident	8 Å²	8	24 Å²	24	5%	0.049	13%	0.132	C	C	.	.			trans	-81.9	167.1	-179.1	67.5	0	0	0	0	112	K107 E111 S112 A113	K107-T109 HydrophobicContact CB-CG2 3.73Å; K107-T109 PolarHBondContact O-N 2.99Å; T109-E111 VanDerWaalsContact C-N 3.26Å; T109-E111 WeakPolarHBondContact CB-OE2 2.93Å; T109-E111 PolarHBondContact O-N 2.74Å; T109-E111 PolarHBondContact OG1-N 2.69Å; T109-E111 PolarHBondContact OG1-OE2 3.31Å; T109-S112 WeakPolarHBondContact O-CB 3.45Å; T109-S112 PolarHBondContact O-N 2.81Å; T109-S112 PolarHBondContact OG1-N 3.22Å; T109-S112 PolarHBondContact OG1-OG 3.1Å; T109-A113 PolarHBondContact O-N 2.89Å; T109-A113 VanDerWaalsContact O-N 3.13Å
110	R	96	Very high	82.7	Confident	59 Å²	59	22.6 Å²	22.6	22%	0.223	12%	0.121	C	C	.	.	H	α-helix	trans	-60.5	-36.5	173.3	-164.5	-170	-76.1	-146.7	-1.5	112.3	A113 F114 Y238 D239 A241 Y276	R110-A113 WeakPolarHBondContact O-CB 3.39Å; R110-A113 PolarHBondContact O-N 3.31Å; R110-F114 PolarHBondContact O-N 3.47Å; R110-Y238 HydrophobicContact CB-CD2 4.44Å; R110-Y238 HydrophobicContact CB-CE2 3.91Å; R110-Y238 VanDerWaalsContact CD-O 3.31Å; R110-Y238 WeakPolarHBondContact CD-O 3.16Å; R110-Y238 HydrophobicContact CG-CD2 3.58Å; R110-Y238 HydrophobicContact CG-CE2 3.43Å; R110-Y238 VanDerWaalsContact CG-CE2 3.43Å; R110-Y238 HydrophobicContact CG-CG 4.35Å; R110-Y238 PolarHBondContact NH1-O 3.22Å; R110-Y238 WeakPolarHBondContact O-CD2 3.29Å; R110-D239 PolarHBondContact NH1-O 3.14Å; R110-A241 HydrophobicContact CG-CB 3.89Å; R110-Y276 HydrophobicContact CB-CD1 4.12Å; R110-Y276 HydrophobicContact CB-CD2 4.44Å; R110-Y276 HydrophobicContact CB-CE1 4.33Å; R110-Y276 HydrophobicContact CB-CG 4.16Å; R110-Y276 HydrophobicContact CG-CD1 4.11Å; R110-Y276 HydrophobicContact CG-CE1 4.2Å; R110-Y276 PolarHBondContact NH2-OH 3.38Å
111	E	93.4	Very high	84.7	Confident	11 Å²	11	22.5 Å²	22.5	5%	0.051	12%	0.12	C	C	.	.	H	α-helix	trans	-63.8	-43.2	176.7	-67.1	66.9	-142.6	0	0	110.8	W89 T109 A113 F114 V115 Y238 S280 F283	W89-E111 HydrophobicContact CD2-CB 4.09Å; W89-E111 HydrophobicContact CD2-CG 3.73Å; W89-E111 HydrophobicContact CE3-CB 3.98Å; W89-E111 HydrophobicContact CE3-CG 3.54Å; W89-E111 HydrophobicContact CG-CG 4.19Å; W89-E111 HydrophobicContact CH2-CB 4.02Å; W89-E111 HydrophobicContact CH2-CG 4.49Å; W89-E111 HydrophobicContact CZ2-CB 4.14Å; W89-E111 HydrophobicContact CZ3-CB 3.94Å; W89-E111 HydrophobicContact CZ3-CG 3.95Å; T109-E111 VanDerWaalsContact C-N 3.26Å; T109-E111 WeakPolarHBondContact CB-OE2 2.93Å; T109-E111 PolarHBondContact O-N 2.74Å; T109-E111 PolarHBondContact OG1-N 2.69Å; T109-E111 PolarHBondContact OG1-OE2 3.31Å; E111-A113 VanDerWaalsContact C-N 3.31Å; E111-A113 PolarHBondContact O-N 2.74Å; E111-F114 PolarHBondContact O-N 3.07Å; E111-V115 WeakPolarHBondContact O-CG2 3.41Å; E111-V115 PolarHBondContact O-N 2.82Å; E111-Y238 HydrophobicContact CG-CE2 4.3Å; E111-Y238 PolarHBondContact OE1-OH 3.43Å; E111-S280 PolarHBondContact OE1-OG 3.44Å; E111-S280 VanDerWaalsContact OE2-CB 3.29Å; E111-S280 WeakPolarHBondContact OE2-CB 3.4Å; E111-S280 PolarHBondContact OE2-OG 2.84Å; E111-F283 HydrophobicContact CG-CE2 4.36Å; E111-F283 HydrophobicContact CG-CZ 4.12Å
112	S	92.6	Very high	86.7	Confident	1 Å²	1	22.3 Å²	22.3	1%	0.007	12%	0.119	C	C	.	.	H	α-helix	trans	-59.3	-42.8	175.1	-52.5	0	0	0	0	111.7	L105 K107 T109 F114 V115 H116	L105-S112 WeakPolarHBondContact CB-OG 3.07Å; K107-S112 WeakPolarHBondContact O-CB 3.47Å; K107-S112 PolarHBondContact O-OG 3.29Å; T109-S112 WeakPolarHBondContact O-CB 3.45Å; T109-S112 PolarHBondContact O-N 2.81Å; T109-S112 PolarHBondContact OG1-N 3.22Å; T109-S112 PolarHBondContact OG1-OG 3.1Å; S112-F114 VanDerWaalsContact C-N 3.33Å; S112-F114 PolarHBondContact O-N 3.37Å; S112-V115 PolarHBondContact O-N 3Å; S112-H116 PolarHBondContact O-CD2 3.41Å; S112-H116 VanDerWaalsContact O-CD2 3.23Å; S112-H116 PolarHBondContact O-N 3.04Å
113	A	96.4	Very high	88.7	Confident	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-56.8	-46.4	177.3	0	0	0	0	0	112.1	T109 R110 E111 H116 A117 N190 M274 V275	T109-A113 PolarHBondContact O-N 2.89Å; T109-A113 VanDerWaalsContact O-N 3.13Å; R110-A113 WeakPolarHBondContact O-CB 3.39Å; R110-A113 PolarHBondContact O-N 3.31Å; E111-A113 VanDerWaalsContact C-N 3.31Å; E111-A113 PolarHBondContact O-N 2.74Å; A113-H116 PolarHBondContact O-N 3.22Å; A113-A117 PolarHBondContact O-N 3.09Å; A113-A117 VanDerWaalsContact O-N 3.12Å; A113-N190 WeakPolarHBondContact CA-ND2 3.35Å; A113-N190 WeakPolarHBondContact CB-ND2 3.26Å; A113-M274 HydrophobicContact CB-CB 4.33Å; A113-V275 WeakPolarHBondContact CB-O 3.42Å
114	F	96.9	Very high	91	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-64.8	-42.7	177.3	179.7	-87.6	0	0	0	112.6	C80 Q83 F84 R110 E111 S112 H116 A117 I118 L234 K235 Y238 M274	C80-F114 HydrophobicContact CB-CE1 3.96Å; Q83-F114 HydrophobicContact CB-CZ 4.23Å; Q83-F114 HydrophobicContact CG-CZ 4.16Å; F84-F114 HydrophobicContact CD2-CD1 4.33Å; F84-F114 HydrophobicContact CD2-CE1 4.13Å; F84-F114 AromaticContact CE2-CD1 3.5Å; F84-F114 HydrophobicContact CE2-CD1 3.5Å; F84-F114 VanDerWaalsContact CE2-CD1 3.5Å; F84-F114 HydrophobicContact CE2-CD2 4.26Å; F84-F114 AromaticContact CE2-CE1 3.57Å; F84-F114 HydrophobicContact CE2-CE1 3.57Å; F84-F114 HydrophobicContact CE2-CE2 4.3Å; F84-F114 AromaticContact CE2-CG 3.87Å; F84-F114 HydrophobicContact CE2-CG 3.87Å; F84-F114 AromaticContact CE2-CZ 3.98Å; F84-F114 HydrophobicContact CE2-CZ 3.98Å; F84-F114 HydrophobicContact CZ-CD1 4.24Å; F84-F114 HydrophobicContact CZ-CG 4.23Å; R110-F114 PolarHBondContact O-N 3.47Å; E111-F114 PolarHBondContact O-N 3.07Å; S112-F114 VanDerWaalsContact C-N 3.33Å; S112-F114 PolarHBondContact O-N 3.37Å; F114-H116 VanDerWaalsContact C-N 3.34Å; F114-H116 PolarHBondContact O-N 3.23Å; F114-A117 PolarHBondContact O-N 3.44Å; F114-I118 HydrophobicContact CD1-CB 4.46Å; F114-I118 HydrophobicContact CD1-CG2 4.1Å; F114-I118 HydrophobicContact CE1-CB 3.99Å; F114-I118 HydrophobicContact CE1-CG1 4.32Å; F114-I118 HydrophobicContact CE1-CG2 3.82Å; F114-I118 HydrophobicContact CZ-CB 4.19Å; F114-I118 HydrophobicContact CZ-CD1 4.47Å; F114-I118 HydrophobicContact CZ-CG1 4.29Å; F114-I118 VanDerWaalsContact O-CG2 3.31Å; F114-I118 WeakPolarHBondContact O-CG2 3.39Å; F114-I118 PolarHBondContact O-N 3.23Å; F114-L234 HydrophobicContact CD2-CB 4.35Å; F114-L234 WeakPolarHBondContact CD2-O 3.45Å; F114-L234 HydrophobicContact CE2-CB 3.8Å; F114-K235 HydrophobicContact CE2-CB 4.16Å; F114-Y238 HydrophobicContact CB-CD2 3.75Å; F114-Y238 HydrophobicContact CB-CG 4.36Å; F114-Y238 HydrophobicContact CD2-CG 4.43Å; F114-Y238 HydrophobicContact CG-CD2 4.41Å; F114-M274 HydrophobicContact CB-SD 4.08Å; F114-M274 HydrophobicContact CD2-CE 3.84Å; F114-M274 HydrophobicContact CD2-SD 4.27Å
115	V	94.8	Very high	93.1	Very high	5 Å²	5	16.3 Å²	16.3	3%	0.03	8%	0.078	C	C	.	.	H	α-helix	trans	-58.9	-45.5	178.6	170.5	0	0	0	0	111.4	I77 W89 I94 I100 L105 E111 S112 A119	I77-V115 HydrophobicContact CD1-CG1 4.35Å; W89-V115 HydrophobicContact CH2-CG2 3.61Å; W89-V115 HydrophobicContact CZ2-CG2 4Å; I94-V115 HydrophobicContact CD1-CB 4.32Å; I94-V115 HydrophobicContact CD1-CG1 3.6Å; I94-V115 HydrophobicContact CD1-CG2 3.67Å; I100-V115 HydrophobicContact CG2-CG1 4.24Å; L105-V115 HydrophobicContact CD1-CG2 4.08Å; E111-V115 WeakPolarHBondContact O-CG2 3.41Å; E111-V115 PolarHBondContact O-N 2.82Å; S112-V115 PolarHBondContact O-N 3Å; V115-A119 WeakPolarHBondContact O-CB 3.45Å; V115-A119 PolarHBondContact O-N 3.43Å
116	H	94.6	Very high	94.5	Very high	7 Å²	7	15.9 Å²	15.9	3%	0.032	8%	0.077	C	C	.	.	H	α-helix	trans	-62.8	-43.5	177.4	-85.3	-77.1	0	0	0	112.1	S112 A113 F114 S120 R183 N187 N190 N191	S112-H116 PolarHBondContact O-CD2 3.41Å; S112-H116 VanDerWaalsContact O-CD2 3.23Å; S112-H116 PolarHBondContact O-N 3.04Å; A113-H116 PolarHBondContact O-N 3.22Å; F114-H116 VanDerWaalsContact C-N 3.34Å; F114-H116 PolarHBondContact O-N 3.23Å; H116-S120 VanDerWaalsContact O-CB 3.31Å; H116-S120 WeakPolarHBondContact O-CB 3.47Å; H116-S120 PolarHBondContact O-N 3.27Å; H116-S120 PolarHBondContact O-OG 3.17Å; H116-R183 PolarHBondContact NE2-NH2 2.86Å; H116-N187 PolarHBondContact CD2-OD1 3.47Å; H116-N187 VanDerWaalsContact CE1-CG 3.47Å; H116-N187 PolarHBondContact CE1-ND2 3.07Å; H116-N187 VanDerWaalsContact CE1-ND2 3.35Å; H116-N187 PolarHBondContact NE2-ND2 3.41Å; H116-N187 PolarHBondContact NE2-OD1 2.86Å; H116-N190 HydrophobicContact CB-CB 4.21Å; H116-N191 VanDerWaalsContact CB-OD1 3.31Å; H116-N191 WeakPolarHBondContact CB-OD1 3.39Å; H116-N191 PolarHBondContact ND1-OD1 2.98Å; H116-N191 PolarHBondContact O-OD1 2.94Å
117	A	97.8	Very high	95.8	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-64.6	-52.1	177.6	0	0	0	0	0	112.4	A113 F114 A119 S120 A121 N190 G194 L234 M274	A113-A117 PolarHBondContact O-N 3.09Å; A113-A117 VanDerWaalsContact O-N 3.12Å; F114-A117 PolarHBondContact O-N 3.44Å; A117-A119 PolarHBondContact O-N 3.45Å; A117-S120 PolarHBondContact O-N 2.89Å; A117-A121 VanDerWaalsContact O-CB 3.3Å; A117-A121 WeakPolarHBondContact O-CB 3.35Å; A117-A121 PolarHBondContact O-N 3.42Å; A117-N190 VanDerWaalsContact CA-O 3.26Å; A117-N190 WeakPolarHBondContact CA-O 3.27Å; A117-N190 VanDerWaalsContact CB-O 3.28Å; A117-N190 WeakPolarHBondContact CB-O 3.36Å; A117-G194 WeakPolarHBondContact O-CA 3.26Å; A117-L234 HydrophobicContact CB-CD2 4.29Å; A117-M274 HydrophobicContact CB-CE 3.53Å; A117-M274 HydrophobicContact CB-SD 4.41Å
118	I	97.6	Very high	96.3	Very high	0 Å²	0	5.9 Å²	5.9	0%	0	3%	0.028	C	C	.	.	H	α-helix	trans	-68.7	-32.7	-176.8	-162.9	65.5	0	0	0	112.3	G76 E79 C80 F114 G122 F227 L234	G76-I118 WeakPolarHBondContact O-CG1 3.01Å; E79-I118 HydrophobicContact CB-CG1 4.42Å; E79-I118 HydrophobicContact CG-CD1 4.29Å; C80-I118 HydrophobicContact CB-CG2 4.12Å; F114-I118 HydrophobicContact CD1-CB 4.46Å; F114-I118 HydrophobicContact CD1-CG2 4.1Å; F114-I118 HydrophobicContact CE1-CB 3.99Å; F114-I118 HydrophobicContact CE1-CG1 4.32Å; F114-I118 HydrophobicContact CE1-CG2 3.82Å; F114-I118 HydrophobicContact CZ-CB 4.19Å; F114-I118 HydrophobicContact CZ-CD1 4.47Å; F114-I118 HydrophobicContact CZ-CG1 4.29Å; F114-I118 VanDerWaalsContact O-CG2 3.31Å; F114-I118 WeakPolarHBondContact O-CG2 3.39Å; F114-I118 PolarHBondContact O-N 3.23Å; I118-G122 PolarHBondContact O-N 2.98Å; I118-F227 HydrophobicContact CD1-CE1 3.93Å; I118-F227 HydrophobicContact CD1-CZ 3.75Å; I118-F227 HydrophobicContact CG1-CE1 4.27Å; I118-F227 HydrophobicContact CG1-CZ 4.19Å; I118-L234 HydrophobicContact CB-CD1 4.39Å; I118-L234 HydrophobicContact CD1-CD1 3.55Å
119	A	94.8	Very high	96.4	Very high	0 Å²	0	8.8 Å²	8.8	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-69.2	-43.7	174.5	0	0	0	0	0	111.5	I100 F101 V115 A117 G122 V123	I100-A119 HydrophobicContact CG2-CB 3.9Å; F101-A119 HydrophobicContact CE1-CB 4.28Å; F101-A119 HydrophobicContact CZ-CB 4.37Å; V115-A119 WeakPolarHBondContact O-CB 3.45Å; V115-A119 PolarHBondContact O-N 3.43Å; A117-A119 PolarHBondContact O-N 3.45Å; A119-G122 PolarHBondContact O-N 3.4Å; A119-V123 WeakPolarHBondContact O-CG2 3.29Å; A119-V123 PolarHBondContact O-N 2.03Å
120	S	96.9	Very high	96.5	Very high	0 Å²	0	9 Å²	9	0%	0	4%	0.041	C	C	.	.	H	α-helix	trans	-66.5	-38.7	177.1	-60.5	0	0	0	0	112	H116 A117 A124 S169 N191	H116-S120 VanDerWaalsContact O-CB 3.31Å; H116-S120 WeakPolarHBondContact O-CB 3.47Å; H116-S120 PolarHBondContact O-N 3.27Å; H116-S120 PolarHBondContact O-OG 3.17Å; A117-S120 PolarHBondContact O-N 2.89Å; S120-A124 PolarHBondContact O-N 3.19Å; S120-A124 VanDerWaalsContact O-N 3.15Å; S120-S169 PolarHBondContact O-OG 3.03Å; S120-N191 WeakPolarHBondContact CB-O 3.39Å; S120-N191 WeakPolarHBondContact OG-CA 3.27Å; S120-N191 VanDerWaalsContact OG-CB 3.29Å; S120-N191 WeakPolarHBondContact OG-CB 3.47Å; S120-N191 VanDerWaalsContact OG-CG 3.22Å; S120-N191 PolarHBondContact OG-OD1 3Å; S120-N191 VanDerWaalsContact OG-OD1 3.07Å
121	A	98.3	Very high	96.5	Very high	0 Å²	0	6.3 Å²	6.3	0%	0	3%	0.031	C	C	.	.	H	α-helix	trans	-62.3	-45.4	170.6	0	0	0	0	0	111.4	A117 V123 A124 F125 G194 I198 F227 L234	A117-A121 VanDerWaalsContact O-CB 3.3Å; A117-A121 WeakPolarHBondContact O-CB 3.35Å; A117-A121 PolarHBondContact O-N 3.42Å; A121-V123 PolarHBondContact O-N 3.26Å; A121-A124 PolarHBondContact O-N 3.24Å; A121-F125 VanDerWaalsContact O-CB 3.26Å; A121-F125 WeakPolarHBondContact O-CB 3.3Å; A121-F125 PolarHBondContact O-N 3.41Å; A121-G194 WeakPolarHBondContact CB-O 3.31Å; A121-I198 HydrophobicContact CB-CD1 3.98Å; A121-I198 HydrophobicContact CB-CG1 4.49Å; A121-F227 HydrophobicContact CB-CE2 4.39Å; A121-L234 HydrophobicContact CB-CD1 4.04Å
122	G	97.9	Very high	96.6	Very high	0 Å²	0	6.9 Å²	6.9	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-60.4	-42.8	179.1	0	0	0	0	0	113.2	G72 I118 A119 F125 A126	G72-G122 VanDerWaalsContact CA-C 3.45Å; G72-G122 WeakPolarHBondContact CA-O 3.19Å; G72-G122 CarbonylContact O-C 3.56Å; G72-G122 VanDerWaalsContact O-C 3.29Å; G72-G122 VanDerWaalsContact O-CA 3.3Å; G72-G122 WeakPolarHBondContact O-CA 3.47Å; I118-G122 PolarHBondContact O-N 2.98Å; A119-G122 PolarHBondContact O-N 3.4Å; G122-F125 PolarHBondContact O-N 3.5Å; G122-A126 WeakPolarHBondContact O-CB 3.41Å; G122-A126 PolarHBondContact O-N 3.31Å
123	V	96.9	Very high	96.7	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-61.8	-49.8	173.7	172.9	0	0	0	0	111.3	V69 V73 F101 A119 A121 F125 A126 V127	V69-V123 HydrophobicContact CB-CG1 4.4Å; V69-V123 HydrophobicContact CG1-CG1 4.03Å; V69-V123 HydrophobicContact CG1-CG2 4.18Å; V69-V123 HydrophobicContact CG2-CG1 4.18Å; V73-V123 HydrophobicContact CG2-CG2 3.58Å; F101-V123 HydrophobicContact CE2-CG2 4.13Å; F101-V123 HydrophobicContact CZ-CG2 3.76Å; A119-V123 WeakPolarHBondContact O-CG2 3.29Å; A119-V123 PolarHBondContact O-N 2.03Å; A121-V123 PolarHBondContact O-N 3.26Å; V123-F125 VanDerWaalsContact C-N 3.29Å; V123-F125 PolarHBondContact O-N 2.97Å; V123-A126 PolarHBondContact O-N 2.76Å; V123-V127 HydrophobicContact CG1-CG2 4.3Å; V123-V127 WeakPolarHBondContact O-CB 3.03Å; V123-V127 VanDerWaalsContact O-CG2 3.23Å; V123-V127 WeakPolarHBondContact O-CG2 3.38Å; V123-V127 PolarHBondContact O-N 2.9Å
124	A	98.4	Very high	96.5	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-58.9	-45.1	179	0	0	0	0	0	111	S120 A121 T128 G165 V166 I198	S120-A124 PolarHBondContact O-N 3.19Å; S120-A124 VanDerWaalsContact O-N 3.15Å; A121-A124 PolarHBondContact O-N 3.24Å; A124-T128 WeakPolarHBondContact O-CB 3.48Å; A124-T128 PolarHBondContact O-N 3.13Å; A124-T128 PolarHBondContact O-OG1 3.23Å; A124-T128 VanDerWaalsContact O-OG1 3.12Å; A124-G165 WeakPolarHBondContact CA-O 3.2Å; A124-V166 HydrophobicContact CB-CG2 4.04Å; A124-I198 HydrophobicContact CB-CG1 3.91Å
125	F	98.6	Very high	95.9	Very high	20 Å²	20	20.1 Å²	20.1	9%	0.088	12%	0.121	C	C	.	.	H	α-helix	trans	-60.6	-52.1	-179.8	-178.7	-88.2	0	0	0	113.3	L75 A121 G122 V123 T128 R129 I198 Q224 P225 F227 L230	L75-F125 HydrophobicContact CD2-CD1 3.46Å; L75-F125 VanDerWaalsContact CD2-CD1 3.46Å; L75-F125 HydrophobicContact CD2-CE1 3.87Å; L75-F125 HydrophobicContact CD2-CG 4.39Å; A121-F125 VanDerWaalsContact O-CB 3.26Å; A121-F125 WeakPolarHBondContact O-CB 3.3Å; A121-F125 PolarHBondContact O-N 3.41Å; G122-F125 PolarHBondContact O-N 3.5Å; V123-F125 VanDerWaalsContact C-N 3.29Å; V123-F125 PolarHBondContact O-N 2.97Å; F125-T128 PolarHBondContact O-N 3.23Å; F125-R129 WeakPolarHBondContact O-CB 3.5Å; F125-R129 PolarHBondContact O-N 3.26Å; F125-I198 HydrophobicContact CB-CD1 4.27Å; F125-Q224 VanDerWaalsContact CA-OE1 3.28Å; F125-Q224 HydrophobicContact CD2-CB 4.23Å; F125-Q224 HydrophobicContact CD2-CG 4.49Å; F125-Q224 HydrophobicContact CE2-CB 3.84Å; F125-Q224 PolarHBondContact O-NE2 3.25Å; F125-P225 VanDerWaalsContact CE2-O 3.27Å; F125-P225 WeakPolarHBondContact CE2-O 3.37Å; F125-F227 HydrophobicContact CB-CD2 3.92Å; F125-F227 HydrophobicContact CB-CE2 3.98Å; F125-F227 HydrophobicContact CD1-CB 4.48Å; F125-F227 AromaticContact CD1-CD2 3.96Å; F125-F227 HydrophobicContact CD1-CD2 3.96Å; F125-F227 HydrophobicContact CD1-CG 4.5Å; F125-F227 AromaticContact CD2-CD2 3.81Å; F125-F227 HydrophobicContact CD2-CD2 3.81Å; F125-F227 HydrophobicContact CE1-CB 4.15Å; F125-F227 HydrophobicContact CE1-CD2 4.43Å; F125-F227 HydrophobicContact CE2-CB 4.27Å; F125-F227 HydrophobicContact CE2-CD2 4.3Å; F125-F227 AromaticContact CG-CD2 3.62Å; F125-F227 HydrophobicContact CG-CD2 3.62Å; F125-F227 HydrophobicContact CG-CE2 4.2Å; F125-F227 HydrophobicContact CZ-CB 4.03Å; F125-L230 HydrophobicContact CD2-CD1 3.95Å; F125-L230 HydrophobicContact CE2-CD1 4.37Å
126	A	97.6	Very high	95.4	Very high	13 Å²	13	20.5 Å²	20.5	11%	0.107	12%	0.124	C	C	.	.	H	α-helix	trans	-68.4	-38.3	-176	0	0	0	0	0	112.2	S68 G122 V123 R129 S130	S68-A126 WeakPolarHBondContact O-CB 3.38Å; G122-A126 WeakPolarHBondContact O-CB 3.41Å; G122-A126 PolarHBondContact O-N 3.31Å; V123-A126 PolarHBondContact O-N 2.76Å; A126-R129 PolarHBondContact O-N 3.23Å; A126-S130 VanDerWaalsContact O-CB 3.22Å; A126-S130 WeakPolarHBondContact O-CB 3.48Å; A126-S130 PolarHBondContact O-N 2.84Å
127	V	97.3	Very high	95.1	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-64.5	-49.9	175.5	171.8	0	0	0	0	110.3	V69 V123 R129 S130 C131 F164 V168	V69-V127 HydrophobicContact CG2-CG2 3.83Å; V123-V127 HydrophobicContact CG1-CG2 4.3Å; V123-V127 WeakPolarHBondContact O-CB 3.03Å; V123-V127 VanDerWaalsContact O-CG2 3.23Å; V123-V127 WeakPolarHBondContact O-CG2 3.38Å; V123-V127 PolarHBondContact O-N 2.9Å; V127-R129 VanDerWaalsContact C-N 3.31Å; V127-R129 PolarHBondContact O-N 3.46Å; V127-S130 PolarHBondContact O-N 3.46Å; V127-C131 PolarHBondContact O-N 3.35Å; V127-C131 PolarHBondContact O-SG 3.27Å; V127-F164 HydrophobicContact CG1-CD1 4.01Å; V127-F164 HydrophobicContact CG1-CE1 3.86Å; V127-V168 HydrophobicContact CB-CG1 4.43Å; V127-V168 HydrophobicContact CG1-CB 4.13Å; V127-V168 HydrophobicContact CG1-CG1 4.11Å; V127-V168 HydrophobicContact CG1-CG2 4.15Å; V127-V168 HydrophobicContact CG2-CG1 3.81Å
128	T	97.6	Very high	94.6	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-57.6	-43.8	177.3	-69.4	0	0	0	0	111.9	A124 F125 C131 A132 E160 D161 A162 G165 Q224	A124-T128 WeakPolarHBondContact O-CB 3.48Å; A124-T128 PolarHBondContact O-N 3.13Å; A124-T128 PolarHBondContact O-OG1 3.23Å; A124-T128 VanDerWaalsContact O-OG1 3.12Å; F125-T128 PolarHBondContact O-N 3.23Å; T128-C131 PolarHBondContact O-N 3.43Å; T128-A132 PolarHBondContact O-N 3.01Å; T128-A132 VanDerWaalsContact O-N 3.09Å; T128-E160 HydrophobicContact CG2-CB 3.7Å; T128-D161 WeakPolarHBondContact CG2-O 3.41Å; T128-D161 PolarHBondContact OG1-O 3.38Å; T128-A162 HydrophobicContact CG2-CB 4.44Å; T128-A162 WeakPolarHBondContact OG1-CA 3.47Å; T128-G165 VanDerWaalsContact OG1-CA 3.3Å; T128-G165 WeakPolarHBondContact OG1-CA 3.36Å; T128-G165 PolarHBondContact OG1-N 3.48Å; T128-Q224 HydrophobicContact CG2-CG 4.25Å
129	R	96.6	Very high	94.3	Very high	61 Å²	61	32 Å²	32	23%	0.23	19%	0.189	C	C	.	.	H	α-helix	trans	-62.4	-48.4	177.7	-177.4	66.5	65.3	-173.4	-3.6	111.7	F125 A126 V127 C131 A132 E133 E160	F125-R129 WeakPolarHBondContact O-CB 3.5Å; F125-R129 PolarHBondContact O-N 3.26Å; A126-R129 PolarHBondContact O-N 3.23Å; V127-R129 VanDerWaalsContact C-N 3.31Å; V127-R129 PolarHBondContact O-N 3.46Å; R129-C131 VanDerWaalsContact C-N 3.3Å; R129-C131 PolarHBondContact O-N 3.06Å; R129-A132 PolarHBondContact O-N 3.18Å; R129-A132 VanDerWaalsContact O-N 3.16Å; R129-E133 WeakPolarHBondContact CG-OE1 3.33Å; R129-E133 WeakPolarHBondContact O-CG 3.35Å; R129-E133 PolarHBondContact O-N 3.39Å; R129-E160 IonicContact CZ-OE1 2.83Å; R129-E160 VanDerWaalsContact CZ-OE1 3.27Å; R129-E160 IonicContact CZ-OE2 2.9Å; R129-E160 IonicContact NE-OE2 3.86Å; R129-E160 IonicContact NH1-OE1 3.62Å; R129-E160 PolarHBondContact NH1-OE1 3.26Å; R129-E160 IonicContact NH1-OE2 2.94Å; R129-E160 IonicContact NH2-OE1 3.38Å; R129-E160 PolarHBondContact NH2-OE1 3.44Å; R129-E160 IonicContact NH2-OE2 2.72Å
130	S	96.3	Very high	94.3	Very high	13 Å²	13	33.3 Å²	33.3	9%	0.091	20%	0.203	C	C	.	.	H	α-helix	trans	-58.9	-40.6	178.8	-176.3	0	0	0	0	112.1	S68 A126 V127 E133 G134 T135	S68-S130 VanDerWaalsContact OG-CB 3.25Å; S68-S130 WeakPolarHBondContact OG-CB 3.3Å; S68-S130 PolarHBondContact OG-OG 3.41Å; A126-S130 VanDerWaalsContact O-CB 3.22Å; A126-S130 WeakPolarHBondContact O-CB 3.48Å; A126-S130 PolarHBondContact O-N 2.84Å; V127-S130 PolarHBondContact O-N 3.46Å; S130-E133 PolarHBondContact O-N 2.74Å; S130-G134 PolarHBondContact O-N 3.43Å; S130-T135 PolarHBondContact O-N 2.83Å; S130-T135 PolarHBondContact O-OG1 2.64Å; S130-T135 PolarHBondContact OG-OG1 3.17Å
131	C	95.8	Very high	94.2	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.007	22%	0.223	C	C	.	.	H	α-helix	trans	-64.5	-43.1	175.8	-65.9	0	0	0	0	111.9	V127 T128 R129 E133 G134 C139 G140 F164	V127-C131 PolarHBondContact O-N 3.35Å; V127-C131 PolarHBondContact O-SG 3.27Å; T128-C131 PolarHBondContact O-N 3.43Å; R129-C131 VanDerWaalsContact C-N 3.3Å; R129-C131 PolarHBondContact O-N 3.06Å; C131-E133 VanDerWaalsContact C-N 3.26Å; C131-E133 PolarHBondContact O-N 3.24Å; C131-G134 PolarHBondContact O-N 3.03Å; C131-G134 VanDerWaalsContact O-N 3.08Å; C131-C139 VanDerWaalsContact CA-SG 3.52Å; C131-C139 HydrophobicContact CB-CB 3.7Å; C131-C139 WeakPolarHBondContact CB-SG 3.48Å; C131-C139 WeakPolarHBondContact SG-CB 3.31Å; C131-C139 CovalentContact SG-SG 2.02Å; C131-C139 PolarHBondContact SG-SG 2.92Å; C131-G140 WeakPolarHBondContact O-CA 3.4Å; C131-F164 VanDerWaalsContact SG-CE1 3.54Å
132	A	95.5	Very high	93.9	Very high	23 Å²	23	36.8 Å²	36.8	19%	0.19	23%	0.226	C	C	.	.	H	α-helix	trans	-66.8	-26.9	178.1	0	0	0	0	0	113.4	T128 R129 G134 C158 E160	T128-A132 PolarHBondContact O-N 3.01Å; T128-A132 VanDerWaalsContact O-N 3.09Å; R129-A132 PolarHBondContact O-N 3.18Å; R129-A132 VanDerWaalsContact O-N 3.16Å; A132-G134 VanDerWaalsContact C-N 3.26Å; A132-G134 PolarHBondContact O-N 3.45Å; A132-C158 PolarHBondContact O-SG 3.14Å; A132-E160 HydrophobicContact CB-CB 4.3Å; A132-E160 HydrophobicContact CB-CG 3.8Å
133	E	94.1	Very high	93.3	Very high	130 Å²	130	40.6 Å²	40.6	61%	0.607	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-12.3	173.8	-71.7	171.5	-176.3	0	0	113.2	R129 S130 C131 T135	R129-E133 WeakPolarHBondContact CG-OE1 3.33Å; R129-E133 WeakPolarHBondContact O-CG 3.35Å; R129-E133 PolarHBondContact O-N 3.39Å; S130-E133 PolarHBondContact O-N 2.74Å; C131-E133 VanDerWaalsContact C-N 3.26Å; C131-E133 PolarHBondContact O-N 3.24Å; E133-T135 HydrophobicContact CB-CG2 4.06Å
134	G	91.4	Very high	92.4	Very high	57 Å²	57	48 Å²	48	59%	0.588	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.7	25.9	179.9	0	0	0	0	0	113.8	S130 C131 A132 S136	S130-G134 PolarHBondContact O-N 3.43Å; C131-G134 PolarHBondContact O-N 3.03Å; C131-G134 VanDerWaalsContact O-N 3.08Å; A132-G134 VanDerWaalsContact C-N 3.26Å; A132-G134 PolarHBondContact O-N 3.45Å; G134-S136 VanDerWaalsContact C-N 3.32Å
135	T	85.9	Confident	90.9	Very high	93 Å²	93	52.1 Å²	52.1	57%	0.571	31%	0.306	S	S	*	.			trans	-79.9	-13.9	-179.9	57.1	0	0	0	0	113.8	S130 E133	S130-T135 PolarHBondContact O-N 2.83Å; S130-T135 PolarHBondContact O-OG1 2.64Å; S130-T135 PolarHBondContact OG-OG1 3.17Å; E133-T135 HydrophobicContact CB-CG2 4.06Å
136	S	84.4	Confident	89.6	Confident	12 Å²	12	55.6 Å²	55.6	8%	0.084	32%	0.321	C	S	.	.			trans	-120.4	147.2	-178.8	177	0	0	0	0	110.4	I65 G134 M138	I65-S136 WeakPolarHBondContact CG2-OG 3.05Å; G134-S136 VanDerWaalsContact C-N 3.32Å; S136-M138 PolarHBondContact OG-N 2.95Å
137	T	87.3	Confident	88.7	Confident	121 Å²	121	57 Å²	57	74%	0.742	34%	0.336	S	S	*	.	S	Bend	trans	-86	-15.6	175.4	66.1	0	0	0	0	112.8	E64	E64-T137 PolarHBondContact OE1-OG1 3.46Å; E64-T137 PolarHBondContact OE2-N 2.74Å; E64-T137 PolarHBondContact OE2-OG1 3.08Å
138	M	86.6	Confident	87.9	Confident	104 Å²	104	62.9 Å²	62.9	51%	0.512	38%	0.375	S	S	.	.	S	Bend	trans	-85.4	-13.4	-174.1	-67.1	-69.9	-69	0	0	114	S136	S136-M138 PolarHBondContact OG-N 2.95Å
139	C	93.2	Very high	87.3	Confident	23 Å²	23	65.8 Å²	65.8	16%	0.155	39%	0.394	C	S	.	.			trans	-150.7	168.2	-177.1	61	0	0	0	0	110.7	C131 F164	C131-C139 VanDerWaalsContact CA-SG 3.52Å; C131-C139 HydrophobicContact CB-CB 3.7Å; C131-C139 WeakPolarHBondContact CB-SG 3.48Å; C131-C139 WeakPolarHBondContact SG-CB 3.31Å; C131-C139 CovalentContact SG-SG 2.02Å; C131-C139 PolarHBondContact SG-SG 2.92Å; C139-F164 HydrophobicContact CB-CD1 3.84Å; C139-F164 HydrophobicContact CB-CE1 3.47Å; C139-F164 VanDerWaalsContact CB-CE1 3.47Å; C139-F164 HydrophobicContact CB-CE2 4.39Å; C139-F164 HydrophobicContact CB-CG 4.44Å; C139-F164 HydrophobicContact CB-CZ 3.78Å
140	G	93.9	Very high	86.8	Confident	28 Å²	28	64.5 Å²	64.5	29%	0.289	40%	0.399	S	S	.	.			trans	-163.8	-153.5	-177.7	0	0	0	0	0	112.6	C131	C131-G140 WeakPolarHBondContact O-CA 3.4Å
141	C	94.3	Very high	86.4	Confident	63 Å²	63	73.3 Å²	73.3	43%	0.426	44%	0.439	S	S	.	.	B	Isolated β-bridge	trans	-72.5	148.3	173.1	-48.8	0	0	0	0	111.2	S143 C158 S159	C141-S143 PolarHBondContact O-N 3.44Å; C141-C158 HydrophobicContact CB-CB 3.99Å; C141-C158 WeakPolarHBondContact CB-SG 3.38Å; C141-C158 WeakPolarHBondContact SG-CB 3.02Å; C141-C158 CovalentContact SG-SG 2.02Å; C141-C158 PolarHBondContact SG-SG 3.27Å; C141-S159 CarbonylContact C-O 3.47Å; C141-S159 WeakPolarHBondContact CA-O 3.34Å
142	D	93.4	Very high	86	Confident	10 Å²	10	75.8 Å²	75.8	5%	0.053	46%	0.464	C	S	.	.			trans	-66.6	123.7	173.8	179.3	16	0	0	0	111.8	H144 H145 K146 S159 D161	D142-H144 PolarHBondContact OD1-N 3.47Å; D142-H145 PolarHBondContact OD1-N 3.12Å; D142-H145 IonicContact OD1-ND1 3.49Å; D142-H145 PolarHBondContact OD1-ND1 3.05Å; D142-H145 VanDerWaalsContact OD2-CB 3.29Å; D142-H145 WeakPolarHBondContact OD2-CB 3.38Å; D142-H145 IonicContact OD2-CG 3.39Å; D142-H145 IonicContact OD2-ND1 2.81Å; D142-H145 PolarHBondContact OD2-ND1 3.25Å; D142-K146 VanDerWaalsContact O-CE 3.29Å; D142-K146 WeakPolarHBondContact O-CE 3.19Å; D142-K146 PolarHBondContact O-NZ 3.34Å; D142-S159 PolarHBondContact N-O 3.4Å; D142-D161 HydrophobicContact CB-CB 4.14Å
143	S	84.8	Confident	85.9	Confident	81 Å²	81	76.7 Å²	76.7	57%	0.566	46%	0.463	S	S	*	.			trans	-103.4	-10.8	174.4	52.6	0	0	0	0	114.4	C141	C141-S143 PolarHBondContact O-N 3.44Å
144	H	78.3	Confident	85.8	Confident	154 Å²	154	77.7 Å²	77.7	71%	0.713	47%	0.465	S	S	*	.	S	Bend	trans	-92.3	-37.1	-167.2	-64.8	-74	0	0	0	113.6	D142 K146	D142-H144 PolarHBondContact OD1-N 3.47Å; H144-K146 PolarHBondContact O-N 3.49Å; H144-K146 VanDerWaalsContact O-N 3.15Å
145	H	66.2	Low	85.9	Confident	87 Å²	87	77.5 Å²	77.5	40%	0.403	45%	0.447	S	S	.	.			trans	-90.9	38.7	-169.1	-62.1	97.7	0	0	0	116.3	D142 E163	D142-H145 PolarHBondContact OD1-N 3.12Å; D142-H145 IonicContact OD1-ND1 3.49Å; D142-H145 PolarHBondContact OD1-ND1 3.05Å; D142-H145 VanDerWaalsContact OD2-CB 3.29Å; D142-H145 WeakPolarHBondContact OD2-CB 3.38Å; D142-H145 IonicContact OD2-CG 3.39Å; D142-H145 IonicContact OD2-ND1 2.81Å; D142-H145 PolarHBondContact OD2-ND1 3.25Å; H145-E163 IonicContact CE1-OE1 3.63Å; H145-E163 IonicContact CE1-OE2 3.63Å; H145-E163 IonicContact NE2-OE1 3.65Å
146	K	71.5	Confident	86.2	Confident	93 Å²	93	74.2 Å²	74.2	40%	0.404	43%	0.431	S	S	.	.			trans	-104.8	84.2	-177.7	-60.8	174.4	-167.3	170.1	0	110.7	D142 H144 W155	D142-K146 VanDerWaalsContact O-CE 3.29Å; D142-K146 WeakPolarHBondContact O-CE 3.19Å; D142-K146 PolarHBondContact O-NZ 3.34Å; H144-K146 PolarHBondContact O-N 3.49Å; H144-K146 VanDerWaalsContact O-N 3.15Å; K146-W155 HydrophobicContact CB-CG 4.35Å; K146-W155 HydrophobicContact CD-CB 4.46Å; K146-W155 HydrophobicContact CG-CD2 4.29Å; K146-W155 HydrophobicContact CG-CG 4.32Å
147	G	77.5	Confident	86.5	Confident	42 Å²	42	76.6 Å²	76.6	43%	0.433	46%	0.457	S	S	.	.			trans	-62.5	177.6	162.4	0	0	0	0	0	111.7	W155	G147-W155 PolarHBondContact O-NE1 3.03Å
148	P	82.3	Confident	86.8	Confident	125 Å²	125	72.3 Å²	72.3	81%	0.812	43%	0.432	S	S	*	.	S	Bend	trans	-57	137.4	171.8	25	-32.4	0	0	0	109.8
149	P	84.9	Confident	87.3	Confident	61 Å²	61	67.5 Å²	67.5	40%	0.396	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-64.3	151.7	179.3	29.7	-35	0	0	0	110.2	W153	P149-W153 HydrophobicContact CB-CD2 4.38Å; P149-W153 HydrophobicContact CB-CE3 4.05Å; P149-W153 HydrophobicContact CB-CH2 4.37Å; P149-W153 HydrophobicContact CB-CZ3 4.04Å; P149-W153 WeakPolarHBondContact CB-O 3.41Å
150	G	84.5	Confident	87.4	Confident	33 Å²	33	66.9 Å²	66.9	34%	0.34	40%	0.404	S	S	.	.	P	Polyproline II helix	trans	-65.8	169.3	172	0	0	0	0	0	112.2	G152 W153	G150-G152 PolarHBondContact O-N 3.33Å; G150-W153 VanDerWaalsContact N-CE2 3.32Å
151	E	88.4	Confident	87.6	Confident	199 Å²	199	67.2 Å²	67.2	93%	0.93	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	134.4	-178.9	-162.6	177.4	-179.5	0	0	111.8
152	G	88.1	Confident	87.7	Confident	52 Å²	52	64.5 Å²	64.5	54%	0.536	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.8	16.7	175.8	0	0	0	0	0	115.9	G150 K218	G150-G152 PolarHBondContact O-N 3.33Å; G152-K218 WeakPolarHBondContact O-CE 3.28Å
153	W	92.7	Very high	87.9	Confident	43 Å²	43	69.3 Å²	69.3	16%	0.163	40%	0.403	C	S	.	.			trans	-153.4	169.2	171.1	59.6	-83	0	0	0	113	P149 G150 W155 L204 K218 C220	P149-W153 HydrophobicContact CB-CD2 4.38Å; P149-W153 HydrophobicContact CB-CE3 4.05Å; P149-W153 HydrophobicContact CB-CH2 4.37Å; P149-W153 HydrophobicContact CB-CZ3 4.04Å; P149-W153 WeakPolarHBondContact CB-O 3.41Å; G150-W153 VanDerWaalsContact N-CE2 3.32Å; W153-W155 HydrophobicContact CH2-CD2 4.05Å; W153-W155 AromaticContact CH2-CE2 3.7Å; W153-W155 HydrophobicContact CH2-CE3 4.22Å; W153-W155 AromaticContact CH2-CH2 3.8Å; W153-W155 HydrophobicContact CH2-CH2 3.8Å; W153-W155 AromaticContact CH2-CZ2 3.6Å; W153-W155 HydrophobicContact CH2-CZ2 3.6Å; W153-W155 HydrophobicContact CH2-CZ3 4.11Å; W153-W155 AromaticContact CZ3-CD2 3.63Å; W153-W155 HydrophobicContact CZ3-CD2 3.63Å; W153-W155 AromaticContact CZ3-CE2 3.76Å; W153-W155 AromaticContact CZ3-CE3 3.79Å; W153-W155 HydrophobicContact CZ3-CE3 3.79Å; W153-W155 HydrophobicContact CZ3-CG 4.13Å; W153-W155 HydrophobicContact CZ3-CH2 4.23Å; W153-W155 HydrophobicContact CZ3-CZ2 4.08Å; W153-W155 HydrophobicContact CZ3-CZ3 4.09Å; W153-L204 HydrophobicContact CH2-CD1 4.12Å; W153-L204 HydrophobicContact CH2-CD2 4Å; W153-L204 HydrophobicContact CZ2-CD1 3.9Å; W153-L204 HydrophobicContact CZ3-CD2 4.44Å; W153-K218 WeakPolarHBondContact CA-O 3.36Å; W153-K218 HydrophobicContact CB-CD 4.21Å; W153-K218 HydrophobicContact CB-CG 3.51Å; W153-K218 WeakPolarHBondContact CB-O 3.47Å; W153-C220 HydrophobicContact CD2-CB 4.14Å; W153-C220 HydrophobicContact CE3-CB 3.52Å; W153-C220 HydrophobicContact CH2-CB 4.5Å; W153-C220 HydrophobicContact CZ3-CB 3.74Å
154	K	92.4	Very high	88.4	Confident	150 Å²	150	67.3 Å²	67.3	65%	0.652	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.2	149.8	174.8	-66.3	-176.4	179.5	179.6	0	110.9	K218 T219 C220	K154-K218 PolarHBondContact N-O 3.46Å; K154-T219 VanDerWaalsContact O-CA 3.26Å; K154-T219 WeakPolarHBondContact O-CA 3.5Å; K154-C220 PolarHBondContact O-N 3.22Å
155	W	93.5	Very high	89.3	Confident	54 Å²	54	60 Å²	60	21%	0.205	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	143.6	167.7	-68.3	110.7	0	0	0	110.9	K146 G147 W153 L204 W222	K146-W155 HydrophobicContact CB-CG 4.35Å; K146-W155 HydrophobicContact CD-CB 4.46Å; K146-W155 HydrophobicContact CG-CD2 4.29Å; K146-W155 HydrophobicContact CG-CG 4.32Å; G147-W155 PolarHBondContact O-NE1 3.03Å; W153-W155 HydrophobicContact CH2-CD2 4.05Å; W153-W155 AromaticContact CH2-CE2 3.7Å; W153-W155 HydrophobicContact CH2-CE3 4.22Å; W153-W155 AromaticContact CH2-CH2 3.8Å; W153-W155 HydrophobicContact CH2-CH2 3.8Å; W153-W155 AromaticContact CH2-CZ2 3.6Å; W153-W155 HydrophobicContact CH2-CZ2 3.6Å; W153-W155 HydrophobicContact CH2-CZ3 4.11Å; W153-W155 AromaticContact CZ3-CD2 3.63Å; W153-W155 HydrophobicContact CZ3-CD2 3.63Å; W153-W155 AromaticContact CZ3-CE2 3.76Å; W153-W155 AromaticContact CZ3-CE3 3.79Å; W153-W155 HydrophobicContact CZ3-CE3 3.79Å; W153-W155 HydrophobicContact CZ3-CG 4.13Å; W153-W155 HydrophobicContact CZ3-CH2 4.23Å; W153-W155 HydrophobicContact CZ3-CZ2 4.08Å; W153-W155 HydrophobicContact CZ3-CZ3 4.09Å; W155-L204 HydrophobicContact CH2-CD2 3.72Å; W155-L204 HydrophobicContact CZ3-CD2 3.62Å; W155-W222 AromaticContact CH2-CD1 3.88Å; W155-W222 AromaticContact CH2-NE1 3.4Å; W155-W222 AromaticContact CZ3-CD1 3.87Å; W155-W222 AromaticContact CZ3-NE1 3.89Å
156	G	91.1	Very high	90.8	Very high	23 Å²	23	56 Å²	56	24%	0.237	33%	0.332	C	S	.	.			trans	172.3	178.8	171.1	0	0	0	0	0	110.9	T219 C220 W221	G156-T219 VanDerWaalsContact C-CG2 3.49Å; G156-C220 PolarHBondContact N-O 3.02Å; G156-C220 VanDerWaalsContact N-O 3.15Å; G156-C220 VanDerWaalsContact O-O 3.13Å; G156-W221 WeakPolarHBondContact O-CB 3.11Å
157	G	91.3	Very high	92.1	Very high	62 Å²	62	55.5 Å²	55.5	64%	0.639	33%	0.334	S	S	*	.	S	Bend	trans	74.9	-159.2	-167.5	0	0	0	0	0	111.9
158	C	94.6	Very high	93	Very high	32 Å²	32	53.6 Å²	53.6	22%	0.216	31%	0.314	C	S	.	.			trans	-110.1	103.9	-178.2	-176.7	0	0	0	0	109.3	A132 C141	A132-C158 PolarHBondContact O-SG 3.14Å; C141-C158 HydrophobicContact CB-CB 3.99Å; C141-C158 WeakPolarHBondContact CB-SG 3.38Å; C141-C158 WeakPolarHBondContact SG-CB 3.02Å; C141-C158 CovalentContact SG-SG 2.02Å; C141-C158 PolarHBondContact SG-SG 3.27Å
159	S	96	Very high	93.6	Very high	3 Å²	3	47.7 Å²	47.7	2%	0.021	28%	0.275	C	S	.	.			trans	-69.2	130	166.9	-69.5	0	0	0	0	108.6	C141 D142 W222	C141-S159 CarbonylContact C-O 3.47Å; C141-S159 WeakPolarHBondContact CA-O 3.34Å; D142-S159 PolarHBondContact N-O 3.4Å; S159-W222 WeakPolarHBondContact CA-O 3.43Å; S159-W222 PolarHBondContact OG-N 3.36Å
160	E	96.4	Very high	94.2	Very high	9 Å²	9	49 Å²	49	4%	0.042	27%	0.272	C	S	.	.	B	Isolated β-bridge	trans	-77	128.6	-179.3	-56.3	-179.3	-148.2	0	0	110.5	T128 R129 A132 A162 M202 W222 Q224	T128-E160 HydrophobicContact CG2-CB 3.7Å; R129-E160 IonicContact CZ-OE1 2.83Å; R129-E160 VanDerWaalsContact CZ-OE1 3.27Å; R129-E160 IonicContact CZ-OE2 2.9Å; R129-E160 IonicContact NE-OE2 3.86Å; R129-E160 IonicContact NH1-OE1 3.62Å; R129-E160 PolarHBondContact NH1-OE1 3.26Å; R129-E160 IonicContact NH1-OE2 2.94Å; R129-E160 IonicContact NH2-OE1 3.38Å; R129-E160 PolarHBondContact NH2-OE1 3.44Å; R129-E160 IonicContact NH2-OE2 2.72Å; A132-E160 HydrophobicContact CB-CB 4.3Å; A132-E160 HydrophobicContact CB-CG 3.8Å; E160-A162 PolarHBondContact O-N 2.88Å; E160-A162 VanDerWaalsContact O-N 3.1Å; E160-M202 HydrophobicContact CB-CE 4.16Å; E160-W222 PolarHBondContact N-O 3.29Å; E160-Q224 PolarHBondContact OE1-N 3.13Å; E160-Q224 WeakPolarHBondContact OE2-CB 3.41Å; E160-Q224 WeakPolarHBondContact OE2-CG 3.41Å; E160-Q224 PolarHBondContact OE2-N 2.92Å; E160-Q224 PolarHBondContact OE2-NE2 2.88Å
161	D	96.9	Very high	94.7	Very high	35 Å²	35	51.8 Å²	51.8	19%	0.187	28%	0.276	C	S	.	.			trans	-82.1	84.7	179.3	-170.3	-15.1	0	0	0	111.1	T128 D142 E163 F164 G165	T128-D161 WeakPolarHBondContact CG2-O 3.41Å; T128-D161 PolarHBondContact OG1-O 3.38Å; D142-D161 HydrophobicContact CB-CB 4.14Å; D161-E163 VanDerWaalsContact C-N 3.31Å; D161-E163 PolarHBondContact OD1-N 3.49Å; D161-F164 HydrophobicContact CB-CB 4.21Å; D161-F164 VanDerWaalsContact CG-CB 3.48Å; D161-F164 PolarHBondContact OD1-N 3.31Å; D161-G165 PolarHBondContact O-N 3.12Å
162	A	97.1	Very high	94.9	Very high	7 Å²	7	42.4 Å²	42.4	6%	0.058	23%	0.233	C	C	.	.	H	α-helix	trans	-68.5	-29.8	179.4	0	0	0	0	0	112.9	T128 E160 G165 V166 I198 L199 M202	T128-A162 HydrophobicContact CG2-CB 4.44Å; T128-A162 WeakPolarHBondContact OG1-CA 3.47Å; E160-A162 PolarHBondContact O-N 2.88Å; E160-A162 VanDerWaalsContact O-N 3.1Å; A162-G165 PolarHBondContact O-N 2.74Å; A162-V166 WeakPolarHBondContact O-CB 3.36Å; A162-V166 WeakPolarHBondContact O-CG2 3.4Å; A162-V166 PolarHBondContact O-N 3.42Å; A162-I198 HydrophobicContact CB-CG2 4.2Å; A162-L199 HydrophobicContact CB-CD2 3.76Å; A162-M202 HydrophobicContact CB-CE 4.06Å; A162-M202 HydrophobicContact CB-CG 3.92Å; A162-M202 HydrophobicContact CB-SD 3.71Å
163	E	96.7	Very high	95.1	Very high	111 Å²	111	39.9 Å²	39.9	52%	0.519	21%	0.207	S	C	.	.	H	α-helix	trans	-66.6	-42.8	178.9	-65.1	-171.9	169.5	0	0	111.1	H145 D161 G165 V166 L167 L199	H145-E163 IonicContact CE1-OE1 3.63Å; H145-E163 IonicContact CE1-OE2 3.63Å; H145-E163 IonicContact NE2-OE1 3.65Å; D161-E163 VanDerWaalsContact C-N 3.31Å; D161-E163 PolarHBondContact OD1-N 3.49Å; E163-G165 PolarHBondContact O-N 3.46Å; E163-V166 PolarHBondContact O-N 3.34Å; E163-L167 WeakPolarHBondContact O-CB 3.32Å; E163-L167 PolarHBondContact O-N 2.91Å; E163-L199 HydrophobicContact CG-CD2 4.19Å
164	F	96.3	Very high	95.1	Very high	38 Å²	38	39.2 Å²	39.2	17%	0.167	21%	0.206	C	C	.	.	H	α-helix	trans	-60.3	-45	174.6	-178.5	-98.9	0	0	0	112.3	I65 V127 C131 C139 D161 V166 L167 V168	I65-F164 HydrophobicContact CD1-CE1 4.36Å; I65-F164 HydrophobicContact CD1-CZ 4.25Å; V127-F164 HydrophobicContact CG1-CD1 4.01Å; V127-F164 HydrophobicContact CG1-CE1 3.86Å; C131-F164 VanDerWaalsContact SG-CE1 3.54Å; C139-F164 HydrophobicContact CB-CD1 3.84Å; C139-F164 HydrophobicContact CB-CE1 3.47Å; C139-F164 VanDerWaalsContact CB-CE1 3.47Å; C139-F164 HydrophobicContact CB-CE2 4.39Å; C139-F164 HydrophobicContact CB-CG 4.44Å; C139-F164 HydrophobicContact CB-CZ 3.78Å; D161-F164 HydrophobicContact CB-CB 4.21Å; D161-F164 VanDerWaalsContact CG-CB 3.48Å; D161-F164 PolarHBondContact OD1-N 3.31Å; F164-V166 PolarHBondContact O-N 2.9Å; F164-L167 WeakPolarHBondContact O-CB 3.5Å; F164-L167 PolarHBondContact O-N 3.08Å; F164-V168 HydrophobicContact CD1-CG2 4.31Å; F164-V168 HydrophobicContact CE1-CG2 3.84Å; F164-V168 HydrophobicContact CE2-CG2 4.33Å; F164-V168 HydrophobicContact CZ-CG2 3.86Å; F164-V168 WeakPolarHBondContact O-CG2 2.98Å; F164-V168 PolarHBondContact O-N 3.03Å
165	G	97.3	Very high	95.1	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-62.5	-43.2	177	0	0	0	0	0	112.7	A124 T128 D161 A162 E163 V168 S169	A124-G165 WeakPolarHBondContact CA-O 3.2Å; T128-G165 VanDerWaalsContact OG1-CA 3.3Å; T128-G165 WeakPolarHBondContact OG1-CA 3.36Å; T128-G165 PolarHBondContact OG1-N 3.48Å; D161-G165 PolarHBondContact O-N 3.12Å; A162-G165 PolarHBondContact O-N 2.74Å; E163-G165 PolarHBondContact O-N 3.46Å; G165-V168 PolarHBondContact O-N 2.84Å; G165-S169 WeakPolarHBondContact O-CB 3.27Å; G165-S169 PolarHBondContact O-N 3.27Å
166	V	98.3	Very high	94.7	Very high	4 Å²	4	32.9 Å²	32.9	2%	0.024	18%	0.18	C	C	.	.	H	α-helix	trans	-62.4	-41.6	175.1	163	0	0	0	0	111.8	A124 A162 E163 F164 S169 R170 R195 I198 L199	A124-V166 HydrophobicContact CB-CG2 4.04Å; A162-V166 WeakPolarHBondContact O-CB 3.36Å; A162-V166 WeakPolarHBondContact O-CG2 3.4Å; A162-V166 PolarHBondContact O-N 3.42Å; E163-V166 PolarHBondContact O-N 3.34Å; F164-V166 PolarHBondContact O-N 2.9Å; V166-S169 PolarHBondContact O-N 2.85Å; V166-R170 WeakPolarHBondContact O-CB 3.24Å; V166-R170 PolarHBondContact O-N 2.85Å; V166-R195 HydrophobicContact CG1-CB 3.98Å; V166-R195 HydrophobicContact CG1-CG 4.47Å; V166-R195 HydrophobicContact CG2-CB 4.07Å; V166-R195 WeakPolarHBondContact CG2-O 2.98Å; V166-R195 WeakPolarHBondContact O-CD 3.48Å; V166-I198 HydrophobicContact CG2-CB 4.35Å; V166-L199 HydrophobicContact CG1-CD1 4.42Å; V166-L199 HydrophobicContact CG2-CD1 4.3Å; V166-L199 HydrophobicContact CG2-CD2 4.03Å; V166-L199 HydrophobicContact CG2-CG 3.96Å
167	L	96.9	Very high	94.7	Very high	82 Å²	82	32.6 Å²	32.6	43%	0.429	17%	0.172	S	C	.	.	H	α-helix	trans	-60.2	-48.9	175.8	176.6	66.1	0	0	0	111.4	E163 F164 S169 R170 E171	E163-L167 WeakPolarHBondContact O-CB 3.32Å; E163-L167 PolarHBondContact O-N 2.91Å; F164-L167 WeakPolarHBondContact O-CB 3.5Å; F164-L167 PolarHBondContact O-N 3.08Å; L167-S169 PolarHBondContact O-N 3.25Å; L167-R170 PolarHBondContact O-N 3.12Å; L167-E171 HydrophobicContact CD1-CG 4.37Å; L167-E171 PolarHBondContact O-N 3.07Å
168	V	96.4	Very high	94.5	Very high	3 Å²	3	35.7 Å²	35.7	2%	0.018	17%	0.174	C	C	.	.	H	α-helix	trans	-59.5	-46.6	177.2	163.9	0	0	0	0	111.1	F58 I65 V69 V127 F164 G165 R170 E171 F172	F58-V168 HydrophobicContact CE1-CG1 4.42Å; F58-V168 HydrophobicContact CZ-CB 4.41Å; F58-V168 HydrophobicContact CZ-CG1 3.89Å; F58-V168 HydrophobicContact CZ-CG2 4.43Å; I65-V168 HydrophobicContact CD1-CB 4.42Å; I65-V168 HydrophobicContact CD1-CG1 3.93Å; I65-V168 HydrophobicContact CD1-CG2 3.59Å; V69-V168 HydrophobicContact CG2-CG1 3.92Å; V127-V168 HydrophobicContact CB-CG1 4.43Å; V127-V168 HydrophobicContact CG1-CB 4.13Å; V127-V168 HydrophobicContact CG1-CG1 4.11Å; V127-V168 HydrophobicContact CG1-CG2 4.15Å; V127-V168 HydrophobicContact CG2-CG1 3.81Å; F164-V168 HydrophobicContact CD1-CG2 4.31Å; F164-V168 HydrophobicContact CE1-CG2 3.84Å; F164-V168 HydrophobicContact CE2-CG2 4.33Å; F164-V168 HydrophobicContact CZ-CG2 3.86Å; F164-V168 WeakPolarHBondContact O-CG2 2.98Å; F164-V168 PolarHBondContact O-N 3.03Å; G165-V168 PolarHBondContact O-N 2.84Å; V168-R170 VanDerWaalsContact C-N 3.34Å; V168-R170 PolarHBondContact O-N 3.48Å; V168-E171 PolarHBondContact O-N 2.95Å; V168-F172 WeakPolarHBondContact O-CB 3.47Å; V168-F172 PolarHBondContact O-N 3.45Å
169	S	96.9	Very high	94.2	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-59.5	-43.5	176.9	179	0	0	0	0	111.9	S120 G165 V166 L167 F172 A173 R195	S120-S169 PolarHBondContact O-OG 3.03Å; G165-S169 WeakPolarHBondContact O-CB 3.27Å; G165-S169 PolarHBondContact O-N 3.27Å; V166-S169 PolarHBondContact O-N 2.85Å; L167-S169 PolarHBondContact O-N 3.25Å; S169-F172 PolarHBondContact O-N 3.43Å; S169-A173 WeakPolarHBondContact O-CB 3.31Å; S169-A173 PolarHBondContact O-N 3.44Å; S169-R195 WeakPolarHBondContact OG-CD 3.5Å
170	R	96.9	Very high	94	Very high	88 Å²	88	45.9 Å²	45.9	33%	0.332	22%	0.218	S	C	.	.	H	α-helix	trans	-63	-51.6	177.7	-171.9	177.5	-66.5	128.4	-3.5	112.2	V166 L167 V168 F172 D174 E192	V166-R170 WeakPolarHBondContact O-CB 3.24Å; V166-R170 PolarHBondContact O-N 2.85Å; L167-R170 PolarHBondContact O-N 3.12Å; V168-R170 VanDerWaalsContact C-N 3.34Å; V168-R170 PolarHBondContact O-N 3.48Å; R170-F172 VanDerWaalsContact C-N 3.26Å; R170-F172 PolarHBondContact O-N 2.87Å; R170-D174 VanDerWaalsContact O-CB 3.26Å; R170-D174 WeakPolarHBondContact O-CB 3.47Å; R170-D174 PolarHBondContact O-N 2.75Å; R170-E192 IonicContact CZ-OE1 2.84Å; R170-E192 IonicContact CZ-OE2 3.13Å; R170-E192 IonicContact NE-OE2 3.01Å; R170-E192 PolarHBondContact NE-OE2 2.58Å; R170-E192 VanDerWaalsContact NE-OE2 3.13Å; R170-E192 IonicContact NH2-OE1 3.51Å; R170-E192 PolarHBondContact NH2-OE1 3.02Å; R170-E192 IonicContact NH2-OE2 2.75Å; R170-E192 PolarHBondContact NH2-OE2 3.43Å
171	E	94.8	Very high	93.9	Very high	92 Å²	92	47.6 Å²	47.6	43%	0.43	23%	0.227	S	C	.	.	H	α-helix	trans	-61	-35.1	-179.9	-75.2	-63.2	145.1	0	0	112.5	F58 L167 V168 A175	F58-E171 HydrophobicContact CD2-CB 3.72Å; F58-E171 HydrophobicContact CE2-CB 3.51Å; F58-E171 HydrophobicContact CE2-CG 4.39Å; L167-E171 HydrophobicContact CD1-CG 4.37Å; L167-E171 PolarHBondContact O-N 3.07Å; V168-E171 PolarHBondContact O-N 2.95Å; E171-A175 WeakPolarHBondContact O-CB 3.39Å
172	F	93	Very high	93.9	Very high	2 Å²	2	46 Å²	46	1%	0.009	22%	0.218	C	C	.	.	H	α-helix	trans	-83.6	-49.4	-178.4	-172.7	-103.6	0	0	0	114	L51 Q55 F58 M66 V69 F101 V168 S169 R170	L51-F172 HydrophobicContact CD2-CE2 3.93Å; L51-F172 HydrophobicContact CD2-CZ 3.63Å; Q55-F172 HydrophobicContact CB-CD2 4.43Å; Q55-F172 HydrophobicContact CB-CE2 4.08Å; Q55-F172 HydrophobicContact CG-CD2 4.28Å; Q55-F172 HydrophobicContact CG-CE2 4.21Å; Q55-F172 PolarHBondContact NE2-O 2.83Å; F58-F172 HydrophobicContact CD1-CB 4.31Å; F58-F172 AromaticContact CD1-CD2 3.68Å; F58-F172 HydrophobicContact CD1-CD2 3.68Å; F58-F172 HydrophobicContact CD1-CG 4.45Å; F58-F172 HydrophobicContact CE1-CB 4.2Å; F58-F172 HydrophobicContact CE1-CD2 4.14Å; F58-F172 HydrophobicContact CG-CD2 4.38Å; M66-F172 HydrophobicContact CE-CE2 3.81Å; M66-F172 HydrophobicContact CE-CZ 4.1Å; M66-F172 HydrophobicContact SD-CE2 4.47Å; V69-F172 HydrophobicContact CG1-CD1 3.71Å; V69-F172 HydrophobicContact CG1-CE1 3.69Å; V69-F172 HydrophobicContact CG1-CG 4.18Å; V69-F172 HydrophobicContact CG1-CZ 4.17Å; F101-F172 AromaticContact CD2-CD1 3.85Å; F101-F172 HydrophobicContact CD2-CD1 3.85Å; F101-F172 AromaticContact CD2-CE1 3.44Å; F101-F172 HydrophobicContact CD2-CE1 3.44Å; F101-F172 VanDerWaalsContact CD2-CE1 3.44Å; F101-F172 AromaticContact CE2-CD1 3.69Å; F101-F172 HydrophobicContact CE2-CD1 3.69Å; F101-F172 AromaticContact CE2-CE1 3.52Å; F101-F172 HydrophobicContact CE2-CE1 3.52Å; F101-F172 HydrophobicContact CG-CE1 4.47Å; F101-F172 HydrophobicContact CZ-CD1 4.44Å; V168-F172 WeakPolarHBondContact O-CB 3.47Å; V168-F172 PolarHBondContact O-N 3.45Å; S169-F172 PolarHBondContact O-N 3.43Å; R170-F172 VanDerWaalsContact C-N 3.26Å; R170-F172 PolarHBondContact O-N 2.87Å
173	A	91.7	Very high	93.7	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-70.5	-44.8	-176.6	0	0	0	0	0	111.4	F101 S169 A175	F101-A173 HydrophobicContact CD1-CB 3.67Å; F101-A173 HydrophobicContact CE1-CB 3.49Å; F101-A173 VanDerWaalsContact CE1-CB 3.49Å; F101-A173 HydrophobicContact CZ-CB 4.22Å; S169-A173 WeakPolarHBondContact O-CB 3.31Å; S169-A173 PolarHBondContact O-N 3.44Å; A173-A175 VanDerWaalsContact C-N 3.26Å; A173-A175 PolarHBondContact O-N 2.96Å
174	D	93.3	Very high	93.6	Very high	28 Å²	28	42.2 Å²	42.2	15%	0.15	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-6.4	-173.5	-57.3	-3.9	0	0	0	112	R170 R176 E177 N191 R195	R170-D174 VanDerWaalsContact O-CB 3.26Å; R170-D174 WeakPolarHBondContact O-CB 3.47Å; R170-D174 PolarHBondContact O-N 2.75Å; D174-R176 PolarHBondContact O-N 2.69Å; D174-R176 VanDerWaalsContact O-N 3.07Å; D174-E177 PolarHBondContact O-N 3.46Å; D174-E177 VanDerWaalsContact O-N 3.07Å; D174-N191 PolarHBondContact OD1-ND2 2.84Å; D174-R195 IonicContact OD1-CZ 3.62Å; D174-R195 IonicContact OD1-NH1 3.6Å; D174-R195 PolarHBondContact OD1-NH1 3.07Å; D174-R195 IonicContact OD1-NH2 3.45Å; D174-R195 IonicContact OD2-CZ 3.76Å; D174-R195 IonicContact OD2-NH1 2.88Å; D174-R195 PolarHBondContact OD2-NH1 3.41Å; D174-R195 IonicContact OD2-NH2 2.81Å; D174-R195 PolarHBondContact OD2-NH2 3.22Å
175	A	91.9	Very high	93.6	Very high	7 Å²	7	41.4 Å²	41.4	6%	0.058	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-22.2	174.8	0	0	0	0	0	113.8	K54 Q55 E171 A173	K54-A175 HydrophobicContact CB-CB 4.11Å; K54-A175 HydrophobicContact CD-CB 3.86Å; K54-A175 HydrophobicContact CG-CB 3.86Å; Q55-A175 HydrophobicContact CG-CB 3.63Å; E171-A175 WeakPolarHBondContact O-CB 3.39Å; A173-A175 VanDerWaalsContact C-N 3.26Å; A173-A175 PolarHBondContact O-N 2.96Å
176	R	86	Confident	93.5	Very high	65 Å²	65	41.4 Å²	41.4	25%	0.245	20%	0.199	C	C	.	.	S	Bend	trans	-92.3	-25.9	177	-71	-171.5	56.9	163.3	9	113.6	G50 V52 Q55 F101 G102 D174 N178	G50-R176 PolarHBondContact O-NH1 3.17Å; G50-R176 VanDerWaalsContact O-NH1 3.14Å; V52-R176 HydrophobicContact CB-CG 4.25Å; V52-R176 HydrophobicContact CG1-CG 3.73Å; V52-R176 HydrophobicContact CG2-CG 3.49Å; V52-R176 VanDerWaalsContact CG2-CG 3.49Å; Q55-R176 VanDerWaalsContact OE1-CD 3.31Å; F101-R176 WeakPolarHBondContact O-CD 3.2Å; F101-R176 VanDerWaalsContact O-CZ 3.29Å; F101-R176 PolarHBondContact O-NE 3.25Å; F101-R176 PolarHBondContact O-NH1 3.46Å; G102-R176 VanDerWaalsContact N-NH1 3.18Å; D174-R176 PolarHBondContact O-N 2.69Å; D174-R176 VanDerWaalsContact O-N 3.07Å; R176-N178 PolarHBondContact O-N 3Å
177	E	89.4	Confident	93.4	Very high	16 Å²	16	41.6 Å²	41.6	8%	0.075	20%	0.199	C	C	.	.			trans	-88.1	49.1	-173.7	-48.8	-56.3	164.7	0	0	111.4	D174 S184 N187 R188	D174-E177 PolarHBondContact O-N 3.46Å; D174-E177 VanDerWaalsContact O-N 3.07Å; E177-S184 WeakPolarHBondContact OE2-CA 3.49Å; E177-N187 VanDerWaalsContact CD-ND2 3.25Å; E177-N187 HydrophobicContact CG-CB 3.83Å; E177-N187 PolarHBondContact OE1-ND2 3.47Å; E177-N187 PolarHBondContact OE2-ND2 2.86Å; E177-R188 HydrophobicContact CB-CG 3.52Å; E177-R188 HydrophobicContact CG-CG 4.24Å; E177-R188 WeakPolarHBondContact O-CD 3.43Å; E177-R188 PolarHBondContact O-NH1 3.17Å
178	N	87.2	Confident	93.4	Very high	128 Å²	128	42 Å²	42	68%	0.684	20%	0.195	S	C	*	.			trans	-100.2	0.1	-177.3	-164.6	32	0	0	0	113.4	R176	R176-N178 PolarHBondContact O-N 3Å
179	R	89.4	Confident	93.5	Very high	174 Å²	174	44.1 Å²	44.1	66%	0.657	21%	0.205	S	C	*	.	S	Bend	trans	-80.6	146.5	178	-63.8	-176.6	178.5	-176.8	-0	109.9	D181 S184 R188	R179-D181 HydrophobicContact CB-CB 4.5Å; R179-D181 WeakPolarHBondContact CB-OD2 3.3Å; R179-D181 PolarHBondContact O-N 3.44Å; R179-S184 VanDerWaalsContact O-CB 3.26Å; R179-S184 WeakPolarHBondContact O-CB 3.49Å; R179-S184 PolarHBondContact O-OG 3.5Å; R179-R188 PolarHBondContact O-NH1 2.8Å
180	P	92.1	Very high	93.5	Very high	75 Å²	75	44.1 Å²	44.1	49%	0.487	21%	0.205	S	C	.	.	S	Bend	trans	-81.7	40.4	174.3	36.1	-36.4	0	0	0	111.5	V256 E257	P180-V256 HydrophobicContact CB-CB 4.36Å; P180-V256 HydrophobicContact CB-CG1 4.16Å; P180-V256 HydrophobicContact CB-CG2 4.02Å; P180-E257 PolarHBondContact O-N 3.16Å
181	D	93.9	Very high	93.6	Very high	44 Å²	44	40 Å²	40	24%	0.235	19%	0.189	C	C	.	.	S	Bend	trans	-105.1	160.1	179	61.6	18.2	0	0	0	111.7	R179 R183 S184 A185	R179-D181 HydrophobicContact CB-CB 4.5Å; R179-D181 WeakPolarHBondContact CB-OD2 3.3Å; R179-D181 PolarHBondContact O-N 3.44Å; D181-R183 PolarHBondContact O-N 2.98Å; D181-S184 PolarHBondContact O-N 3.31Å; D181-S184 WeakPolarHBondContact OD1-CA 3.43Å; D181-S184 WeakPolarHBondContact OD1-CB 3.36Å; D181-S184 PolarHBondContact OD1-N 3.18Å; D181-S184 PolarHBondContact OD1-OG 3.01Å; D181-A185 PolarHBondContact O-N 3.23Å; D181-A185 VanDerWaalsContact O-N 3.11Å
182	A	95.7	Very high	93.8	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.008	18%	0.177	C	C	.	.	H	α-helix	trans	-60.9	-33.6	-177.6	0	0	0	0	0	111.6	A185 M186 V246 E257 L259 Y277	A182-A185 PolarHBondContact O-N 2.96Å; A182-M186 WeakPolarHBondContact O-CB 3.31Å; A182-M186 PolarHBondContact O-N 2.9Å; A182-V246 HydrophobicContact CB-CB 4.3Å; A182-V246 HydrophobicContact CB-CG1 3.72Å; A182-V246 HydrophobicContact CB-CG2 3.59Å; A182-E257 HydrophobicContact CB-CB 4.07Å; A182-E257 WeakPolarHBondContact CB-OE2 3.45Å; A182-E257 PolarHBondContact N-OE2 3.03Å; A182-L259 HydrophobicContact CB-CD2 4.05Å; A182-Y277 HydrophobicContact CB-CE1 3.94Å
183	R	93.8	Very high	94	Very high	36 Å²	36	37.2 Å²	37.2	14%	0.136	18%	0.176	C	C	.	.	H	α-helix	trans	-67.1	-47.4	179.9	-175.8	58.5	-169.8	-116	2.8	111.7	L105 D106 K107 H116 D181 A185 M186 N187	L105-R183 VanDerWaalsContact O-CZ 3.25Å; L105-R183 PolarHBondContact O-NH1 2.73Å; L105-R183 PolarHBondContact O-NH2 2.88Å; D106-R183 PolarHBondContact O-NH1 2.81Å; K107-R183 PolarHBondContact O-NH1 3.15Å; H116-R183 PolarHBondContact NE2-NH2 2.86Å; D181-R183 PolarHBondContact O-N 2.98Å; R183-A185 VanDerWaalsContact C-N 3.27Å; R183-A185 PolarHBondContact O-N 2.89Å; R183-M186 WeakPolarHBondContact O-CB 3.31Å; R183-M186 PolarHBondContact O-N 2.83Å; R183-N187 PolarHBondContact NE-ND2 2.85Å; R183-N187 PolarHBondContact NE-OD1 3.06Å; R183-N187 WeakPolarHBondContact O-CB 3.21Å; R183-N187 VanDerWaalsContact O-CG 3.32Å; R183-N187 PolarHBondContact O-N 3.38Å; R183-N187 PolarHBondContact O-OD1 3.35Å
184	S	93.8	Very high	94.3	Very high	4 Å²	4	37.2 Å²	37.2	3%	0.028	18%	0.176	C	C	.	.	H	α-helix	trans	-63.6	-36.8	176.7	-56.4	0	0	0	0	111.2	E177 R179 D181 N187 R188	E177-S184 WeakPolarHBondContact OE2-CA 3.49Å; R179-S184 VanDerWaalsContact O-CB 3.26Å; R179-S184 WeakPolarHBondContact O-CB 3.49Å; R179-S184 PolarHBondContact O-OG 3.5Å; D181-S184 PolarHBondContact O-N 3.31Å; D181-S184 WeakPolarHBondContact OD1-CA 3.43Å; D181-S184 WeakPolarHBondContact OD1-CB 3.36Å; D181-S184 PolarHBondContact OD1-N 3.18Å; D181-S184 PolarHBondContact OD1-OG 3.01Å; S184-N187 PolarHBondContact O-N 3.09Å; S184-R188 VanDerWaalsContact CB-NH1 3.32Å; S184-R188 WeakPolarHBondContact O-CB 3.48Å; S184-R188 VanDerWaalsContact O-CG 3.3Å; S184-R188 WeakPolarHBondContact O-CG 3.28Å; S184-R188 PolarHBondContact O-N 3.29Å
185	A	96.1	Very high	94.6	Very high	20 Å²	20	35.9 Å²	35.9	17%	0.165	17%	0.17	C	C	.	.	H	α-helix	trans	-61.6	-45.3	174.3	0	0	0	0	0	112.4	D181 A182 R183 H189 L259	D181-A185 PolarHBondContact O-N 3.23Å; D181-A185 VanDerWaalsContact O-N 3.11Å; A182-A185 PolarHBondContact O-N 2.96Å; R183-A185 VanDerWaalsContact C-N 3.27Å; R183-A185 PolarHBondContact O-N 2.89Å; A185-H189 PolarHBondContact O-N 3.5Å; A185-L259 HydrophobicContact CB-CD1 4.21Å; A185-L259 HydrophobicContact CB-CG 4.25Å
186	M	97.1	Very high	94.9	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62	-49.4	176.2	-169.3	-162.8	80.3	0	0	111.5	A108 A182 R183 R188 H189 N190 L259 V275 Y277	A108-M186 HydrophobicContact CB-CE 4.2Å; A108-M186 HydrophobicContact CB-SD 3.61Å; A182-M186 WeakPolarHBondContact O-CB 3.31Å; A182-M186 PolarHBondContact O-N 2.9Å; R183-M186 WeakPolarHBondContact O-CB 3.31Å; R183-M186 PolarHBondContact O-N 2.83Å; M186-R188 PolarHBondContact O-N 3.26Å; M186-H189 PolarHBondContact O-N 3.19Å; M186-N190 WeakPolarHBondContact CG-ND2 3.39Å; M186-N190 PolarHBondContact O-N 3.48Å; M186-N190 PolarHBondContact O-ND2 3.11Å; M186-L259 HydrophobicContact CB-CD1 3.79Å; M186-L259 HydrophobicContact CG-CD1 4.4Å; M186-V275 HydrophobicContact CG-CG2 4.08Å; M186-V275 VanDerWaalsContact CG-O 3.26Å; M186-V275 WeakPolarHBondContact CG-O 3.32Å; M186-Y277 HydrophobicContact CB-CD1 4.4Å; M186-Y277 HydrophobicContact CB-CE1 4.17Å; M186-Y277 HydrophobicContact SD-CD1 4.15Å; M186-Y277 HydrophobicContact SD-CE1 4.17Å
187	N	95.6	Very high	95.5	Very high	8 Å²	8	33.1 Å²	33.1	4%	0.043	16%	0.159	C	C	.	.	H	α-helix	trans	-61.5	-46.3	-177.9	-72.7	-0.5	0	0	0	111.3	H116 E177 R183 S184 H189 N190 N191	H116-N187 PolarHBondContact CD2-OD1 3.47Å; H116-N187 VanDerWaalsContact CE1-CG 3.47Å; H116-N187 PolarHBondContact CE1-ND2 3.07Å; H116-N187 VanDerWaalsContact CE1-ND2 3.35Å; H116-N187 PolarHBondContact NE2-ND2 3.41Å; H116-N187 PolarHBondContact NE2-OD1 2.86Å; E177-N187 VanDerWaalsContact CD-ND2 3.25Å; E177-N187 HydrophobicContact CG-CB 3.83Å; E177-N187 PolarHBondContact OE1-ND2 3.47Å; E177-N187 PolarHBondContact OE2-ND2 2.86Å; R183-N187 PolarHBondContact NE-ND2 2.85Å; R183-N187 PolarHBondContact NE-OD1 3.06Å; R183-N187 WeakPolarHBondContact O-CB 3.21Å; R183-N187 VanDerWaalsContact O-CG 3.32Å; R183-N187 PolarHBondContact O-N 3.38Å; R183-N187 PolarHBondContact O-OD1 3.35Å; S184-N187 PolarHBondContact O-N 3.09Å; N187-H189 VanDerWaalsContact C-N 3.34Å; N187-H189 PolarHBondContact O-N 2.92Å; N187-N190 PolarHBondContact O-N 3.41Å; N187-N191 VanDerWaalsContact O-CB 3.28Å; N187-N191 WeakPolarHBondContact O-CB 3.45Å; N187-N191 PolarHBondContact O-N 3.31Å; N187-N191 PolarHBondContact O-ND2 3.46Å; N187-N191 PolarHBondContact O-OD1 3.32Å
188	R	96.4	Very high	95.9	Very high	90 Å²	90	32.4 Å²	32.4	34%	0.34	16%	0.156	S	C	.	.	H	α-helix	trans	-58.7	-43.7	176.4	-72.3	-173.6	-54.3	-97.3	-0.4	112.4	E177 R179 S184 M186 E192	E177-R188 HydrophobicContact CB-CG 3.52Å; E177-R188 HydrophobicContact CG-CG 4.24Å; E177-R188 WeakPolarHBondContact O-CD 3.43Å; E177-R188 PolarHBondContact O-NH1 3.17Å; R179-R188 PolarHBondContact O-NH1 2.8Å; S184-R188 VanDerWaalsContact CB-NH1 3.32Å; S184-R188 WeakPolarHBondContact O-CB 3.48Å; S184-R188 VanDerWaalsContact O-CG 3.3Å; S184-R188 WeakPolarHBondContact O-CG 3.28Å; S184-R188 PolarHBondContact O-N 3.29Å; M186-R188 PolarHBondContact O-N 3.26Å; R188-E192 WeakPolarHBondContact O-CB 3.37Å; R188-E192 PolarHBondContact O-N 2.95Å
189	H	98.2	Very high	96.4	Very high	49 Å²	49	29.5 Å²	29.5	23%	0.227	14%	0.14	C	C	.	.	H	α-helix	trans	-62.3	-49.4	178.6	-176	94.8	0	0	0	111.6	A185 M186 N187 E192 A193 T270 D273 V275	A185-H189 PolarHBondContact O-N 3.5Å; M186-H189 PolarHBondContact O-N 3.19Å; N187-H189 VanDerWaalsContact C-N 3.34Å; N187-H189 PolarHBondContact O-N 2.92Å; H189-E192 WeakPolarHBondContact O-CB 3.26Å; H189-E192 PolarHBondContact O-N 2.93Å; H189-A193 PolarHBondContact O-N 2.89Å; H189-T270 PolarHBondContact CE1-O 2.9Å; H189-T270 VanDerWaalsContact CE1-O 3.29Å; H189-T270 PolarHBondContact NE2-O 3.41Å; H189-D273 PolarHBondContact CD2-O 2.77Å; H189-D273 PolarHBondContact NE2-O 2.93Å; H189-V275 HydrophobicContact CB-CG2 3.98Å; H189-V275 VanDerWaalsContact CD2-CG2 3.43Å; H189-V275 WeakPolarHBondContact CD2-CG2 3.48Å
190	N	98.2	Very high	96.7	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-69.4	-36.7	-178.9	-66.9	-36.2	0	0	0	112.6	A113 H116 A117 M186 N187 E192 A193 G194 M274 V275	A113-N190 WeakPolarHBondContact CA-ND2 3.35Å; A113-N190 WeakPolarHBondContact CB-ND2 3.26Å; H116-N190 HydrophobicContact CB-CB 4.21Å; A117-N190 VanDerWaalsContact CA-O 3.26Å; A117-N190 WeakPolarHBondContact CA-O 3.27Å; A117-N190 VanDerWaalsContact CB-O 3.28Å; A117-N190 WeakPolarHBondContact CB-O 3.36Å; M186-N190 WeakPolarHBondContact CG-ND2 3.39Å; M186-N190 PolarHBondContact O-N 3.48Å; M186-N190 PolarHBondContact O-ND2 3.11Å; N187-N190 PolarHBondContact O-N 3.41Å; N190-E192 VanDerWaalsContact C-N 3.28Å; N190-E192 PolarHBondContact O-N 3.07Å; N190-A193 PolarHBondContact O-N 3.04Å; N190-G194 PolarHBondContact O-N 2.83Å; N190-M274 VanDerWaalsContact OD1-CA 3.31Å; N190-M274 WeakPolarHBondContact OD1-CA 3.36Å; N190-V275 PolarHBondContact ND2-O 2.92Å; N190-V275 PolarHBondContact OD1-N 2.98Å; N190-V275 PolarHBondContact OD1-O 2.83Å
191	N	97.7	Very high	97	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-59.3	-42.9	172.3	-68.3	-14.1	0	0	0	110.4	H116 S120 D174 N187 G194 R195	H116-N191 VanDerWaalsContact CB-OD1 3.31Å; H116-N191 WeakPolarHBondContact CB-OD1 3.39Å; H116-N191 PolarHBondContact ND1-OD1 2.98Å; H116-N191 PolarHBondContact O-OD1 2.94Å; S120-N191 WeakPolarHBondContact CB-O 3.39Å; S120-N191 WeakPolarHBondContact OG-CA 3.27Å; S120-N191 VanDerWaalsContact OG-CB 3.29Å; S120-N191 WeakPolarHBondContact OG-CB 3.47Å; S120-N191 VanDerWaalsContact OG-CG 3.22Å; S120-N191 PolarHBondContact OG-OD1 3Å; S120-N191 VanDerWaalsContact OG-OD1 3.07Å; D174-N191 PolarHBondContact OD1-ND2 2.84Å; N187-N191 VanDerWaalsContact O-CB 3.28Å; N187-N191 WeakPolarHBondContact O-CB 3.45Å; N187-N191 PolarHBondContact O-N 3.31Å; N187-N191 PolarHBondContact O-ND2 3.46Å; N187-N191 PolarHBondContact O-OD1 3.32Å; N191-G194 PolarHBondContact O-N 2.82Å; N191-R195 VanDerWaalsContact CB-NH1 3.35Å; N191-R195 WeakPolarHBondContact O-CG 3.32Å; N191-R195 PolarHBondContact O-N 3.26Å
192	E	98.4	Very high	97.1	Very high	36 Å²	36	22.2 Å²	22.2	17%	0.168	11%	0.108	C	C	.	.	H	α-helix	trans	-64.5	-47.3	176.3	-170.2	59.1	-154	0	0	111.7	R170 R188 H189 N190 G194 R195 T196	R170-E192 IonicContact CZ-OE1 2.84Å; R170-E192 IonicContact CZ-OE2 3.13Å; R170-E192 IonicContact NE-OE2 3.01Å; R170-E192 PolarHBondContact NE-OE2 2.58Å; R170-E192 VanDerWaalsContact NE-OE2 3.13Å; R170-E192 IonicContact NH2-OE1 3.51Å; R170-E192 PolarHBondContact NH2-OE1 3.02Å; R170-E192 IonicContact NH2-OE2 2.75Å; R170-E192 PolarHBondContact NH2-OE2 3.43Å; R188-E192 WeakPolarHBondContact O-CB 3.37Å; R188-E192 PolarHBondContact O-N 2.95Å; H189-E192 WeakPolarHBondContact O-CB 3.26Å; H189-E192 PolarHBondContact O-N 2.93Å; N190-E192 VanDerWaalsContact C-N 3.28Å; N190-E192 PolarHBondContact O-N 3.07Å; E192-G194 PolarHBondContact O-N 2.91Å; E192-R195 CarbonylContact O-C 3.53Å; E192-R195 WeakPolarHBondContact O-CA 3.31Å; E192-R195 PolarHBondContact O-N 2.89Å; E192-R195 IonicContact OE2-CZ 2.74Å; E192-R195 VanDerWaalsContact OE2-CZ 3.3Å; E192-R195 IonicContact OE2-NE 3.88Å; E192-R195 PolarHBondContact OE2-NE 3.05Å; E192-R195 IonicContact OE2-NH2 3.3Å; E192-R195 PolarHBondContact OE2-NH2 3.48Å; E192-T196 PolarHBondContact O-N 3.42Å; E192-T196 PolarHBondContact O-OG1 2.92Å; E192-T196 PolarHBondContact OE1-OG1 3.4Å
193	A	98.6	Very high	97.1	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-53.7	-40.4	175.9	0	0	0	0	0	112.7	H189 N190 T197 E271	H189-A193 PolarHBondContact O-N 2.89Å; N190-A193 PolarHBondContact O-N 3.04Å; A193-T197 PolarHBondContact O-N 3.03Å; A193-T197 PolarHBondContact O-OG1 2.91Å; A193-E271 WeakPolarHBondContact CA-O 3.3Å; A193-E271 VanDerWaalsContact CB-O 3.3Å; A193-E271 WeakPolarHBondContact CB-O 3.16Å; A193-E271 PolarHBondContact N-O 3.01Å
194	G	98.4	Very high	97.1	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-62.8	-45.9	172.7	0	0	0	0	0	113.4	A117 A121 N190 N191 E192 T197	A117-G194 WeakPolarHBondContact O-CA 3.26Å; A121-G194 WeakPolarHBondContact CB-O 3.31Å; N190-G194 PolarHBondContact O-N 2.83Å; N191-G194 PolarHBondContact O-N 2.82Å; E192-G194 PolarHBondContact O-N 2.91Å; G194-T197 WeakPolarHBondContact O-CB 3.48Å; G194-T197 PolarHBondContact O-N 3.31Å
195	R	98.6	Very high	97.1	Very high	1 Å²	1	33.9 Å²	33.9	0%	0.004	16%	0.159	C	C	.	.	H	α-helix	trans	-68.1	-45.4	179.7	-72.5	-178.7	-60.9	-112.8	7.4	112.8	V166 S169 D174 N191 E192 T197 I198	V166-R195 HydrophobicContact CG1-CB 3.98Å; V166-R195 HydrophobicContact CG1-CG 4.47Å; V166-R195 HydrophobicContact CG2-CB 4.07Å; V166-R195 WeakPolarHBondContact CG2-O 2.98Å; V166-R195 WeakPolarHBondContact O-CD 3.48Å; S169-R195 WeakPolarHBondContact OG-CD 3.5Å; D174-R195 IonicContact OD1-CZ 3.62Å; D174-R195 IonicContact OD1-NH1 3.6Å; D174-R195 PolarHBondContact OD1-NH1 3.07Å; D174-R195 IonicContact OD1-NH2 3.45Å; D174-R195 IonicContact OD2-CZ 3.76Å; D174-R195 IonicContact OD2-NH1 2.88Å; D174-R195 PolarHBondContact OD2-NH1 3.41Å; D174-R195 IonicContact OD2-NH2 2.81Å; D174-R195 PolarHBondContact OD2-NH2 3.22Å; N191-R195 VanDerWaalsContact CB-NH1 3.35Å; N191-R195 WeakPolarHBondContact O-CG 3.32Å; N191-R195 PolarHBondContact O-N 3.26Å; E192-R195 CarbonylContact O-C 3.53Å; E192-R195 WeakPolarHBondContact O-CA 3.31Å; E192-R195 PolarHBondContact O-N 2.89Å; E192-R195 IonicContact OE2-CZ 2.74Å; E192-R195 VanDerWaalsContact OE2-CZ 3.3Å; E192-R195 IonicContact OE2-NE 3.88Å; E192-R195 PolarHBondContact OE2-NE 3.05Å; E192-R195 IonicContact OE2-NH2 3.3Å; E192-R195 PolarHBondContact OE2-NH2 3.48Å; R195-T197 PolarHBondContact O-N 3.01Å; R195-I198 WeakPolarHBondContact O-CB 3.49Å; R195-I198 PolarHBondContact O-N 2.72Å
196	T	98.3	Very high	97.1	Very high	13 Å²	13	35.6 Å²	35.6	8%	0.08	17%	0.169	C	C	.	.	H	α-helix	trans	-59.8	-34.3	179	-48.4	0	0	0	0	111.1	E192 I198 L199 D200 R272	E192-T196 PolarHBondContact O-N 3.42Å; E192-T196 PolarHBondContact O-OG1 2.92Å; E192-T196 PolarHBondContact OE1-OG1 3.4Å; T196-I198 PolarHBondContact O-N 3.07Å; T196-L199 PolarHBondContact O-N 2.98Å; T196-L199 VanDerWaalsContact O-N 3.09Å; T196-D200 PolarHBondContact O-N 3.04Å; T196-R272 HydrophobicContact CG2-CG 4.07Å
197	T	98.1	Very high	97	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-57.6	-34	175.1	-62.1	0	0	0	0	112.5	A193 G194 R195 H201 L230 Y233 L234	A193-T197 PolarHBondContact O-N 3.03Å; A193-T197 PolarHBondContact O-OG1 2.91Å; G194-T197 WeakPolarHBondContact O-CB 3.48Å; G194-T197 PolarHBondContact O-N 3.31Å; R195-T197 PolarHBondContact O-N 3.01Å; T197-H201 PolarHBondContact O-N 2.76Å; T197-H201 PolarHBondContact O-ND1 3.18Å; T197-L230 HydrophobicContact CG2-CD2 4.07Å; T197-Y233 HydrophobicContact CG2-CD1 3.47Å; T197-Y233 VanDerWaalsContact CG2-CD1 3.47Å; T197-Y233 HydrophobicContact CG2-CE1 3.86Å; T197-Y233 HydrophobicContact CG2-CG 4.36Å; T197-Y233 WeakPolarHBondContact OG1-CE1 3.3Å; T197-L234 HydrophobicContact CG2-CD2 4.42Å; T197-L234 HydrophobicContact CG2-CG 4.32Å
198	I	97.9	Very high	97	Very high	2 Å²	2	43.7 Å²	43.7	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-63.3	-48.4	175.5	-54	-51.3	0	0	0	110.6	A121 A124 F125 A162 V166 R195 T196 H201 M202 L230	A121-I198 HydrophobicContact CB-CD1 3.98Å; A121-I198 HydrophobicContact CB-CG1 4.49Å; A124-I198 HydrophobicContact CB-CG1 3.91Å; F125-I198 HydrophobicContact CB-CD1 4.27Å; A162-I198 HydrophobicContact CB-CG2 4.2Å; V166-I198 HydrophobicContact CG2-CB 4.35Å; R195-I198 WeakPolarHBondContact O-CB 3.49Å; R195-I198 PolarHBondContact O-N 2.72Å; T196-I198 PolarHBondContact O-N 3.07Å; I198-H201 PolarHBondContact O-N 3.5Å; I198-M202 WeakPolarHBondContact O-CG 3.48Å; I198-M202 PolarHBondContact O-N 3.06Å; I198-L230 HydrophobicContact CD1-CD1 3.54Å
199	L	97.3	Very high	96.9	Very high	66 Å²	66	44.2 Å²	44.2	35%	0.346	22%	0.215	S	C	.	.	H	α-helix	trans	-65.5	-44.5	-178.6	-58.4	175.2	0	0	0	111.4	A162 E163 V166 T196 H201 M202	A162-L199 HydrophobicContact CB-CD2 3.76Å; E163-L199 HydrophobicContact CG-CD2 4.19Å; V166-L199 HydrophobicContact CG1-CD1 4.42Å; V166-L199 HydrophobicContact CG2-CD1 4.3Å; V166-L199 HydrophobicContact CG2-CD2 4.03Å; V166-L199 HydrophobicContact CG2-CG 3.96Å; T196-L199 PolarHBondContact O-N 2.98Å; T196-L199 VanDerWaalsContact O-N 3.09Å; L199-H201 PolarHBondContact O-N 3.41Å; L199-M202 PolarHBondContact O-N 3.27Å
200	D	97.3	Very high	96.6	Very high	67 Å²	67	42.6 Å²	42.6	36%	0.358	21%	0.211	S	C	.	.	H	α-helix	trans	-64.2	-23.2	-177.4	-73.1	-21.1	0	0	0	113	T196 R272	T196-D200 PolarHBondContact O-N 3.04Å; D200-R272 IonicContact OD1-CZ 3.8Å; D200-R272 IonicContact OD1-NE 3.56Å; D200-R272 IonicContact OD1-NH2 3.1Å; D200-R272 PolarHBondContact OD1-NH2 2.7Å; D200-R272 VanDerWaalsContact OD1-NH2 3.1Å; D200-R272 WeakPolarHBondContact OD2-CD 3.48Å; D200-R272 IonicContact OD2-CZ 2.7Å; D200-R272 IonicContact OD2-NE 3.46Å; D200-R272 PolarHBondContact OD2-NE 2.8Å; D200-R272 IonicContact OD2-NH2 2.93Å
201	H	97.6	Very high	96.5	Very high	41 Å²	41	49.9 Å²	49.9	19%	0.19	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109	9.2	-175.4	-66.2	82.3	0	0	0	114.2	T197 I198 L199 H203 P225 M229 L230 Y233	T197-H201 PolarHBondContact O-N 2.76Å; T197-H201 PolarHBondContact O-ND1 3.18Å; I198-H201 PolarHBondContact O-N 3.5Å; L199-H201 PolarHBondContact O-N 3.41Å; H201-H203 PolarHBondContact O-N 3.01Å; H201-P225 HydrophobicContact CB-CG 4.09Å; H201-P225 WeakPolarHBondContact O-CD 3.3Å; H201-M229 HydrophobicContact CB-CE 4.41Å; H201-M229 HydrophobicContact CB-SD 4.49Å; H201-L230 HydrophobicContact CB-CD2 3.67Å; H201-Y233 AromaticContact CE1-CD1 3.89Å; H201-Y233 AromaticContact CE1-CD2 3.8Å; H201-Y233 AromaticContact CE1-CE1 3.97Å; H201-Y233 AromaticContact CE1-CE2 3.9Å; H201-Y233 AromaticContact CE1-CG 3.79Å; H201-Y233 AromaticContact CE1-CZ 3.97Å; H201-Y233 AromaticContact NE2-CD2 3.72Å; H201-Y233 AromaticContact NE2-CG 3.94Å
202	M	96.1	Very high	96.2	Very high	33 Å²	33	56.1 Å²	56.1	16%	0.163	29%	0.293	C	S	.	.			trans	-60	131.9	167.3	-67.6	-58.7	-72.2	0	0	109.7	E160 A162 I198 L199 W222 Q224	E160-M202 HydrophobicContact CB-CE 4.16Å; A162-M202 HydrophobicContact CB-CE 4.06Å; A162-M202 HydrophobicContact CB-CG 3.92Å; A162-M202 HydrophobicContact CB-SD 3.71Å; I198-M202 WeakPolarHBondContact O-CG 3.48Å; I198-M202 PolarHBondContact O-N 3.06Å; L199-M202 PolarHBondContact O-N 3.27Å; M202-W222 HydrophobicContact CB-CE3 4.19Å; M202-W222 HydrophobicContact CE-CB 4.06Å; M202-Q224 HydrophobicContact CE-CG 4.21Å; M202-Q224 HydrophobicContact SD-CB 4.26Å; M202-Q224 HydrophobicContact SD-CG 3.46Å; M202-Q224 WeakPolarHBondContact SD-CG 3.35Å
203	H	95.2	Very high	95.8	Very high	78 Å²	78	56.8 Å²	56.8	36%	0.361	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	157.2	-178.2	66.3	-76.3	0	0	0	111.7	H201 R205 W222 A223	H201-H203 PolarHBondContact O-N 3.01Å; H203-R205 PolarHBondContact O-N 3.31Å; H203-W222 VanDerWaalsContact C-CE3 3.46Å; H203-A223 PolarHBondContact N-O 3.41Å; H203-A223 VanDerWaalsContact N-O 3.07Å; H203-A223 PolarHBondContact ND1-O 3.21Å; H203-A223 PolarHBondContact O-N 3.35Å
204	L	93.7	Very high	95.6	Very high	71 Å²	71	58.5 Å²	58.5	37%	0.372	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	119.9	174.4	-81.8	170.7	0	0	0	110	W153 W155 C220 W222	W153-L204 HydrophobicContact CH2-CD1 4.12Å; W153-L204 HydrophobicContact CH2-CD2 4Å; W153-L204 HydrophobicContact CZ2-CD1 3.9Å; W153-L204 HydrophobicContact CZ3-CD2 4.44Å; W155-L204 HydrophobicContact CH2-CD2 3.72Å; W155-L204 HydrophobicContact CZ3-CD2 3.62Å; L204-C220 HydrophobicContact CD2-CB 4.11Å; L204-W222 HydrophobicContact CD2-CD2 4.41Å; L204-W222 HydrophobicContact CG-CE3 4.42Å; L204-W222 HydrophobicContact CG-CH2 4.27Å; L204-W222 HydrophobicContact CG-CZ2 4.45Å; L204-W222 HydrophobicContact CG-CZ3 4.27Å
205	R	95.1	Very high	95.5	Very high	137 Å²	137	62.1 Å²	62.1	52%	0.517	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	130.6	168.7	-171.6	174.4	-176	176.4	3.2	109	H203 C220 W221 A223	H203-R205 PolarHBondContact O-N 3.31Å; R205-C220 CarbonylContact O-C 3.52Å; R205-C220 WeakPolarHBondContact O-CA 3.04Å; R205-W221 HydrophobicContact CG-CZ2 4.13Å; R205-W221 PolarHBondContact N-O 3.35Å; R205-W221 PolarHBondContact O-N 2.83Å; R205-A223 HydrophobicContact CB-CB 3.8Å
206	C	94.4	Very high	95.2	Very high	56 Å²	56	69.9 Å²	69.9	38%	0.378	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	146.2	-177.8	-57.1	0	0	0	0	111.6	K218 T219 C220	C206-K218 HydrophobicContact CB-CD 4.39Å; C206-T219 CarbonylContact C-O 3.53Å; C206-T219 VanDerWaalsContact CA-O 3.28Å; C206-T219 WeakPolarHBondContact CA-O 3.47Å; C206-C220 HydrophobicContact CB-CB 4.03Å; C206-C220 WeakPolarHBondContact CB-SG 3.3Å; C206-C220 WeakPolarHBondContact SG-CB 3.46Å; C206-C220 CovalentContact SG-SG 2.03Å; C206-C220 PolarHBondContact SG-SG 3.29Å
207	K	95.7	Very high	94.9	Very high	138 Å²	138	73 Å²	73	60%	0.6	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.2	128.2	168.6	-175.6	176.1	-177.4	-179.4	0	110.1	K218 T219 W221	K207-K218 VanDerWaalsContact O-CA 3.28Å; K207-K218 WeakPolarHBondContact O-CA 3.26Å; K207-K218 WeakPolarHBondContact O-CB 3.25Å; K207-T219 PolarHBondContact N-O 2.96Å; K207-T219 PolarHBondContact O-N 3.44Å; K207-W221 HydrophobicContact CB-CH2 3.76Å; K207-W221 HydrophobicContact CB-CZ3 3.89Å
208	C	95.8	Very high	94.7	Very high	40 Å²	40	76.2 Å²	76.2	27%	0.27	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	137	175.9	-57.7	0	0	0	0	110.3	C215	C208-C215 HydrophobicContact CB-CB 3.86Å; C208-C215 WeakPolarHBondContact CB-SG 2.98Å; C208-C215 VanDerWaalsContact SG-CA 3.54Å; C208-C215 WeakPolarHBondContact SG-CB 3.43Å; C208-C215 CovalentContact SG-SG 2.03Å; C208-C215 PolarHBondContact SG-SG 3.37Å
209	H	93.9	Very high	94.6	Very high	101 Å²	101	77.6 Å²	77.6	47%	0.468	42%	0.424	S	S	.	.			trans	-143.1	20.5	-177.7	51.7	75	0	0	0	113.2	V217 T219	H209-V217 WeakPolarHBondContact CE1-CG1 3.06Å; H209-V217 PolarHBondContact N-O 2.93Å; H209-T219 PolarHBondContact NE2-OG1 3.26Å
210	G	92.8	Very high	94.5	Very high	14 Å²	14	74.5 Å²	74.5	14%	0.144	41%	0.407	C	S	.	.	S	Bend	trans	-67.7	174.5	169.4	0	0	0	0	0	112.9	S212 G213 S214	G210-S212 PolarHBondContact O-N 3.27Å; G210-G213 PolarHBondContact O-N 3.45Å; G210-S214 VanDerWaalsContact CA-O 3.27Å; G210-S214 WeakPolarHBondContact CA-O 3.5Å; G210-S214 WeakPolarHBondContact CA-OG 3.25Å; G210-S214 PolarHBondContact N-O 2.69Å; G210-S214 PolarHBondContact O-N 2.88Å
211	L	94.8	Very high	94.3	Very high	153 Å²	153	73.5 Å²	73.5	80%	0.801	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-51.2	129.5	-178.6	-166.6	84.7	0	0	0	110.4	G213 S214	L211-G213 PolarHBondContact O-N 2.83Å; L211-G213 VanDerWaalsContact O-N 3.11Å; L211-S214 PolarHBondContact N-OG 2.98Å; L211-S214 WeakPolarHBondContact O-CB 3.33Å; L211-S214 PolarHBondContact O-N 3.15Å; L211-S214 VanDerWaalsContact O-N 3.09Å; L211-S214 PolarHBondContact O-OG 3.06Å
212	S	92.3	Very high	94.2	Very high	131 Å²	131	75.5 Å²	75.5	92%	0.916	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	56	24.9	-178.1	-55	0	0	0	0	114.8	G210	G210-S212 PolarHBondContact O-N 3.27Å
213	G	90.7	Very high	94.3	Very high	51 Å²	51	73.9 Å²	73.9	53%	0.526	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	86.9	13.9	-179.1	0	0	0	0	0	114.7	G210 L211	G210-G213 PolarHBondContact O-N 3.45Å; L211-G213 PolarHBondContact O-N 2.83Å; L211-G213 VanDerWaalsContact O-N 3.11Å
214	S	94.3	Very high	94.4	Very high	35 Å²	35	70.4 Å²	70.4	25%	0.245	38%	0.381	C	S	.	.			trans	-62.5	152.2	176.1	78.6	0	0	0	0	112.3	G210 L211	G210-S214 VanDerWaalsContact CA-O 3.27Å; G210-S214 WeakPolarHBondContact CA-O 3.5Å; G210-S214 WeakPolarHBondContact CA-OG 3.25Å; G210-S214 PolarHBondContact N-O 2.69Å; G210-S214 PolarHBondContact O-N 2.88Å; L211-S214 PolarHBondContact N-OG 2.98Å; L211-S214 WeakPolarHBondContact O-CB 3.33Å; L211-S214 PolarHBondContact O-N 3.15Å; L211-S214 VanDerWaalsContact O-N 3.09Å; L211-S214 PolarHBondContact O-OG 3.06Å
215	C	94.9	Very high	94.6	Very high	76 Å²	76	67.6 Å²	67.6	51%	0.514	37%	0.367	S	S	.	.	S	Bend	trans	-95.4	13.6	179.8	-68.2	0	0	0	0	114	C208 V217	C208-C215 HydrophobicContact CB-CB 3.86Å; C208-C215 WeakPolarHBondContact CB-SG 2.98Å; C208-C215 VanDerWaalsContact SG-CA 3.54Å; C208-C215 WeakPolarHBondContact SG-CB 3.43Å; C208-C215 CovalentContact SG-SG 2.03Å; C208-C215 PolarHBondContact SG-SG 3.37Å; C215-V217 PolarHBondContact O-N 3.33Å
216	E	92.4	Very high	94.7	Very high	164 Å²	164	67.4 Å²	67.4	77%	0.766	38%	0.376	S	S	*	.	S	Bend	trans	-60.2	-33.2	173.7	-64.5	176.7	166.5	0	0	111.5
217	V	92.9	Very high	94.9	Very high	80 Å²	80	65.3 Å²	65.3	49%	0.485	36%	0.36	S	S	.	.	S	Bend	trans	-119.5	118	168.1	-162.3	0	0	0	0	108.1	H209 C215	H209-V217 WeakPolarHBondContact CE1-CG1 3.06Å; H209-V217 PolarHBondContact N-O 2.93Å; C215-V217 PolarHBondContact O-N 3.33Å
218	K	94.6	Very high	95	Very high	66 Å²	66	63.8 Å²	63.8	29%	0.287	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	150.2	175.7	70.5	-172.4	175.7	-177.3	0	111.4	G152 W153 K154 C206 K207	G152-K218 WeakPolarHBondContact O-CE 3.28Å; W153-K218 WeakPolarHBondContact CA-O 3.36Å; W153-K218 HydrophobicContact CB-CD 4.21Å; W153-K218 HydrophobicContact CB-CG 3.51Å; W153-K218 WeakPolarHBondContact CB-O 3.47Å; K154-K218 PolarHBondContact N-O 3.46Å; C206-K218 HydrophobicContact CB-CD 4.39Å; K207-K218 VanDerWaalsContact O-CA 3.28Å; K207-K218 WeakPolarHBondContact O-CA 3.26Å; K207-K218 WeakPolarHBondContact O-CB 3.25Å
219	T	94.1	Very high	95.1	Very high	32 Å²	32	65.7 Å²	65.7	20%	0.196	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	133.8	177.8	-63.1	0	0	0	0	109	K154 G156 C206 K207 H209	K154-T219 VanDerWaalsContact O-CA 3.26Å; K154-T219 WeakPolarHBondContact O-CA 3.5Å; G156-T219 VanDerWaalsContact C-CG2 3.49Å; C206-T219 CarbonylContact C-O 3.53Å; C206-T219 VanDerWaalsContact CA-O 3.28Å; C206-T219 WeakPolarHBondContact CA-O 3.47Å; K207-T219 PolarHBondContact N-O 2.96Å; K207-T219 PolarHBondContact O-N 3.44Å; H209-T219 PolarHBondContact NE2-OG1 3.26Å
220	C	94.9	Very high	95.3	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	154.2	-177.3	-45.9	0	0	0	0	112.6	W153 K154 G156 L204 R205 C206	W153-C220 HydrophobicContact CD2-CB 4.14Å; W153-C220 HydrophobicContact CE3-CB 3.52Å; W153-C220 HydrophobicContact CH2-CB 4.5Å; W153-C220 HydrophobicContact CZ3-CB 3.74Å; K154-C220 PolarHBondContact O-N 3.22Å; G156-C220 PolarHBondContact N-O 3.02Å; G156-C220 VanDerWaalsContact N-O 3.15Å; G156-C220 VanDerWaalsContact O-O 3.13Å; L204-C220 HydrophobicContact CD2-CB 4.11Å; R205-C220 CarbonylContact O-C 3.52Å; R205-C220 WeakPolarHBondContact O-CA 3.04Å; C206-C220 HydrophobicContact CB-CB 4.03Å; C206-C220 WeakPolarHBondContact CB-SG 3.3Å; C206-C220 WeakPolarHBondContact SG-CB 3.46Å; C206-C220 CovalentContact SG-SG 2.03Å; C206-C220 PolarHBondContact SG-SG 3.29Å
221	W	94.9	Very high	95.6	Very high	47 Å²	47	60.2 Å²	60.2	18%	0.178	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	161.9	175.6	55.6	98.9	0	0	0	110.4	G156 R205 K207	G156-W221 WeakPolarHBondContact O-CB 3.11Å; R205-W221 HydrophobicContact CG-CZ2 4.13Å; R205-W221 PolarHBondContact N-O 3.35Å; R205-W221 PolarHBondContact O-N 2.83Å; K207-W221 HydrophobicContact CB-CH2 3.76Å; K207-W221 HydrophobicContact CB-CZ3 3.89Å
222	W	95.4	Very high	95.8	Very high	82 Å²	82	56.2 Å²	56.2	31%	0.311	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	129.7	171	-73.4	115.7	0	0	0	110.2	W155 S159 E160 M202 H203 L204	W155-W222 AromaticContact CH2-CD1 3.88Å; W155-W222 AromaticContact CH2-NE1 3.4Å; W155-W222 AromaticContact CZ3-CD1 3.87Å; W155-W222 AromaticContact CZ3-NE1 3.89Å; S159-W222 WeakPolarHBondContact CA-O 3.43Å; S159-W222 PolarHBondContact OG-N 3.36Å; E160-W222 PolarHBondContact N-O 3.29Å; M202-W222 HydrophobicContact CB-CE3 4.19Å; M202-W222 HydrophobicContact CE-CB 4.06Å; H203-W222 VanDerWaalsContact C-CE3 3.46Å; L204-W222 HydrophobicContact CD2-CD2 4.41Å; L204-W222 HydrophobicContact CG-CE3 4.42Å; L204-W222 HydrophobicContact CG-CH2 4.27Å; L204-W222 HydrophobicContact CG-CZ2 4.45Å; L204-W222 HydrophobicContact CG-CZ3 4.27Å
223	A	96.6	Very high	96.1	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	148.9	-179.5	0	0	0	0	0	111.1	H203 R205	H203-A223 PolarHBondContact N-O 3.41Å; H203-A223 VanDerWaalsContact N-O 3.07Å; H203-A223 PolarHBondContact ND1-O 3.21Å; H203-A223 PolarHBondContact O-N 3.35Å; R205-A223 HydrophobicContact CB-CB 3.8Å
224	Q	97.6	Very high	96.5	Very high	5 Å²	5	50.4 Å²	50.4	2%	0.023	25%	0.249	C	C	.	.			trans	-73.8	148.2	167.9	-65.7	179.9	95.6	0	0	110.1	F125 T128 E160 M202	F125-Q224 VanDerWaalsContact CA-OE1 3.28Å; F125-Q224 HydrophobicContact CD2-CB 4.23Å; F125-Q224 HydrophobicContact CD2-CG 4.49Å; F125-Q224 HydrophobicContact CE2-CB 3.84Å; F125-Q224 PolarHBondContact O-NE2 3.25Å; T128-Q224 HydrophobicContact CG2-CG 4.25Å; E160-Q224 PolarHBondContact OE1-N 3.13Å; E160-Q224 WeakPolarHBondContact OE2-CB 3.41Å; E160-Q224 WeakPolarHBondContact OE2-CG 3.41Å; E160-Q224 PolarHBondContact OE2-N 2.92Å; E160-Q224 PolarHBondContact OE2-NE2 2.88Å; M202-Q224 HydrophobicContact CE-CG 4.21Å; M202-Q224 HydrophobicContact SD-CB 4.26Å; M202-Q224 HydrophobicContact SD-CG 3.46Å; M202-Q224 WeakPolarHBondContact SD-CG 3.35Å
225	P	97.5	Very high	96.7	Very high	11 Å²	11	49.4 Å²	49.4	7%	0.071	24%	0.241	C	C	.	.			trans	-72.1	178.9	170.8	34.7	-36.8	0	0	0	111.4	F125 H201 M229 L230	F125-P225 VanDerWaalsContact CE2-O 3.27Å; F125-P225 WeakPolarHBondContact CE2-O 3.37Å; H201-P225 HydrophobicContact CB-CG 4.09Å; H201-P225 WeakPolarHBondContact O-CD 3.3Å; P225-M229 HydrophobicContact CB-CE 3.3Å; P225-M229 HydrophobicContact CB-SD 4.13Å; P225-M229 HydrophobicContact CG-CE 3.62Å; P225-M229 HydrophobicContact CG-SD 4.02Å; P225-L230 HydrophobicContact CG-CD1 4.23Å; P225-L230 HydrophobicContact CG-CD2 3.6Å; P225-L230 HydrophobicContact CG-CG 3.9Å
226	D	97.8	Very high	96.8	Very high	133 Å²	133	51 Å²	51	71%	0.711	24%	0.244	S	C	*	.			trans	-65.3	137.9	167.4	-71.1	-30.8	0	0	0	110.1	R228 M229	D226-R228 PolarHBondContact O-N 3.38Å; D226-M229 PolarHBondContact O-N 3.39Å
227	F	98.4	Very high	97.1	Very high	12 Å²	12	45 Å²	45	5%	0.053	22%	0.215	C	C	.	.	H	α-helix	trans	-58.9	-25	-176.7	-166.1	-107.5	0	0	0	113.3	L75 E79 I118 A121 F125 M229 L230 G231	L75-F227 HydrophobicContact CD1-CB 4.45Å; L75-F227 HydrophobicContact CD1-CD1 3.83Å; L75-F227 HydrophobicContact CD1-CE1 4.4Å; L75-F227 HydrophobicContact CD1-CG 4.26Å; L75-F227 HydrophobicContact CD2-CB 4.26Å; L75-F227 HydrophobicContact CD2-CD1 3.98Å; L75-F227 HydrophobicContact CD2-CD2 4Å; L75-F227 HydrophobicContact CD2-CE1 4.31Å; L75-F227 HydrophobicContact CD2-CE2 4.36Å; L75-F227 HydrophobicContact CD2-CG 3.81Å; L75-F227 HydrophobicContact CD2-CZ 4.5Å; L75-F227 HydrophobicContact CG-CD1 3.6Å; L75-F227 HydrophobicContact CG-CD2 4.48Å; L75-F227 HydrophobicContact CG-CE1 3.78Å; L75-F227 HydrophobicContact CG-CG 3.97Å; L75-F227 HydrophobicContact CG-CZ 4.32Å; E79-F227 HydrophobicContact CB-CD1 3.83Å; E79-F227 HydrophobicContact CB-CE1 3.57Å; E79-F227 HydrophobicContact CG-CD1 3.99Å; E79-F227 HydrophobicContact CG-CE1 3.96Å; I118-F227 HydrophobicContact CD1-CE1 3.93Å; I118-F227 HydrophobicContact CD1-CZ 3.75Å; I118-F227 HydrophobicContact CG1-CE1 4.27Å; I118-F227 HydrophobicContact CG1-CZ 4.19Å; A121-F227 HydrophobicContact CB-CE2 4.39Å; F125-F227 HydrophobicContact CB-CD2 3.92Å; F125-F227 HydrophobicContact CB-CE2 3.98Å; F125-F227 HydrophobicContact CD1-CB 4.48Å; F125-F227 AromaticContact CD1-CD2 3.96Å; F125-F227 HydrophobicContact CD1-CD2 3.96Å; F125-F227 HydrophobicContact CD1-CG 4.5Å; F125-F227 AromaticContact CD2-CD2 3.81Å; F125-F227 HydrophobicContact CD2-CD2 3.81Å; F125-F227 HydrophobicContact CE1-CB 4.15Å; F125-F227 HydrophobicContact CE1-CD2 4.43Å; F125-F227 HydrophobicContact CE2-CB 4.27Å; F125-F227 HydrophobicContact CE2-CD2 4.3Å; F125-F227 AromaticContact CG-CD2 3.62Å; F125-F227 HydrophobicContact CG-CD2 3.62Å; F125-F227 HydrophobicContact CG-CE2 4.2Å; F125-F227 HydrophobicContact CZ-CB 4.03Å; F227-M229 VanDerWaalsContact C-N 3.33Å; F227-M229 PolarHBondContact O-N 3.28Å; F227-L230 HydrophobicContact CD2-CD1 4Å; F227-L230 HydrophobicContact CE2-CD1 4.46Å; F227-L230 PolarHBondContact O-N 2.97Å; F227-G231 PolarHBondContact O-N 2.88Å
228	R	98.4	Very high	97.3	Very high	107 Å²	107	42 Å²	42	40%	0.404	20%	0.195	S	C	.	.	H	α-helix	trans	-55.3	-45.9	172.6	178	53.2	52	78.8	1.6	112.3	E79 H82 D226 L230 G231 D232	E79-R228 VanDerWaalsContact CD-NE 3.28Å; E79-R228 VanDerWaalsContact OE1-CD 3.31Å; E79-R228 WeakPolarHBondContact OE1-CD 3.26Å; E79-R228 IonicContact OE1-CZ 2.69Å; E79-R228 IonicContact OE1-NE 3.09Å; E79-R228 PolarHBondContact OE1-NE 2.85Å; E79-R228 IonicContact OE2-CZ 2.93Å; E79-R228 IonicContact OE2-NE 3.95Å; E79-R228 PolarHBondContact OE2-NE 2.81Å; E79-R228 IonicContact OE2-NH2 2.74Å; E79-R228 PolarHBondContact OE2-NH2 3.06Å; E79-R228 VanDerWaalsContact OE2-NH2 3.13Å; H82-R228 PolarHBondContact CD2-NH2 2.95Å; H82-R228 PolarHBondContact CE1-NE 3.35Å; H82-R228 VanDerWaalsContact CE1-NE 3.29Å; H82-R228 PolarHBondContact CE1-NH1 2.94Å; H82-R228 VanDerWaalsContact CG-NH2 3.3Å; H82-R228 PolarHBondContact ND1-NE 2.66Å; H82-R228 PolarHBondContact ND1-NH2 2.76Å; H82-R228 VanDerWaalsContact NE2-CZ 3.31Å; H82-R228 PolarHBondContact NE2-NH1 3.35Å; D226-R228 PolarHBondContact O-N 3.38Å; R228-L230 VanDerWaalsContact C-N 3.28Å; R228-L230 PolarHBondContact O-N 2.94Å; R228-G231 WeakPolarHBondContact O-CA 3.14Å; R228-G231 PolarHBondContact O-N 3.47Å; R228-G231 VanDerWaalsContact O-N 3.12Å; R228-D232 VanDerWaalsContact O-CG 3.27Å; R228-D232 PolarHBondContact O-N 2.86Å
229	M	98.4	Very high	97.5	Very high	79 Å²	79	42.3 Å²	42.3	39%	0.389	20%	0.2	S	C	.	.	H	α-helix	trans	-64.3	-35.9	-179.1	176.5	-97.3	-100.7	0	0	111.6	H201 P225 D226 F227 D232 Y233	H201-M229 HydrophobicContact CB-CE 4.41Å; H201-M229 HydrophobicContact CB-SD 4.49Å; P225-M229 HydrophobicContact CB-CE 3.3Å; P225-M229 HydrophobicContact CB-SD 4.13Å; P225-M229 HydrophobicContact CG-CE 3.62Å; P225-M229 HydrophobicContact CG-SD 4.02Å; D226-M229 PolarHBondContact O-N 3.39Å; F227-M229 VanDerWaalsContact C-N 3.33Å; F227-M229 PolarHBondContact O-N 3.28Å; M229-D232 PolarHBondContact O-N 3.34Å; M229-Y233 PolarHBondContact O-N 3.23Å
230	L	98.4	Very high	97.6	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-69	-39.2	174.2	-53.4	177.1	0	0	0	111.5	F125 T197 I198 H201 P225 F227 R228 Y233 L234	F125-L230 HydrophobicContact CD2-CD1 3.95Å; F125-L230 HydrophobicContact CE2-CD1 4.37Å; T197-L230 HydrophobicContact CG2-CD2 4.07Å; I198-L230 HydrophobicContact CD1-CD1 3.54Å; H201-L230 HydrophobicContact CB-CD2 3.67Å; P225-L230 HydrophobicContact CG-CD1 4.23Å; P225-L230 HydrophobicContact CG-CD2 3.6Å; P225-L230 HydrophobicContact CG-CG 3.9Å; F227-L230 HydrophobicContact CD2-CD1 4Å; F227-L230 HydrophobicContact CE2-CD1 4.46Å; F227-L230 PolarHBondContact O-N 2.97Å; R228-L230 VanDerWaalsContact C-N 3.28Å; R228-L230 PolarHBondContact O-N 2.94Å; L230-Y233 PolarHBondContact O-N 3.36Å; L230-L234 WeakPolarHBondContact O-CB 3.48Å; L230-L234 WeakPolarHBondContact O-CG 3.37Å; L230-L234 PolarHBondContact O-N 3.27Å
231	G	98.4	Very high	97.7	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-59.3	-44.1	172.4	0	0	0	0	0	112.6	F227 R228 L234 K235	F227-G231 PolarHBondContact O-N 2.88Å; R228-G231 WeakPolarHBondContact O-CA 3.14Å; R228-G231 PolarHBondContact O-N 3.47Å; R228-G231 VanDerWaalsContact O-N 3.12Å; G231-L234 PolarHBondContact O-N 3.07Å; G231-K235 WeakPolarHBondContact O-CB 3.47Å; G231-K235 PolarHBondContact O-N 3.07Å
232	D	98.6	Very high	97.9	Very high	70 Å²	70	43.8 Å²	43.8	37%	0.374	22%	0.22	S	C	.	.	H	α-helix	trans	-62.9	-47.6	176.2	-63.7	-29.6	0	0	0	110.7	Q83 R228 M229 L234 K235 D236	Q83-D232 PolarHBondContact NE2-OD1 3.06Å; R228-D232 VanDerWaalsContact O-CG 3.27Å; R228-D232 PolarHBondContact O-N 2.86Å; M229-D232 PolarHBondContact O-N 3.34Å; D232-L234 PolarHBondContact O-N 3.06Å; D232-K235 WeakPolarHBondContact O-CB 3.12Å; D232-K235 PolarHBondContact O-N 2.69Å; D232-K235 VanDerWaalsContact O-N 3.08Å; D232-D236 PolarHBondContact O-N 2.85Å
233	Y	98.6	Very high	98	Very high	59 Å²	59	42 Å²	42	23%	0.231	22%	0.215	C	C	.	.	H	α-helix	trans	-59.8	-46.9	176.8	177	-93.5	0	0	0	112.6	T197 H201 M229 L230 K235 D236 K237	T197-Y233 HydrophobicContact CG2-CD1 3.47Å; T197-Y233 VanDerWaalsContact CG2-CD1 3.47Å; T197-Y233 HydrophobicContact CG2-CE1 3.86Å; T197-Y233 HydrophobicContact CG2-CG 4.36Å; T197-Y233 WeakPolarHBondContact OG1-CE1 3.3Å; H201-Y233 AromaticContact CE1-CD1 3.89Å; H201-Y233 AromaticContact CE1-CD2 3.8Å; H201-Y233 AromaticContact CE1-CE1 3.97Å; H201-Y233 AromaticContact CE1-CE2 3.9Å; H201-Y233 AromaticContact CE1-CG 3.79Å; H201-Y233 AromaticContact CE1-CZ 3.97Å; H201-Y233 AromaticContact NE2-CD2 3.72Å; H201-Y233 AromaticContact NE2-CG 3.94Å; M229-Y233 PolarHBondContact O-N 3.23Å; L230-Y233 PolarHBondContact O-N 3.36Å; Y233-K235 PolarHBondContact O-N 2.81Å; Y233-D236 WeakPolarHBondContact O-CB 3.5Å; Y233-D236 PolarHBondContact O-N 3.43Å; Y233-K237 HydrophobicContact CD1-CG 4.34Å; Y233-K237 HydrophobicContact CE1-CG 3.94Å; Y233-K237 PolarHBondContact O-N 3.34Å; Y233-K237 VanDerWaalsContact O-N 3.08Å; Y233-K237 WeakPolarHBondContact OH-CE 3.28Å
234	L	98.6	Very high	98.1	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-66	-28.5	177	-71.9	171.8	0	0	0	111.5	F114 A117 I118 A121 T197 L230 G231 D232 K237 Y238 M274	F114-L234 HydrophobicContact CD2-CB 4.35Å; F114-L234 WeakPolarHBondContact CD2-O 3.45Å; F114-L234 HydrophobicContact CE2-CB 3.8Å; A117-L234 HydrophobicContact CB-CD2 4.29Å; I118-L234 HydrophobicContact CB-CD1 4.39Å; I118-L234 HydrophobicContact CD1-CD1 3.55Å; A121-L234 HydrophobicContact CB-CD1 4.04Å; T197-L234 HydrophobicContact CG2-CD2 4.42Å; T197-L234 HydrophobicContact CG2-CG 4.32Å; L230-L234 WeakPolarHBondContact O-CB 3.48Å; L230-L234 WeakPolarHBondContact O-CG 3.37Å; L230-L234 PolarHBondContact O-N 3.27Å; G231-L234 PolarHBondContact O-N 3.07Å; D232-L234 PolarHBondContact O-N 3.06Å; L234-K237 PolarHBondContact O-N 3.15Å; L234-Y238 PolarHBondContact O-N 3.33Å; L234-M274 HydrophobicContact CB-CE 3.86Å; L234-M274 HydrophobicContact CD2-CE 3.63Å; L234-M274 HydrophobicContact CG-CE 4.32Å; L234-M274 VanDerWaalsContact O-CE 3.3Å; L234-M274 WeakPolarHBondContact O-CE 3.4Å
235	K	98.3	Very high	98.1	Very high	15 Å²	15	45.1 Å²	45.1	7%	0.065	23%	0.233	C	C	.	.	H	α-helix	trans	-71.3	-33	177.8	176.7	62.1	-158.6	61	0	111.6	Q83 F84 F114 G231 D232 Y233 Y238 D239	Q83-K235 HydrophobicContact CB-CD 4.23Å; Q83-K235 HydrophobicContact CB-CG 4.42Å; Q83-K235 HydrophobicContact CG-CB 4.26Å; F84-K235 HydrophobicContact CE2-CD 3.96Å; F84-K235 HydrophobicContact CZ-CD 4.02Å; F114-K235 HydrophobicContact CE2-CB 4.16Å; G231-K235 WeakPolarHBondContact O-CB 3.47Å; G231-K235 PolarHBondContact O-N 3.07Å; D232-K235 WeakPolarHBondContact O-CB 3.12Å; D232-K235 PolarHBondContact O-N 2.69Å; D232-K235 VanDerWaalsContact O-N 3.08Å; Y233-K235 PolarHBondContact O-N 2.81Å; K235-Y238 HydrophobicContact CD-CD1 4.29Å; K235-Y238 WeakPolarHBondContact O-CB 3.33Å; K235-Y238 PolarHBondContact O-N 3.26Å; K235-D239 IonicContact NZ-OD1 3.46Å; K235-D239 PolarHBondContact NZ-OD1 3.45Å; K235-D239 IonicContact NZ-OD2 2.74Å; K235-D239 PolarHBondContact NZ-OD2 2.82Å; K235-D239 PolarHBondContact O-N 3.1Å
236	D	98.2	Very high	98.1	Very high	108 Å²	108	46.9 Å²	46.9	58%	0.578	24%	0.244	S	C	*	.	H	α-helix	trans	-66.6	-44	169	-70.2	-18.2	0	0	0	111	D232 Y233 Y238 D239 S240	D232-D236 PolarHBondContact O-N 2.85Å; Y233-D236 WeakPolarHBondContact O-CB 3.5Å; Y233-D236 PolarHBondContact O-N 3.43Å; D236-Y238 VanDerWaalsContact C-N 3.26Å; D236-Y238 PolarHBondContact O-N 2.93Å; D236-D239 PolarHBondContact O-N 3.1Å; D236-S240 PolarHBondContact O-N 2.74Å; D236-S240 VanDerWaalsContact O-N 3.12Å; D236-S240 PolarHBondContact O-OG 3.45Å
237	K	98.4	Very high	98	Very high	38 Å²	38	44.3 Å²	44.3	17%	0.165	23%	0.227	C	C	.	.	H	α-helix	trans	-61	-33.5	174.6	-68.9	-59	-169.1	175.9	0	113.3	Y233 L234 S240 A241 R272 D273 M274	Y233-K237 HydrophobicContact CD1-CG 4.34Å; Y233-K237 HydrophobicContact CE1-CG 3.94Å; Y233-K237 PolarHBondContact O-N 3.34Å; Y233-K237 VanDerWaalsContact O-N 3.08Å; Y233-K237 WeakPolarHBondContact OH-CE 3.28Å; L234-K237 PolarHBondContact O-N 3.15Å; K237-S240 CarbonylContact O-C 3.49Å; K237-S240 PolarHBondContact O-N 3.32Å; K237-S240 PolarHBondContact O-OG 2.7Å; K237-A241 WeakPolarHBondContact O-CA 3.45Å; K237-A241 PolarHBondContact O-N 3.01Å; K237-R272 WeakPolarHBondContact CD-O 2.98Å; K237-R272 VanDerWaalsContact CE-O 3.28Å; K237-R272 WeakPolarHBondContact CE-O 3.35Å; K237-D273 IonicContact NZ-OD1 3.57Å; K237-D273 PolarHBondContact NZ-OD1 3.26Å; K237-M274 HydrophobicContact CB-CE 4.07Å; K237-M274 HydrophobicContact CB-CG 4.28Å; K237-M274 HydrophobicContact CB-SD 4.47Å
238	Y	98.1	Very high	97.9	Very high	17 Å²	17	50.2 Å²	50.2	7%	0.067	25%	0.253	C	S	.	.	H	α-helix	trans	-63.8	-43.5	170.8	163.1	-84.4	0	0	0	111.8	F84 R110 E111 F114 L234 K235 D236 S240 A241	F84-Y238 HydrophobicContact CE1-CD1 4.35Å; F84-Y238 HydrophobicContact CE1-CD2 4.48Å; F84-Y238 AromaticContact CE1-CE1 3.81Å; F84-Y238 HydrophobicContact CE1-CE1 3.81Å; F84-Y238 AromaticContact CE1-CE2 3.93Å; F84-Y238 HydrophobicContact CE1-CE2 3.93Å; F84-Y238 AromaticContact CE1-CZ 3.58Å; F84-Y238 AromaticContact CZ-CD1 3.94Å; F84-Y238 HydrophobicContact CZ-CD1 3.94Å; F84-Y238 AromaticContact CZ-CD2 3.84Å; F84-Y238 HydrophobicContact CZ-CD2 3.84Å; F84-Y238 AromaticContact CZ-CE1 3.86Å; F84-Y238 HydrophobicContact CZ-CE1 3.86Å; F84-Y238 AromaticContact CZ-CE2 3.73Å; F84-Y238 HydrophobicContact CZ-CE2 3.73Å; F84-Y238 AromaticContact CZ-CG 3.94Å; F84-Y238 HydrophobicContact CZ-CG 3.94Å; F84-Y238 AromaticContact CZ-CZ 3.76Å; R110-Y238 HydrophobicContact CB-CD2 4.44Å; R110-Y238 HydrophobicContact CB-CE2 3.91Å; R110-Y238 VanDerWaalsContact CD-O 3.31Å; R110-Y238 WeakPolarHBondContact CD-O 3.16Å; R110-Y238 HydrophobicContact CG-CD2 3.58Å; R110-Y238 HydrophobicContact CG-CE2 3.43Å; R110-Y238 VanDerWaalsContact CG-CE2 3.43Å; R110-Y238 HydrophobicContact CG-CG 4.35Å; R110-Y238 PolarHBondContact NH1-O 3.22Å; R110-Y238 WeakPolarHBondContact O-CD2 3.29Å; E111-Y238 HydrophobicContact CG-CE2 4.3Å; E111-Y238 PolarHBondContact OE1-OH 3.43Å; F114-Y238 HydrophobicContact CB-CD2 3.75Å; F114-Y238 HydrophobicContact CB-CG 4.36Å; F114-Y238 HydrophobicContact CD2-CG 4.43Å; F114-Y238 HydrophobicContact CG-CD2 4.41Å; L234-Y238 PolarHBondContact O-N 3.33Å; K235-Y238 HydrophobicContact CD-CD1 4.29Å; K235-Y238 WeakPolarHBondContact O-CB 3.33Å; K235-Y238 PolarHBondContact O-N 3.26Å; D236-Y238 VanDerWaalsContact C-N 3.26Å; D236-Y238 PolarHBondContact O-N 2.93Å; Y238-S240 PolarHBondContact O-N 3.5Å; Y238-A241 WeakPolarHBondContact O-CB 3.5Å; Y238-A241 PolarHBondContact O-N 2.03Å
239	D	97	Very high	97.7	Very high	73 Å²	73	48.5 Å²	48.5	39%	0.39	25%	0.249	S	C	.	.	H	α-helix	trans	-65.2	-32.7	-179.4	-73.7	-26	0	0	0	111.4	R87 R110 K235 D236	R87-D239 IonicContact NH2-OD1 2.98Å; R110-D239 PolarHBondContact NH1-O 3.14Å; K235-D239 IonicContact NZ-OD1 3.46Å; K235-D239 PolarHBondContact NZ-OD1 3.45Å; K235-D239 IonicContact NZ-OD2 2.74Å; K235-D239 PolarHBondContact NZ-OD2 2.82Å; K235-D239 PolarHBondContact O-N 3.1Å; D236-D239 PolarHBondContact O-N 3.1Å
240	S	97.1	Very high	97.5	Very high	71 Å²	71	54.2 Å²	54.2	50%	0.497	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	15.7	176.2	72.3	0	0	0	0	115.1	D236 K237 Y238	D236-S240 PolarHBondContact O-N 2.74Å; D236-S240 VanDerWaalsContact O-N 3.12Å; D236-S240 PolarHBondContact O-OG 3.45Å; K237-S240 CarbonylContact O-C 3.49Å; K237-S240 PolarHBondContact O-N 3.32Å; K237-S240 PolarHBondContact O-OG 2.7Å; Y238-S240 PolarHBondContact O-N 3.5Å
241	A	98	Very high	97.2	Very high	9 Å²	9	58.7 Å²	58.7	7%	0.074	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-61	140.7	-176.1	0	0	0	0	0	112.1	R110 K237 Y238 M274 Y276	R110-A241 HydrophobicContact CG-CB 3.89Å; K237-A241 WeakPolarHBondContact O-CA 3.45Å; K237-A241 PolarHBondContact O-N 3.01Å; Y238-A241 WeakPolarHBondContact O-CB 3.5Å; Y238-A241 PolarHBondContact O-N 2.03Å; A241-M274 CarbonylContact C-O 3.56Å; A241-M274 WeakPolarHBondContact CA-O 3.27Å; A241-M274 HydrophobicContact CB-CB 3.88Å; A241-Y276 HydrophobicContact CB-CD1 3.93Å; A241-Y276 HydrophobicContact CB-CE1 4.07Å
242	S	98.1	Very high	96.9	Very high	30 Å²	30	64.7 Å²	64.7	21%	0.21	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	129.1	-176.4	-68	0	0	0	0	112.1	M274 V275 Y276	S242-M274 PolarHBondContact N-O 3.06Å; S242-V275 WeakPolarHBondContact O-CA 3.41Å; S242-Y276 PolarHBondContact O-N 3.48Å; S242-Y276 VanDerWaalsContact O-N 3.07Å
243	E	98	Very high	96.4	Very high	44 Å²	44	72.9 Å²	72.9	21%	0.206	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	129.8	172.2	-165.3	-176.7	178.5	0	0	110.3	K262 Y263 Y276	E243-K262 HydrophobicContact CB-CB 4.49Å; E243-K262 HydrophobicContact CB-CD 4.35Å; E243-K262 HydrophobicContact CG-CD 3.84Å; E243-K262 WeakPolarHBondContact O-CB 3.32Å; E243-K262 PolarHBondContact O-N 3.24Å; E243-K262 IonicContact OE1-NZ 3.71Å; E243-K262 PolarHBondContact OE1-NZ 3.26Å; E243-K262 WeakPolarHBondContact OE2-CD 3.36Å; E243-K262 IonicContact OE2-NZ 2.67Å; E243-K262 PolarHBondContact OE2-NZ 3.4Å; E243-Y263 HydrophobicContact CB-CE2 4.36Å; E243-Y263 PolarHBondContact OE2-OH 2.93Å; E243-Y276 CarbonylContact C-O 3.56Å; E243-Y276 WeakPolarHBondContact CA-O 3.46Å; E243-Y276 HydrophobicContact CB-CE1 4.22Å; E243-Y276 HydrophobicContact CB-CE2 4.17Å; E243-Y276 HydrophobicContact CG-CD2 4.49Å; E243-Y276 HydrophobicContact CG-CE2 3.89Å
244	M	98.1	Very high	96.2	Very high	17 Å²	17	71.5 Å²	71.5	8%	0.084	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	162.5	-176.9	-50.3	-61.1	-82.1	0	0	111.2	L259 R260 A261 P269 V275 Y276 Y277	M244-L259 HydrophobicContact CB-CB 4.09Å; M244-L259 HydrophobicContact CB-CD2 4.35Å; M244-L259 HydrophobicContact CE-CB 3.89Å; M244-L259 HydrophobicContact CG-CB 4.29Å; M244-R260 CarbonylContact C-O 3.59Å; M244-R260 VanDerWaalsContact CA-O 3.27Å; M244-R260 WeakPolarHBondContact CA-O 3.26Å; M244-R260 VanDerWaalsContact CE-C 3.5Å; M244-A261 HydrophobicContact SD-CB 4.23Å; M244-P269 HydrophobicContact CE-CG 4.15Å; M244-P269 HydrophobicContact SD-CG 4.04Å; M244-V275 HydrophobicContact CE-CG1 4.4Å; M244-V275 HydrophobicContact CG-CB 3.72Å; M244-V275 HydrophobicContact CG-CG1 4.1Å; M244-V275 HydrophobicContact SD-CB 4.25Å; M244-V275 HydrophobicContact SD-CG1 3.95Å; M244-Y276 PolarHBondContact N-O 3.38Å; M244-Y277 WeakPolarHBondContact O-CB 3.45Å
245	V	97.6	Very high	95.9	Very high	55 Å²	55	80 Å²	80	33%	0.333	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	139.7	171	179.2	0	0	0	0	107.9	R260 K262	V245-R260 PolarHBondContact N-O 3.27Å; V245-R260 PolarHBondContact O-N 2.95Å; V245-K262 HydrophobicContact CG2-CB 3.76Å; V245-K262 HydrophobicContact CG2-CD 4.4Å; V245-K262 HydrophobicContact CG2-CG 3.74Å
246	V	97.8	Very high	95.7	Very high	48 Å²	48	80.4 Å²	80.4	29%	0.291	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	123.3	176.6	-178.3	0	0	0	0	109.5	A182 E257 T258 L259 Y277	A182-V246 HydrophobicContact CB-CB 4.3Å; A182-V246 HydrophobicContact CB-CG1 3.72Å; A182-V246 HydrophobicContact CB-CG2 3.59Å; V246-E257 HydrophobicContact CG1-CB 4.02Å; V246-E257 HydrophobicContact CG1-CG 4.39Å; V246-T258 WeakPolarHBondContact CA-O 3.47Å; V246-L259 HydrophobicContact CG2-CD2 4.11Å; V246-Y277 HydrophobicContact CG2-CD1 4.42Å; V246-Y277 HydrophobicContact CG2-CD2 3.76Å; V246-Y277 HydrophobicContact CG2-CE2 4.06Å; V246-Y277 HydrophobicContact CG2-CG 3.97Å
247	E	96.3	Very high	95.6	Very high	78 Å²	78	77.5 Å²	77.5	36%	0.364	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	142.6	171.5	-64.3	-170.9	157.4	0	0	109.4	E257 T258 R260	E247-E257 CarbonylContact O-C 3.53Å; E247-E257 VanDerWaalsContact O-CA 3.25Å; E247-E257 WeakPolarHBondContact O-CA 3.03Å; E247-T258 PolarHBondContact N-O 3.36Å; E247-T258 PolarHBondContact O-N 3.48Å; E247-R260 HydrophobicContact CG-CB 4.37Å; E247-R260 WeakPolarHBondContact OE1-CD 3.45Å; E247-R260 IonicContact OE1-CZ 3.89Å; E247-R260 IonicContact OE1-NE 3.46Å; E247-R260 PolarHBondContact OE1-NE 3.48Å; E247-R260 IonicContact OE1-NH2 2.64Å; E247-R260 IonicContact OE2-NE 3.89Å
248	K	95.4	Very high	95.5	Very high	137 Å²	137	78.2 Å²	78.2	60%	0.596	39%	0.385	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.4	125.8	178.5	-50	-158.5	-170.7	-160.2	0	109.6	V256 E257	K248-V256 WeakPolarHBondContact CA-O 3.34Å; K248-E257 HydrophobicContact CD-CG 4.07Å; K248-E257 WeakPolarHBondContact CE-OE1 3.45Å; K248-E257 HydrophobicContact CG-CG 4.03Å; K248-E257 IonicContact NZ-OE1 3.27Å; K248-E257 PolarHBondContact NZ-OE1 3.38Å
249	H	94.2	Very high	95.5	Very high	70 Å²	70	79.1 Å²	79.1	32%	0.324	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	163.1	173.2	64.9	-82.9	0	0	0	110.5	E251 V256	H249-E251 IonicContact CD2-OE1 3.93Å; H249-E251 IonicContact CE1-OE1 2.69Å; H249-E251 IonicContact NE2-OE1 3.63Å; H249-E251 PolarHBondContact NE2-OE1 3.09Å; H249-V256 PolarHBondContact N-O 2.95Å; H249-V256 PolarHBondContact O-N 3.37Å
250	R	93.6	Very high	95.4	Very high	199 Å²	199	80.6 Å²	80.6	75%	0.751	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.9	122.1	-176.2	-176.3	174.1	161.1	-179	-5.7	109.7	W255	R250-W255 HydrophobicContact CB-CE3 4.31Å; R250-W255 HydrophobicContact CB-CZ3 4.34Å
251	E	92.8	Very high	95.4	Very high	95 Å²	95	77.7 Å²	77.7	44%	0.444	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	175.8	172.5	-64.5	-173.5	-169.2	0	0	110.8	H249 R253 G254 V256	H249-E251 IonicContact CD2-OE1 3.93Å; H249-E251 IonicContact CE1-OE1 2.69Å; H249-E251 IonicContact NE2-OE1 3.63Å; H249-E251 PolarHBondContact NE2-OE1 3.09Å; E251-R253 PolarHBondContact O-N 2.8Å; E251-G254 PolarHBondContact N-O 3.43Å; E251-G254 PolarHBondContact O-N 3.08Å; E251-G254 VanDerWaalsContact O-N 3.15Å; E251-V256 HydrophobicContact CB-CG2 4.07Å; E251-V256 HydrophobicContact CG-CB 4.4Å; E251-V256 HydrophobicContact CG-CG2 3.84Å
252	S	92.4	Very high	95.3	Very high	126 Å²	126	81.1 Å²	81.1	88%	0.881	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-29.7	178.5	57	0	0	0	0	113.2
253	R	88.5	Confident	95.2	Very high	242 Å²	242	85.4 Å²	85.4	91%	0.913	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-1.8	-179.5	-64.3	-176.5	178.6	175.5	1	114.2	E251	E251-R253 PolarHBondContact O-N 2.8Å
254	G	92.9	Very high	94.9	Very high	29 Å²	29	86.2 Å²	86.2	30%	0.299	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	130.2	-162.3	179.3	0	0	0	0	0	113.8	E251	E251-G254 PolarHBondContact N-O 3.43Å; E251-G254 PolarHBondContact O-N 3.08Å; E251-G254 VanDerWaalsContact O-N 3.15Å
255	W	93.1	Very high	94.6	Very high	179 Å²	179	95.3 Å²	95.3	68%	0.678	45%	0.451	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.8	134.3	174.5	-67.9	98.3	0	0	0	110.5	R250	R250-W255 HydrophobicContact CB-CE3 4.31Å; R250-W255 HydrophobicContact CB-CZ3 4.34Å
256	V	95.2	Very high	94.4	Very high	24 Å²	24	99.9 Å²	99.9	15%	0.145	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	136.3	176.6	-177.4	0	0	0	0	108.6	P180 K248 H249 E251	P180-V256 HydrophobicContact CB-CB 4.36Å; P180-V256 HydrophobicContact CB-CG1 4.16Å; P180-V256 HydrophobicContact CB-CG2 4.02Å; K248-V256 WeakPolarHBondContact CA-O 3.34Å; H249-V256 PolarHBondContact N-O 2.95Å; H249-V256 PolarHBondContact O-N 3.37Å; E251-V256 HydrophobicContact CB-CG2 4.07Å; E251-V256 HydrophobicContact CG-CB 4.4Å; E251-V256 HydrophobicContact CG-CG2 3.84Å
257	E	96.2	Very high	94.3	Very high	47 Å²	47	107.2 Å²	107.2	22%	0.22	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	129.9	173.7	-54.9	-174.4	154.1	0	0	110	P180 A182 V246 E247 K248	P180-E257 PolarHBondContact O-N 3.16Å; A182-E257 HydrophobicContact CB-CB 4.07Å; A182-E257 WeakPolarHBondContact CB-OE2 3.45Å; A182-E257 PolarHBondContact N-OE2 3.03Å; V246-E257 HydrophobicContact CG1-CB 4.02Å; V246-E257 HydrophobicContact CG1-CG 4.39Å; E247-E257 CarbonylContact O-C 3.53Å; E247-E257 VanDerWaalsContact O-CA 3.25Å; E247-E257 WeakPolarHBondContact O-CA 3.03Å; K248-E257 HydrophobicContact CD-CG 4.07Å; K248-E257 WeakPolarHBondContact CE-OE1 3.45Å; K248-E257 HydrophobicContact CG-CG 4.03Å; K248-E257 IonicContact NZ-OE1 3.27Å; K248-E257 PolarHBondContact NZ-OE1 3.38Å
258	T	95.6	Very high	94.2	Very high	53 Å²	53	109.4 Å²	109.4	33%	0.325	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	161.8	175.8	51.3	0	0	0	0	111.3	V246 E247	V246-T258 WeakPolarHBondContact CA-O 3.47Å; E247-T258 PolarHBondContact N-O 3.36Å; E247-T258 PolarHBondContact O-N 3.48Å
259	L	97	Very high	94.3	Very high	36 Å²	36	104.2 Å²	104.2	19%	0.188	49%	0.485	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	122.8	-179.5	-60.7	179.1	0	0	0	109.4	A182 A185 M186 M244 V246 V275 Y277	A182-L259 HydrophobicContact CB-CD2 4.05Å; A185-L259 HydrophobicContact CB-CD1 4.21Å; A185-L259 HydrophobicContact CB-CG 4.25Å; M186-L259 HydrophobicContact CB-CD1 3.79Å; M186-L259 HydrophobicContact CG-CD1 4.4Å; M244-L259 HydrophobicContact CB-CB 4.09Å; M244-L259 HydrophobicContact CB-CD2 4.35Å; M244-L259 HydrophobicContact CE-CB 3.89Å; M244-L259 HydrophobicContact CG-CB 4.29Å; V246-L259 HydrophobicContact CG2-CD2 4.11Å; L259-V275 HydrophobicContact CD1-CG2 4.32Å; L259-Y277 HydrophobicContact CD2-CD1 3.73Å; L259-Y277 HydrophobicContact CD2-CE1 4.28Å; L259-Y277 HydrophobicContact CD2-CG 4.33Å
260	R	96.1	Very high	94.4	Very high	103 Å²	103	104.2 Å²	104.2	39%	0.389	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	140.7	171.7	-171.4	-179.4	62.5	73.9	1.5	110.1	M244 V245 E247 K262	M244-R260 CarbonylContact C-O 3.59Å; M244-R260 VanDerWaalsContact CA-O 3.27Å; M244-R260 WeakPolarHBondContact CA-O 3.26Å; M244-R260 VanDerWaalsContact CE-C 3.5Å; V245-R260 PolarHBondContact N-O 3.27Å; V245-R260 PolarHBondContact O-N 2.95Å; E247-R260 HydrophobicContact CG-CB 4.37Å; E247-R260 WeakPolarHBondContact OE1-CD 3.45Å; E247-R260 IonicContact OE1-CZ 3.89Å; E247-R260 IonicContact OE1-NE 3.46Å; E247-R260 PolarHBondContact OE1-NE 3.48Å; E247-R260 IonicContact OE1-NH2 2.64Å; E247-R260 IonicContact OE2-NE 3.89Å; R260-K262 PolarHBondContact O-N 3.47Å
261	A	96.9	Very high	94.6	Very high	10 Å²	10	100.7 Å²	100.7	8%	0.083	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	128.2	175.4	0	0	0	0	0	110.9	M244 Y263	M244-A261 HydrophobicContact SD-CB 4.23Å; A261-Y263 VanDerWaalsContact C-N 3.33Å; A261-Y263 PolarHBondContact O-N 3.12Å
262	K	96.3	Very high	94.8	Very high	82 Å²	82	100.9 Å²	100.9	36%	0.357	48%	0.479	S	S	.	.	S	Bend	trans	-63.3	-40.9	-177.4	-175.8	175.1	177.2	-176	0	112	E243 V245 R260	E243-K262 HydrophobicContact CB-CB 4.49Å; E243-K262 HydrophobicContact CB-CD 4.35Å; E243-K262 HydrophobicContact CG-CD 3.84Å; E243-K262 WeakPolarHBondContact O-CB 3.32Å; E243-K262 PolarHBondContact O-N 3.24Å; E243-K262 IonicContact OE1-NZ 3.71Å; E243-K262 PolarHBondContact OE1-NZ 3.26Å; E243-K262 WeakPolarHBondContact OE2-CD 3.36Å; E243-K262 IonicContact OE2-NZ 2.67Å; E243-K262 PolarHBondContact OE2-NZ 3.4Å; V245-K262 HydrophobicContact CG2-CB 3.76Å; V245-K262 HydrophobicContact CG2-CD 4.4Å; V245-K262 HydrophobicContact CG2-CG 3.74Å; R260-K262 PolarHBondContact O-N 3.47Å
263	Y	95	Very high	95	Very high	119 Å²	119	96.1 Å²	96.1	47%	0.467	44%	0.443	S	S	.	.			trans	-109.9	99	-175.8	-53.3	-76.1	0	0	0	110.8	E243 A261 F265 F266	E243-Y263 HydrophobicContact CB-CE2 4.36Å; E243-Y263 PolarHBondContact OE2-OH 2.93Å; A261-Y263 VanDerWaalsContact C-N 3.33Å; A261-Y263 PolarHBondContact O-N 3.12Å; Y263-F265 VanDerWaalsContact C-N 3.26Å; Y263-F265 PolarHBondContact O-N 2.93Å; Y263-F266 HydrophobicContact CG-CD2 4.33Å; Y263-F266 HydrophobicContact CG-CE2 4.41Å; Y263-F266 PolarHBondContact O-N 3.02Å
264	A	91.4	Very high	95.5	Very high	62 Å²	62	84.7 Å²	84.7	51%	0.512	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-15.9	-174.8	0	0	0	0	0	114.9	F266	A264-F266 VanDerWaalsContact C-N 3.32Å
265	F	93.2	Very high	95.8	Very high	208 Å²	208	83.4 Å²	83.4	91%	0.912	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-14.2	179.5	-60.4	-71.8	0	0	0	113.6	Y263	Y263-F265 VanDerWaalsContact C-N 3.26Å; Y263-F265 PolarHBondContact O-N 2.93Å
266	F	93.6	Very high	96	Very high	150 Å²	150	76 Å²	76	66%	0.658	36%	0.359	S	S	*	.	S	Bend	trans	-94.2	164.6	175	-63.2	-76.4	0	0	0	110.9	Y263 A264 H268	Y263-F266 HydrophobicContact CG-CD2 4.33Å; Y263-F266 HydrophobicContact CG-CE2 4.41Å; Y263-F266 PolarHBondContact O-N 3.02Å; A264-F266 VanDerWaalsContact C-N 3.32Å; F266-H268 PolarHBondContact O-N 2.93Å
267	K	93.7	Very high	96.1	Very high	202 Å²	202	77.5 Å²	77.5	88%	0.878	36%	0.362	S	S	*	.	P	Polyproline II helix	trans	-59.1	134.8	174.4	-66.7	-176.5	179.9	-179.2	0	109.8
268	H	95	Very high	96.1	Very high	125 Å²	125	78.8 Å²	78.8	58%	0.579	37%	0.368	S	S	*	.	P	Polyproline II helix	trans	-64.4	143.6	174.2	-73.7	-84	0	0	0	110.8	F266 T270	F266-H268 PolarHBondContact O-N 2.93Å; H268-T270 PolarHBondContact O-N 2.75Å
269	P	97.1	Very high	96	Very high	28 Å²	28	79 Å²	79	18%	0.182	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-63.6	136.3	176.2	26.1	-33.1	0	0	0	110.5	M244 D273 V275	M244-P269 HydrophobicContact CE-CG 4.15Å; M244-P269 HydrophobicContact SD-CG 4.04Å; P269-D273 HydrophobicContact CB-CB 4Å; P269-V275 HydrophobicContact CB-CG1 3.87Å; P269-V275 HydrophobicContact CG-CG1 3.88Å
270	T	97.5	Very high	95.7	Very high	69 Å²	69	79.7 Å²	79.7	42%	0.423	39%	0.389	S	S	.	.			trans	-87.6	174.4	171.4	67.9	0	0	0	0	110.5	H189 H268 R272 D273	H189-T270 PolarHBondContact CE1-O 2.9Å; H189-T270 VanDerWaalsContact CE1-O 3.29Å; H189-T270 PolarHBondContact NE2-O 3.41Å; H268-T270 PolarHBondContact O-N 2.75Å; T270-R272 PolarHBondContact O-N 2.74Å; T270-R272 VanDerWaalsContact O-N 3.08Å; T270-R272 PolarHBondContact OG1-N 3.13Å; T270-D273 WeakPolarHBondContact CB-OD2 3.44Å; T270-D273 PolarHBondContact N-OD2 3.18Å; T270-D273 PolarHBondContact O-N 2.8Å; T270-D273 PolarHBondContact OG1-OD2 2.96Å
271	E	96.3	Very high	95.5	Very high	126 Å²	126	76.2 Å²	76.2	59%	0.589	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-14.2	173.2	-62.2	177.4	167.5	0	0	113.7	A193	A193-E271 WeakPolarHBondContact CA-O 3.3Å; A193-E271 VanDerWaalsContact CB-O 3.3Å; A193-E271 WeakPolarHBondContact CB-O 3.16Å; A193-E271 PolarHBondContact N-O 3.01Å
272	R	97.4	Very high	95.2	Very high	99 Å²	99	81 Å²	81	37%	0.374	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-4.9	178.4	-63.4	171.2	174.7	79.4	5.9	113.2	T196 D200 K237 T270	T196-R272 HydrophobicContact CG2-CG 4.07Å; D200-R272 IonicContact OD1-CZ 3.8Å; D200-R272 IonicContact OD1-NE 3.56Å; D200-R272 IonicContact OD1-NH2 3.1Å; D200-R272 PolarHBondContact OD1-NH2 2.7Å; D200-R272 VanDerWaalsContact OD1-NH2 3.1Å; D200-R272 WeakPolarHBondContact OD2-CD 3.48Å; D200-R272 IonicContact OD2-CZ 2.7Å; D200-R272 IonicContact OD2-NE 3.46Å; D200-R272 PolarHBondContact OD2-NE 2.8Å; D200-R272 IonicContact OD2-NH2 2.93Å; K237-R272 WeakPolarHBondContact CD-O 2.98Å; K237-R272 VanDerWaalsContact CE-O 3.28Å; K237-R272 WeakPolarHBondContact CE-O 3.35Å; T270-R272 PolarHBondContact O-N 2.74Å; T270-R272 VanDerWaalsContact O-N 3.08Å; T270-R272 PolarHBondContact OG1-N 3.13Å
273	D	98.1	Very high	95	Very high	26 Å²	26	78.1 Å²	78.1	14%	0.139	39%	0.391	C	S	.	.	S	Bend	trans	-98.7	156.4	-178.4	-59.8	-49.3	0	0	0	110.2	H189 K237 P269 T270	H189-D273 PolarHBondContact CD2-O 2.77Å; H189-D273 PolarHBondContact NE2-O 2.93Å; K237-D273 IonicContact NZ-OD1 3.57Å; K237-D273 PolarHBondContact NZ-OD1 3.26Å; P269-D273 HydrophobicContact CB-CB 4Å; T270-D273 WeakPolarHBondContact CB-OD2 3.44Å; T270-D273 PolarHBondContact N-OD2 3.18Å; T270-D273 PolarHBondContact O-N 2.8Å; T270-D273 PolarHBondContact OG1-OD2 2.96Å
274	M	98.2	Very high	94.9	Very high	1 Å²	1	72.9 Å²	72.9	1%	0.005	37%	0.372	C	S	.	.			trans	-92.8	145.7	174.7	-67.1	-176.2	-169.6	0	0	110.4	A113 F114 A117 N190 L234 K237 A241 S242	A113-M274 HydrophobicContact CB-CB 4.33Å; F114-M274 HydrophobicContact CB-SD 4.08Å; F114-M274 HydrophobicContact CD2-CE 3.84Å; F114-M274 HydrophobicContact CD2-SD 4.27Å; A117-M274 HydrophobicContact CB-CE 3.53Å; A117-M274 HydrophobicContact CB-SD 4.41Å; N190-M274 VanDerWaalsContact OD1-CA 3.31Å; N190-M274 WeakPolarHBondContact OD1-CA 3.36Å; L234-M274 HydrophobicContact CB-CE 3.86Å; L234-M274 HydrophobicContact CD2-CE 3.63Å; L234-M274 HydrophobicContact CG-CE 4.32Å; L234-M274 VanDerWaalsContact O-CE 3.3Å; L234-M274 WeakPolarHBondContact O-CE 3.4Å; K237-M274 HydrophobicContact CB-CE 4.07Å; K237-M274 HydrophobicContact CB-CG 4.28Å; K237-M274 HydrophobicContact CB-SD 4.47Å; A241-M274 CarbonylContact C-O 3.56Å; A241-M274 WeakPolarHBondContact CA-O 3.27Å; A241-M274 HydrophobicContact CB-CB 3.88Å; S242-M274 PolarHBondContact N-O 3.06Å
275	V	98.3	Very high	94.8	Very high	3 Å²	3	74.8 Å²	74.8	2%	0.018	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	144.6	177.7	-61.1	0	0	0	0	111.8	A113 M186 H189 N190 S242 M244 L259 P269	A113-V275 WeakPolarHBondContact CB-O 3.42Å; M186-V275 HydrophobicContact CG-CG2 4.08Å; M186-V275 VanDerWaalsContact CG-O 3.26Å; M186-V275 WeakPolarHBondContact CG-O 3.32Å; H189-V275 HydrophobicContact CB-CG2 3.98Å; H189-V275 VanDerWaalsContact CD2-CG2 3.43Å; H189-V275 WeakPolarHBondContact CD2-CG2 3.48Å; N190-V275 PolarHBondContact ND2-O 2.92Å; N190-V275 PolarHBondContact OD1-N 2.98Å; N190-V275 PolarHBondContact OD1-O 2.83Å; S242-V275 WeakPolarHBondContact O-CA 3.41Å; M244-V275 HydrophobicContact CE-CG1 4.4Å; M244-V275 HydrophobicContact CG-CB 3.72Å; M244-V275 HydrophobicContact CG-CG1 4.1Å; M244-V275 HydrophobicContact SD-CB 4.25Å; M244-V275 HydrophobicContact SD-CG1 3.95Å; L259-V275 HydrophobicContact CD1-CG2 4.32Å; P269-V275 HydrophobicContact CB-CG1 3.87Å; P269-V275 HydrophobicContact CG-CG1 3.88Å
276	Y	98	Very high	94.5	Very high	24 Å²	24	69.2 Å²	69.2	9%	0.094	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	161.7	174.9	72.9	-82.4	0	0	0	110	R110 A241 S242 E243 M244 E278	R110-Y276 HydrophobicContact CB-CD1 4.12Å; R110-Y276 HydrophobicContact CB-CD2 4.44Å; R110-Y276 HydrophobicContact CB-CE1 4.33Å; R110-Y276 HydrophobicContact CB-CG 4.16Å; R110-Y276 HydrophobicContact CG-CD1 4.11Å; R110-Y276 HydrophobicContact CG-CE1 4.2Å; R110-Y276 PolarHBondContact NH2-OH 3.38Å; A241-Y276 HydrophobicContact CB-CD1 3.93Å; A241-Y276 HydrophobicContact CB-CE1 4.07Å; S242-Y276 PolarHBondContact O-N 3.48Å; S242-Y276 VanDerWaalsContact O-N 3.07Å; E243-Y276 CarbonylContact C-O 3.56Å; E243-Y276 WeakPolarHBondContact CA-O 3.46Å; E243-Y276 HydrophobicContact CB-CE1 4.22Å; E243-Y276 HydrophobicContact CB-CE2 4.17Å; E243-Y276 HydrophobicContact CG-CD2 4.49Å; E243-Y276 HydrophobicContact CG-CE2 3.89Å; M244-Y276 PolarHBondContact N-O 3.38Å; Y276-E278 WeakPolarHBondContact CD2-O 3.42Å
277	Y	97.4	Very high	94	Very high	54 Å²	54	65 Å²	65	21%	0.212	34%	0.339	C	S	.	.			trans	-136.1	-1.6	-180	65.2	-99.2	0	0	0	114.8	A108 A182 M186 M244 V246 L259	A108-Y277 HydrophobicContact CB-CD1 3.72Å; A108-Y277 HydrophobicContact CB-CD2 3.98Å; A108-Y277 HydrophobicContact CB-CE1 3.28Å; A108-Y277 HydrophobicContact CB-CE2 3.56Å; A108-Y277 HydrophobicContact CB-CG 4.05Å; A108-Y277 PolarHBondContact O-N 2.98Å; A182-Y277 HydrophobicContact CB-CE1 3.94Å; M186-Y277 HydrophobicContact CB-CD1 4.4Å; M186-Y277 HydrophobicContact CB-CE1 4.17Å; M186-Y277 HydrophobicContact SD-CD1 4.15Å; M186-Y277 HydrophobicContact SD-CE1 4.17Å; M244-Y277 WeakPolarHBondContact O-CB 3.45Å; V246-Y277 HydrophobicContact CG2-CD1 4.42Å; V246-Y277 HydrophobicContact CG2-CD2 3.76Å; V246-Y277 HydrophobicContact CG2-CE2 4.06Å; V246-Y277 HydrophobicContact CG2-CG 3.97Å; L259-Y277 HydrophobicContact CD2-CD1 3.73Å; L259-Y277 HydrophobicContact CD2-CE1 4.28Å; L259-Y277 HydrophobicContact CD2-CG 4.33Å
278	E	95.4	Very high	93.1	Very high	75 Å²	75	64.6 Å²	64.6	35%	0.35	34%	0.341	S	S	.	.	S	Bend	trans	-117	139.9	172.6	-67	-175.8	133.4	0	0	111.2	K107 A108 Y276	K107-E278 WeakPolarHBondContact CA-OE2 3.37Å; K107-E278 WeakPolarHBondContact CB-OE2 3.36Å; A108-E278 HydrophobicContact CB-CB 4.33Å; A108-E278 HydrophobicContact CB-CG 4.08Å; A108-E278 PolarHBondContact N-OE2 3.26Å; A108-E278 PolarHBondContact O-N 2.88Å; Y276-E278 WeakPolarHBondContact CD2-O 3.42Å
279	G	93.6	Very high	92.1	Very high	58 Å²	58	66.4 Å²	66.4	60%	0.598	35%	0.349	S	S	*	.	P	Polyproline II helix	trans	-64.7	138	175.2	0	0	0	0	0	111.8
280	S	91.9	Very high	91	Very high	49 Å²	49	66 Å²	66	34%	0.343	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-64	136.8	176.1	-56.9	0	0	0	0	110.6	E111	E111-S280 PolarHBondContact OE1-OG 3.44Å; E111-S280 VanDerWaalsContact OE2-CB 3.29Å; E111-S280 WeakPolarHBondContact OE2-CB 3.4Å; E111-S280 PolarHBondContact OE2-OG 2.84Å
281	P	90.9	Very high	89.8	Confident	31 Å²	31	64.2 Å²	64.2	20%	0.201	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-69.7	168	177.9	30.7	-35.3	0	0	0	111.2	F283 T290	P281-F283 HydrophobicContact CG-CD1 4.33Å; P281-F283 HydrophobicContact CG-CE1 3.7Å; P281-F283 HydrophobicContact CG-CZ 3.85Å; P281-F283 WeakPolarHBondContact O-CD2 3.49Å; P281-F283 PolarHBondContact O-N 3.04Å; P281-T290 HydrophobicContact CB-CG2 3.6Å; P281-T290 HydrophobicContact CG-CG2 3.85Å
282	N	90.2	Very high	89.1	Confident	110 Å²	110	58.6 Å²	58.6	59%	0.588	32%	0.316	S	S	*	.	P	Polyproline II helix	trans	-74.3	117.1	169.4	-171.1	-14.8	0	0	0	110.2	C284	N282-C284 WeakPolarHBondContact OD1-CB 3.42Å; N282-C284 PolarHBondContact OD1-N 3.46Å; N282-C284 PolarHBondContact OD1-SG 2.95Å
283	F	92	Very high	88.4	Confident	22 Å²	22	59.5 Å²	59.5	10%	0.096	32%	0.323	C	S	.	.			trans	-89	7.1	179.6	-58.4	-71.1	0	0	0	114.5	R88 W89 E111 P281 G294	R88-F283 HydrophobicContact CB-CB 3.79Å; W89-F283 HydrophobicContact CB-CB 4.46Å; W89-F283 HydrophobicContact CB-CD1 3.85Å; W89-F283 HydrophobicContact CB-CD2 3.82Å; W89-F283 HydrophobicContact CB-CE1 3.93Å; W89-F283 HydrophobicContact CB-CE2 3.89Å; W89-F283 HydrophobicContact CB-CG 3.79Å; W89-F283 HydrophobicContact CB-CZ 3.94Å; W89-F283 AromaticContact CD1-CE1 3.71Å; W89-F283 HydrophobicContact CG-CD1 4.3Å; W89-F283 HydrophobicContact CG-CE1 4.01Å; W89-F283 HydrophobicContact CG-CZ 4.15Å; E111-F283 HydrophobicContact CG-CE2 4.36Å; E111-F283 HydrophobicContact CG-CZ 4.12Å; P281-F283 HydrophobicContact CG-CD1 4.33Å; P281-F283 HydrophobicContact CG-CE1 3.7Å; P281-F283 HydrophobicContact CG-CZ 3.85Å; P281-F283 WeakPolarHBondContact O-CD2 3.49Å; P281-F283 PolarHBondContact O-N 3.04Å; F283-G294 WeakPolarHBondContact O-CA 3.39Å
284	C	92.8	Very high	88	Confident	8 Å²	8	58.7 Å²	58.7	5%	0.054	32%	0.321	C	S	.	.	S	Bend	trans	-67.2	-41.4	-178.6	-72.6	0	0	0	0	113.2	N282 G294 T295 C315 R317	N282-C284 WeakPolarHBondContact OD1-CB 3.42Å; N282-C284 PolarHBondContact OD1-N 3.46Å; N282-C284 PolarHBondContact OD1-SG 2.95Å; C284-G294 WeakPolarHBondContact O-CA 3.48Å; C284-T295 PolarHBondContact O-N 3.31Å; C284-T295 PolarHBondContact O-OG1 3.39Å; C284-C315 VanDerWaalsContact CA-SG 3.56Å; C284-C315 HydrophobicContact CB-CB 3.69Å; C284-C315 WeakPolarHBondContact CB-SG 3.39Å; C284-C315 WeakPolarHBondContact SG-CB 3.48Å; C284-C315 CovalentContact SG-SG 2.02Å; C284-C315 PolarHBondContact SG-SG 3.5Å; C284-R317 PolarHBondContact O-NH1 2.88Å
285	E	91.1	Very high	87.8	Confident	103 Å²	103	58.6 Å²	58.6	48%	0.481	32%	0.32	S	S	.	.	S	Bend	trans	-108.4	152.1	-177	-64	-53.6	138.9	0	0	110.7	N287 S292 G294 R317	E285-N287 PolarHBondContact O-N 2.93Å; E285-S292 PolarHBondContact O-OG 3.24Å; E285-G294 VanDerWaalsContact C-CA 3.46Å; E285-R317 IonicContact OE1-CZ 3.55Å; E285-R317 IonicContact OE1-NE 3.85Å; E285-R317 IonicContact OE1-NH1 2.7Å; E285-R317 PolarHBondContact OE1-NH1 3.28Å
286	P	86.5	Confident	87.6	Confident	91 Å²	91	66.5 Å²	66.5	59%	0.591	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.6	130.3	173.4	26.9	-32.8	0	0	0	110	S292	P286-S292 CarbonylContact C-O 3.51Å; P286-S292 VanDerWaalsContact CA-O 3.32Å; P286-S292 WeakPolarHBondContact CA-O 3.22Å
287	N	82	Confident	87.4	Confident	62 Å²	62	70.4 Å²	70.4	33%	0.332	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	114.9	176.2	-179.1	-19.4	0	0	0	109.3	E285 E289 T290 G291 S292	E285-N287 PolarHBondContact O-N 2.93Å; N287-E289 WeakPolarHBondContact OD1-CB 3.25Å; N287-E289 PolarHBondContact OD1-N 3.13Å; N287-T290 WeakPolarHBondContact CB-OG1 3.42Å; N287-T290 PolarHBondContact O-N 3.19Å; N287-T290 PolarHBondContact O-OG1 2.92Å; N287-T290 PolarHBondContact OD1-N 3.05Å; N287-G291 CarbonylContact O-C 3.54Å; N287-G291 PolarHBondContact O-N 3.35Å; N287-G291 VanDerWaalsContact O-N 3.07Å; N287-S292 PolarHBondContact N-O 3.34Å; N287-S292 PolarHBondContact O-N 3.26Å
288	Q	76.6	Confident	87.2	Confident	193 Å²	193	69.6 Å²	69.6	90%	0.902	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-33.5	-178.8	-68.3	179.9	5.2	0	0	112.7	T290 G291	Q288-T290 VanDerWaalsContact C-N 3.27Å; Q288-T290 PolarHBondContact O-N 3.49Å; Q288-G291 PolarHBondContact O-N 3.03Å
289	E	73.9	Confident	87.1	Confident	162 Å²	162	69.4 Å²	69.4	76%	0.757	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-29	-179.9	-58.4	-179.2	170.9	0	0	112.5	N287	N287-E289 WeakPolarHBondContact OD1-CB 3.25Å; N287-E289 PolarHBondContact OD1-N 3.13Å
290	T	72.3	Confident	87.1	Confident	21 Å²	21	67.3 Å²	67.3	13%	0.129	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-3.1	176.9	62.2	0	0	0	0	112.7	P281 N287 Q288 S292	P281-T290 HydrophobicContact CB-CG2 3.6Å; P281-T290 HydrophobicContact CG-CG2 3.85Å; N287-T290 WeakPolarHBondContact CB-OG1 3.42Å; N287-T290 PolarHBondContact O-N 3.19Å; N287-T290 PolarHBondContact O-OG1 2.92Å; N287-T290 PolarHBondContact OD1-N 3.05Å; Q288-T290 VanDerWaalsContact C-N 3.27Å; Q288-T290 PolarHBondContact O-N 3.49Å; T290-S292 PolarHBondContact O-N 2.89Å; T290-S292 WeakPolarHBondContact OG1-CB 3.39Å; T290-S292 PolarHBondContact OG1-N 3.17Å
291	G	72.4	Confident	87.2	Confident	31 Å²	31	68.5 Å²	68.5	32%	0.32	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.2	10.8	-171.4	0	0	0	0	0	114.2	T93 N287 Q288	T93-G291 WeakPolarHBondContact CG2-O 3.23Å; N287-G291 CarbonylContact O-C 3.54Å; N287-G291 PolarHBondContact O-N 3.35Å; N287-G291 VanDerWaalsContact O-N 3.07Å; Q288-G291 PolarHBondContact O-N 3.03Å
292	S	81.5	Confident	87.3	Confident	8 Å²	8	71.4 Å²	71.4	6%	0.056	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	129.3	178.3	178.1	0	0	0	0	111.1	E285 P286 N287 T290 G294	E285-S292 PolarHBondContact O-OG 3.24Å; P286-S292 CarbonylContact C-O 3.51Å; P286-S292 VanDerWaalsContact CA-O 3.32Å; P286-S292 WeakPolarHBondContact CA-O 3.22Å; N287-S292 PolarHBondContact N-O 3.34Å; N287-S292 PolarHBondContact O-N 3.26Å; T290-S292 PolarHBondContact O-N 2.89Å; T290-S292 WeakPolarHBondContact OG1-CB 3.39Å; T290-S292 PolarHBondContact OG1-N 3.17Å; S292-G294 VanDerWaalsContact C-N 3.33Å; S292-G294 PolarHBondContact OG-N 3.07Å
293	F	84.1	Confident	87.4	Confident	117 Å²	117	71.4 Å²	71.4	51%	0.513	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	-6.9	169.2	-72.3	-67	0	0	0	113.5	T93	T93-F293 HydrophobicContact CG2-CD2 3.61Å; T93-F293 HydrophobicContact CG2-CE2 3.72Å
294	G	89.3	Confident	87.4	Confident	9 Å²	9	71.8 Å²	71.8	9%	0.093	39%	0.386	C	S	.	.			trans	73.8	-178	-168.7	0	0	0	0	0	112.7	F283 C284 E285 S292	F283-G294 WeakPolarHBondContact O-CA 3.39Å; C284-G294 WeakPolarHBondContact O-CA 3.48Å; E285-G294 VanDerWaalsContact C-CA 3.46Å; S292-G294 VanDerWaalsContact C-N 3.33Å; S292-G294 PolarHBondContact OG-N 3.07Å
295	T	93.9	Very high	87.3	Confident	0 Å²	0	79.3 Å²	79.3	0%	0	42%	0.42	C	S	.	.	S	Bend	trans	-109.7	2.9	-177.7	59.7	0	0	0	0	114.9	R88 C284 R298 L313 R317 C354	R88-T295 HydrophobicContact CB-CG2 3.81Å; R88-T295 HydrophobicContact CG-CG2 3.96Å; C284-T295 PolarHBondContact O-N 3.31Å; C284-T295 PolarHBondContact O-OG1 3.39Å; T295-R298 VanDerWaalsContact O-CB 3.29Å; T295-R298 WeakPolarHBondContact O-CB 3.37Å; T295-R298 WeakPolarHBondContact O-CG 3.44Å; T295-R298 PolarHBondContact O-N 3.39Å; T295-L313 WeakPolarHBondContact CB-O 3.5Å; T295-L313 HydrophobicContact CG2-CD1 4.36Å; T295-L313 WeakPolarHBondContact CG2-O 3.3Å; T295-L313 PolarHBondContact OG1-O 3.08Å; T295-R317 PolarHBondContact OG1-NH2 2.74Å; T295-C354 WeakPolarHBondContact O-CB 3.29Å
296	R	94.1	Very high	87.3	Confident	169 Å²	169	76 Å²	76	64%	0.638	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	142.3	177	-178.8	166.5	176.6	175.7	4.8	111.5	R298 K355	R296-R298 PolarHBondContact O-N 3.46Å; R296-K355 VanDerWaalsContact CD-OXT 3.31Å; R296-K355 WeakPolarHBondContact CD-OXT 3.39Å; R296-K355 WeakPolarHBondContact CG-OXT 3.27Å; R296-K355 PolarHBondContact NE-OXT 3.47Å
297	D	93.4	Very high	87.5	Confident	106 Å²	106	74.9 Å²	74.9	57%	0.567	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.1	7.6	-178.6	-58.3	-49.4	0	0	0	115.5	C354	D297-C354 WeakPolarHBondContact CA-O 3.29Å; D297-C354 PolarHBondContact N-O 3.49Å
298	R	92.9	Very high	87.9	Confident	36 Å²	36	76 Å²	76	14%	0.136	41%	0.405	C	S	.	.			trans	-77.3	137	175	-67.2	-168.9	60.1	-164.8	-8.4	111.6	R85 R87 R88 T295 R296 C300 T353 C354	R85-R298 PolarHBondContact O-NH2 2.97Å; R87-R298 PolarHBondContact O-NH1 3.22Å; R87-R298 PolarHBondContact O-NH2 3.34Å; R88-R298 PolarHBondContact O-NH1 3.44Å; T295-R298 VanDerWaalsContact O-CB 3.29Å; T295-R298 WeakPolarHBondContact O-CB 3.37Å; T295-R298 WeakPolarHBondContact O-CG 3.44Å; T295-R298 PolarHBondContact O-N 3.39Å; R296-R298 PolarHBondContact O-N 3.46Å; R298-C300 PolarHBondContact O-N 3.1Å; R298-T353 CarbonylContact O-C 3.55Å; R298-T353 VanDerWaalsContact O-CA 3.23Å; R298-T353 WeakPolarHBondContact O-CA 3.47Å; R298-C354 PolarHBondContact O-N 2.81Å
299	A	93.6	Very high	88.7	Confident	71 Å²	71	66.9 Å²	66.9	59%	0.587	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.2	132.2	172.3	0	0	0	0	0	110.4	L313 H352	A299-L313 WeakPolarHBondContact O-CD2 3.16Å; A299-H352 CarbonylContact C-O 3.6Å; A299-H352 VanDerWaalsContact CA-O 3.27Å; A299-H352 WeakPolarHBondContact CA-O 3.46Å
300	C	94.6	Very high	89.7	Confident	15 Å²	15	59.3 Å²	59.3	10%	0.101	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	156.5	178.1	66.2	0	0	0	0	110.8	R298 C310 L313 H352	R298-C300 PolarHBondContact O-N 3.1Å; C300-C310 HydrophobicContact CB-CB 3.85Å; C300-C310 WeakPolarHBondContact CB-SG 3.49Å; C300-C310 VanDerWaalsContact SG-CA 3.55Å; C300-C310 WeakPolarHBondContact SG-CB 3.46Å; C300-C310 CovalentContact SG-SG 2.04Å; C300-C310 PolarHBondContact SG-SG 3.46Å; C300-L313 HydrophobicContact CB-CB 4.49Å; C300-L313 HydrophobicContact CB-CD2 3.93Å; C300-H352 PolarHBondContact N-O 2.75Å
301	N	94.3	Very high	90.7	Very high	74 Å²	74	63.9 Å²	63.9	40%	0.396	35%	0.351	S	S	.	.	B	Isolated β-bridge	trans	-97.5	115.9	178.6	-174.1	-14.1	0	0	0	110.1	S303 S304 E308 G309 C310	N301-S303 VanDerWaalsContact C-N 3.32Å; N301-S303 PolarHBondContact O-N 3.41Å; N301-S303 PolarHBondContact OD1-N 3.49Å; N301-S304 PolarHBondContact O-N 3.29Å; N301-E308 PolarHBondContact N-O 2.76Å; N301-G309 VanDerWaalsContact O-CA 3.3Å; N301-G309 WeakPolarHBondContact O-CA 3.33Å; N301-C310 PolarHBondContact O-N 3.49Å
302	L	92.6	Very high	91.8	Very high	92 Å²	92	66 Å²	66	48%	0.482	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-31.8	-179.1	-166.8	68.9	0	0	0	112.7	S304 H319	L302-S304 VanDerWaalsContact C-N 3.31Å; L302-H319 VanDerWaalsContact CD1-NE2 3.26Å; L302-H319 WeakPolarHBondContact CD1-NE2 3.28Å
303	S	91.7	Very high	92.4	Very high	109 Å²	109	65.6 Å²	65.6	76%	0.762	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-10.2	-177.4	-52.6	0	0	0	0	113.4	N301	N301-S303 VanDerWaalsContact C-N 3.32Å; N301-S303 PolarHBondContact O-N 3.41Å; N301-S303 PolarHBondContact OD1-N 3.49Å
304	S	92.5	Very high	93	Very high	31 Å²	31	60 Å²	60	22%	0.217	33%	0.328	C	S	.	.			trans	-95.3	128.8	-179.1	-175.7	0	0	0	0	110.5	N301 L302 G306 G309	N301-S304 PolarHBondContact O-N 3.29Å; L302-S304 VanDerWaalsContact C-N 3.31Å; S304-G306 VanDerWaalsContact C-N 3.31Å; S304-G306 PolarHBondContact OG-N 3.09Å; S304-G309 WeakPolarHBondContact O-CA 3.44Å
305	H	90.6	Very high	93.3	Very high	165 Å²	165	61.5 Å²	61.5	76%	0.764	34%	0.336	S	S	*	.			trans	-90.4	1	167.8	-61.1	-69.3	0	0	0	112.6
306	G	90.9	Very high	93.3	Very high	33 Å²	33	64.7 Å²	64.7	34%	0.34	37%	0.37	S	S	.	.	S	Bend	trans	-84.1	-167.7	178.1	0	0	0	0	0	112.9	S304 E308 G309 L312	S304-G306 VanDerWaalsContact C-N 3.31Å; S304-G306 PolarHBondContact OG-N 3.09Å; G306-E308 PolarHBondContact O-N 3.41Å; G306-G309 WeakPolarHBondContact O-CA 3.2Å; G306-G309 PolarHBondContact O-N 3.1Å; G306-L312 WeakPolarHBondContact O-CD1 3.21Å
307	I	89.8	Confident	93.3	Very high	69 Å²	69	60 Å²	60	35%	0.354	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-25.9	-174.3	-57.2	167.3	0	0	0	112.5	R87	R87-I307 VanDerWaalsContact CZ-CD1 3.44Å
308	E	90.3	Very high	93.4	Very high	85 Å²	85	56.4 Å²	56.4	40%	0.397	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-9.2	173.6	-44.1	-165.1	135.1	0	0	113	G86 N301 G306	G86-E308 WeakPolarHBondContact CA-OE1 3.37Å; G86-E308 WeakPolarHBondContact O-CA 3.46Å; N301-E308 PolarHBondContact N-O 2.76Å; G306-E308 PolarHBondContact O-N 3.41Å
309	G	94.8	Very high	93.6	Very high	1 Å²	1	57 Å²	57	1%	0.01	34%	0.344	C	S	.	.	B	Isolated β-bridge	trans	-66.6	147	178.8	0	0	0	0	0	112.7	N301 S304 G306 D311 L312 L313	N301-G309 VanDerWaalsContact O-CA 3.3Å; N301-G309 WeakPolarHBondContact O-CA 3.33Å; S304-G309 WeakPolarHBondContact O-CA 3.44Å; G306-G309 WeakPolarHBondContact O-CA 3.2Å; G306-G309 PolarHBondContact O-N 3.1Å; G309-D311 PolarHBondContact O-N 3.46Å; G309-L312 PolarHBondContact O-N 3.3Å; G309-L313 WeakPolarHBondContact O-CB 3.32Å; G309-L313 PolarHBondContact O-N 2.84Å
310	C	95.1	Very high	93.7	Very high	4 Å²	4	57.2 Å²	57.2	3%	0.027	34%	0.335	C	S	.	.	H	α-helix	trans	-59	-34.9	179.8	-64	0	0	0	0	113	C300 N301 C314 H319	C300-C310 HydrophobicContact CB-CB 3.85Å; C300-C310 WeakPolarHBondContact CB-SG 3.49Å; C300-C310 VanDerWaalsContact SG-CA 3.55Å; C300-C310 WeakPolarHBondContact SG-CB 3.46Å; C300-C310 CovalentContact SG-SG 2.04Å; C300-C310 PolarHBondContact SG-SG 3.46Å; N301-C310 PolarHBondContact O-N 3.49Å; C310-C314 WeakPolarHBondContact O-CB 3.49Å; C310-C314 PolarHBondContact O-N 3.42Å; C310-C314 PolarHBondContact O-SG 3.36Å; C310-H319 HydrophobicContact CB-CB 4.45Å
311	D	93.5	Very high	93.7	Very high	116 Å²	116	60.4 Å²	60.4	62%	0.62	35%	0.354	S	S	*	.	H	α-helix	trans	-63.5	-47	179.3	-62.7	-28.3	0	0	0	112.3	G309 C315 G316	G309-D311 PolarHBondContact O-N 3.46Å; D311-C315 PolarHBondContact O-N 3.43Å; D311-G316 PolarHBondContact O-N 3.35Å
312	L	94.1	Very high	93.7	Very high	75 Å²	75	63.3 Å²	63.3	39%	0.393	36%	0.359	S	S	.	.	H	α-helix	trans	-83	-41.9	-176.9	-68.5	-178.2	0	0	0	112.5	R88 G306 G309 C315	R88-L312 VanDerWaalsContact CZ-O 3.26Å; R88-L312 PolarHBondContact NE-O 2.98Å; R88-L312 PolarHBondContact NH2-O 3.39Å; G306-L312 WeakPolarHBondContact O-CD1 3.21Å; G309-L312 PolarHBondContact O-N 3.3Å; L312-C315 PolarHBondContact O-N 2.95Å
313	L	95.4	Very high	93.9	Very high	1 Å²	1	63.2 Å²	63.2	1%	0.005	36%	0.363	C	S	.	.	H	α-helix	trans	-68.1	-40.6	-179.3	-169.6	62.3	0	0	0	111.4	R88 T295 A299 C300 G309 C315	R88-L313 HydrophobicContact CG-CD1 4.13Å; T295-L313 WeakPolarHBondContact CB-O 3.5Å; T295-L313 HydrophobicContact CG2-CD1 4.36Å; T295-L313 WeakPolarHBondContact CG2-O 3.3Å; T295-L313 PolarHBondContact OG1-O 3.08Å; A299-L313 WeakPolarHBondContact O-CD2 3.16Å; C300-L313 HydrophobicContact CB-CB 4.49Å; C300-L313 HydrophobicContact CB-CD2 3.93Å; G309-L313 WeakPolarHBondContact O-CB 3.32Å; G309-L313 PolarHBondContact O-N 2.84Å; L313-C315 VanDerWaalsContact C-N 3.27Å; L313-C315 PolarHBondContact O-N 2.02Å
314	C	95.9	Very high	94	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	4	-179.3	-45.8	0	0	0	0	113.3	C310 G316 R317 G318 C354	C310-C314 WeakPolarHBondContact O-CB 3.49Å; C310-C314 PolarHBondContact O-N 3.42Å; C310-C314 PolarHBondContact O-SG 3.36Å; C314-G316 PolarHBondContact O-N 3.5Å; C314-R317 WeakPolarHBondContact O-CB 3.03Å; C314-R317 WeakPolarHBondContact O-CG 3.01Å; C314-R317 PolarHBondContact O-N 3.3Å; C314-G318 WeakPolarHBondContact CB-O 3.06Å; C314-C354 WeakPolarHBondContact CA-SG 3.42Å; C314-C354 HydrophobicContact CB-CB 3.53Å; C314-C354 WeakPolarHBondContact CB-SG 3.42Å; C314-C354 PolarHBondContact N-SG 3.45Å; C314-C354 WeakPolarHBondContact SG-CA 3Å; C314-C354 WeakPolarHBondContact SG-CB 3.42Å; C314-C354 CovalentContact SG-SG 2.03Å; C314-C354 PolarHBondContact SG-SG 3.38Å
315	C	95.2	Very high	94.2	Very high	39 Å²	39	66.6 Å²	66.6	26%	0.264	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.3	37.2	173.6	-51.3	0	0	0	0	113.6	R88 C284 D311 L312 L313 R317	R88-C315 PolarHBondContact NE-SG 3.36Å; R88-C315 VanDerWaalsContact NE-SG 3.44Å; C284-C315 VanDerWaalsContact CA-SG 3.56Å; C284-C315 HydrophobicContact CB-CB 3.69Å; C284-C315 WeakPolarHBondContact CB-SG 3.39Å; C284-C315 WeakPolarHBondContact SG-CB 3.48Å; C284-C315 CovalentContact SG-SG 2.02Å; C284-C315 PolarHBondContact SG-SG 3.5Å; D311-C315 PolarHBondContact O-N 3.43Å; L312-C315 PolarHBondContact O-N 2.95Å; L313-C315 VanDerWaalsContact C-N 3.27Å; L313-C315 PolarHBondContact O-N 2.02Å; C315-R317 VanDerWaalsContact C-N 3.27Å; C315-R317 PolarHBondContact O-N 2.95Å
316	G	93.7	Very high	94.4	Very high	68 Å²	68	64.5 Å²	64.5	70%	0.701	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.8	0.6	-179.5	0	0	0	0	0	116	D311 C314 G318	D311-G316 PolarHBondContact O-N 3.35Å; C314-G316 PolarHBondContact O-N 3.5Å; G316-G318 PolarHBondContact O-N 3.43Å
317	R	95.1	Very high	94.6	Very high	70 Å²	70	70.7 Å²	70.7	26%	0.264	36%	0.364	S	S	.	.	S	Bend	trans	-72.1	-9.5	177	-58.8	-170.6	-58.2	-91.3	-10.7	113.6	C284 E285 T295 C314 C315 K355	C284-R317 PolarHBondContact O-NH1 2.88Å; E285-R317 IonicContact OE1-CZ 3.55Å; E285-R317 IonicContact OE1-NE 3.85Å; E285-R317 IonicContact OE1-NH1 2.7Å; E285-R317 PolarHBondContact OE1-NH1 3.28Å; T295-R317 PolarHBondContact OG1-NH2 2.74Å; C314-R317 WeakPolarHBondContact O-CB 3.03Å; C314-R317 WeakPolarHBondContact O-CG 3.01Å; C314-R317 PolarHBondContact O-N 3.3Å; C315-R317 VanDerWaalsContact C-N 3.27Å; C315-R317 PolarHBondContact O-N 2.95Å; R317-K355 HydrophobicContact CB-CB 4.47Å; R317-K355 PolarHBondContact NE-O 2.7Å; R317-K355 PolarHBondContact NH2-O 3.15Å
318	G	94.6	Very high	94.9	Very high	30 Å²	30	69.8 Å²	69.8	31%	0.309	36%	0.358	S	S	.	.			trans	77.7	-174.2	-170.5	0	0	0	0	0	112.7	C314 G316 K355	C314-G318 WeakPolarHBondContact CB-O 3.06Å; G316-G318 PolarHBondContact O-N 3.43Å; G318-K355 PolarHBondContact O-N 3.21Å; G318-K355 VanDerWaalsContact O-N 3.16Å
319	H	96.6	Very high	95.2	Very high	50 Å²	50	71.7 Å²	71.7	23%	0.231	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	155.8	-178.1	62.2	87.1	0	0	0	111.2	L302 C310 H352 T353 K355	L302-H319 VanDerWaalsContact CD1-NE2 3.26Å; L302-H319 WeakPolarHBondContact CD1-NE2 3.28Å; C310-H319 HydrophobicContact CB-CB 4.45Å; H319-H352 AromaticContact CE1-ND1 3.85Å; H319-H352 AromaticContact ND1-ND1 3.79Å; H319-T353 CarbonylContact C-O 3.47Å; H319-T353 VanDerWaalsContact CA-O 3.26Å; H319-T353 WeakPolarHBondContact CA-O 3.28Å; H319-T353 WeakPolarHBondContact CB-O 3.26Å; H319-K355 WeakPolarHBondContact O-CE 3.07Å
320	N	96.3	Very high	95.3	Very high	75 Å²	75	72.1 Å²	72.1	40%	0.401	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	153.9	164.9	-64.2	-36.7	0	0	0	108.9	H352 T353 K355	N320-H352 CarbonylContact O-C 3.29Å; N320-H352 VanDerWaalsContact O-CA 3.26Å; N320-H352 WeakPolarHBondContact O-CA 3.41Å; N320-T353 PolarHBondContact N-O 2.92Å; N320-T353 PolarHBondContact O-N 3.35Å; N320-K355 WeakPolarHBondContact OD1-CE 3.19Å
321	T	95.7	Very high	95.4	Very high	81 Å²	81	78.2 Å²	78.2	50%	0.497	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	128.3	174.1	-59.4	0	0	0	0	108.2	D350 H352	T321-D350 HydrophobicContact CG2-CB 4.31Å; T321-H352 PolarHBondContact OG1-ND1 2.89Å
322	R	94.3	Very high	95.5	Very high	135 Å²	135	76 Å²	76	51%	0.509	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	139.8	172.5	71.2	179	-170.9	-127.7	2.6	109.8	E324 V351	R322-E324 IonicContact NE-OE2 3.71Å; R322-E324 IonicContact NH2-OE2 3.52Å; R322-V351 HydrophobicContact CG-CB 3.99Å; R322-V351 PolarHBondContact N-O 3.48Å; R322-V351 PolarHBondContact O-N 2.03Å
323	T	95.2	Very high	95.6	Very high	90 Å²	90	77.3 Å²	77.3	55%	0.552	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.1	125.4	175	-53.6	0	0	0	0	109.4	V348 Y349 D350	T323-V348 HydrophobicContact CG2-CG1 3.11Å; T323-Y349 CarbonylContact C-O 3.49Å; T323-D350 PolarHBondContact OG1-OD1 2.03Å
324	E	94.6	Very high	95.7	Very high	56 Å²	56	82.9 Å²	82.9	26%	0.262	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	128.2	-176.8	-162.4	178.6	130.1	0	0	109.8	R322 R326 Y349 V351	R322-E324 IonicContact NE-OE2 3.71Å; R322-E324 IonicContact NH2-OE2 3.52Å; E324-R326 HydrophobicContact CG-CG 4.5Å; E324-R326 IonicContact OE1-CZ 3.28Å; E324-R326 VanDerWaalsContact OE1-CZ 3.28Å; E324-R326 IonicContact OE1-NE 2.79Å; E324-R326 PolarHBondContact OE1-NE 2.83Å; E324-R326 IonicContact OE1-NH2 2.88Å; E324-R326 PolarHBondContact OE1-NH2 2.89Å; E324-R326 IonicContact OE2-NH2 3.48Å; E324-R326 PolarHBondContact OE2-NH2 2.94Å; E324-Y349 PolarHBondContact N-O 3.15Å; E324-Y349 PolarHBondContact O-N 3Å; E324-V351 HydrophobicContact CB-CG2 4.1Å
325	K	95.8	Very high	95.6	Very high	156 Å²	156	86.3 Å²	86.3	68%	0.678	44%	0.435	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.6	120.1	175.8	-62.7	-170.1	179.8	177.1	0	109.2	V346 R347 V348	K325-V346 HydrophobicContact CB-CG1 3.82Å; K325-V346 HydrophobicContact CD-CG1 4.19Å; K325-V346 HydrophobicContact CG-CG1 4.33Å; K325-R347 WeakPolarHBondContact CA-O 3.36Å; K325-V348 HydrophobicContact CG-CG2 4.2Å
326	R	95.4	Very high	95.4	Very high	121 Å²	121	95.5 Å²	95.5	46%	0.457	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	133.3	177.7	-64.3	-176.4	177.5	169.2	3.3	110.1	E324 R347 Y349	E324-R326 HydrophobicContact CG-CG 4.5Å; E324-R326 IonicContact OE1-CZ 3.28Å; E324-R326 VanDerWaalsContact OE1-CZ 3.28Å; E324-R326 IonicContact OE1-NE 2.79Å; E324-R326 PolarHBondContact OE1-NE 2.83Å; E324-R326 IonicContact OE1-NH2 2.88Å; E324-R326 PolarHBondContact OE1-NH2 2.89Å; E324-R326 IonicContact OE2-NH2 3.48Å; E324-R326 PolarHBondContact OE2-NH2 2.94Å; R326-R347 PolarHBondContact N-O 2.9Å; R326-R347 PolarHBondContact O-N 3.19Å; R326-Y349 HydrophobicContact CB-CD2 4.15Å; R326-Y349 HydrophobicContact CB-CE2 4.07Å; R326-Y349 HydrophobicContact CG-CD2 4.18Å
327	K	96.4	Very high	94.8	Very high	163 Å²	163	97.1 Å²	97.1	71%	0.709	46%	0.464	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.7	124.8	169.8	-72.8	-174.6	178	-170.6	0	108.5	C345 V346	K327-C345 WeakPolarHBondContact CA-O 3.02Å; K327-V346 HydrophobicContact CG-CG2 4.16Å
328	E	96.2	Very high	94.6	Very high	50 Å²	50	99.1 Å²	99.1	23%	0.234	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	155.7	176.4	59.5	-179.1	-130.3	0	0	110.5	C330 C345 R347 Y349	E328-C330 PolarHBondContact O-N 2.93Å; E328-C345 PolarHBondContact N-O 3.35Å; E328-C345 PolarHBondContact O-N 2.88Å; E328-R347 HydrophobicContact CG-CB 4.44Å; E328-R347 HydrophobicContact CG-CG 4.11Å; E328-R347 WeakPolarHBondContact OE1-CD 3.42Å; E328-R347 WeakPolarHBondContact OE1-CG 3.46Å; E328-R347 IonicContact OE1-CZ 3.79Å; E328-R347 IonicContact OE1-NE 3.12Å; E328-R347 PolarHBondContact OE1-NE 2.98Å; E328-R347 VanDerWaalsContact OE1-NE 3.12Å; E328-R347 IonicContact OE1-NH1 3.72Å; E328-R347 PolarHBondContact OE1-NH1 3.36Å; E328-R347 IonicContact OE1-NH2 3.87Å; E328-Y349 PolarHBondContact OE2-OH 3.3Å
329	K	96.4	Very high	94.6	Very high	125 Å²	125	104.2 Å²	104.2	54%	0.543	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	127.4	173.3	-62.6	-56	-173.3	-176.3	0	108.5	C342 Q343 E344	K329-C342 HydrophobicContact CB-CB 3.81Å; K329-C342 HydrophobicContact CD-CB 4.07Å; K329-C342 HydrophobicContact CG-CB 4.25Å; K329-Q343 WeakPolarHBondContact CA-O 3.36Å; K329-E344 HydrophobicContact CD-CG 4.32Å; K329-E344 IonicContact NZ-OE1 3.66Å; K329-E344 PolarHBondContact NZ-OE1 2.93Å
330	C	96.2	Very high	94.6	Very high	10 Å²	10	106 Å²	106	7%	0.068	51%	0.513	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	166.6	-178	63.8	0	0	0	0	109.8	E328 C332 Q343 C345	E328-C330 PolarHBondContact O-N 2.93Å; C330-C332 PolarHBondContact O-N 3.25Å; C330-C332 VanDerWaalsContact O-N 3.14Å; C330-Q343 PolarHBondContact N-O 2.94Å; C330-Q343 PolarHBondContact O-N 3.11Å; C330-Q343 PolarHBondContact SG-O 3.22Å; C330-C345 HydrophobicContact CB-CB 3.56Å; C330-C345 WeakPolarHBondContact CB-SG 3.27Å; C330-C345 WeakPolarHBondContact SG-CB 3.41Å; C330-C345 PolarHBondContact SG-N 2.8Å; C330-C345 CovalentContact SG-SG 2Å; C330-C345 PolarHBondContact SG-SG 3.03Å
331	H	96.2	Very high	94.6	Very high	131 Å²	131	105.3 Å²	105.3	61%	0.606	51%	0.513	S	S	*	.	E	Extended strand (participates in β ladder)	trans	47.6	45.9	177.9	-53.1	104.3	0	0	0	112.1	I333	H331-I333 PolarHBondContact O-N 2.02Å
332	C	96.7	Very high	94.7	Very high	69 Å²	69	103.3 Å²	103.3	47%	0.466	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	117.4	-178.6	-67	0	0	0	0	110	C330 V340 S341 C342	C330-C332 PolarHBondContact O-N 3.25Å; C330-C332 VanDerWaalsContact O-N 3.14Å; C332-V340 HydrophobicContact CB-CG1 3.84Å; C332-S341 CarbonylContact C-O 3.53Å; C332-S341 WeakPolarHBondContact CA-O 3.02Å; C332-C342 HydrophobicContact CB-CB 4.12Å; C332-C342 WeakPolarHBondContact CB-SG 3Å; C332-C342 WeakPolarHBondContact SG-CB 3.33Å; C332-C342 CovalentContact SG-SG 2.04Å; C332-C342 PolarHBondContact SG-SG 3.29Å
333	I	96.4	Very high	94.8	Very high	104 Å²	104	102.8 Å²	102.8	53%	0.533	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	126.1	176.8	-58.7	173.7	0	0	0	107.9	H331 S341	H331-I333 PolarHBondContact O-N 2.02Å; I333-S341 PolarHBondContact N-O 3.45Å; I333-S341 PolarHBondContact O-N 3.46Å
334	F	96.7	Very high	94.9	Very high	118 Å²	118	104.3 Å²	104.3	52%	0.518	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	124.3	171.7	177.3	-121.5	0	0	0	109.7	W336 V340	F334-W336 AromaticContact CE1-CE3 3.45Å; F334-W336 HydrophobicContact CE1-CE3 3.45Å; F334-W336 VanDerWaalsContact CE1-CE3 3.45Å; F334-W336 AromaticContact CE1-CZ3 3.82Å; F334-W336 HydrophobicContact CE1-CZ3 3.82Å; F334-W336 AromaticContact CZ-CE3 3.86Å; F334-W336 HydrophobicContact CZ-CE3 3.86Å; F334-W336 HydrophobicContact CZ-CZ3 4.11Å; F334-V340 HydrophobicContact CD2-CG2 3.97Å
335	H	94.8	Very high	95	Very high	72 Å²	72	103.1 Å²	103.1	33%	0.333	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	117.4	173.9	-66.4	-90.2	0	0	0	108.4	C337 Y339	H335-C337 PolarHBondContact O-N 3.09Å; H335-Y339 HydrophobicContact CB-CD1 4.35Å; H335-Y339 HydrophobicContact CB-CE1 3.95Å; H335-Y339 HydrophobicContact CB-CE2 4.15Å; H335-Y339 AromaticContact CD2-CE2 3.56Å; H335-Y339 AromaticContact CD2-CZ 3.95Å; H335-Y339 AromaticContact CG-CE2 3.92Å; H335-Y339 AromaticContact CG-CZ 3.83Å; H335-Y339 PolarHBondContact N-O 3.43Å
336	W	90.8	Very high	95.1	Very high	231 Å²	231	99.7 Å²	99.7	88%	0.875	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	114.3	177.4	-167.8	-122.1	0	0	0	109.1	F334	F334-W336 AromaticContact CE1-CE3 3.45Å; F334-W336 HydrophobicContact CE1-CE3 3.45Å; F334-W336 VanDerWaalsContact CE1-CE3 3.45Å; F334-W336 AromaticContact CE1-CZ3 3.82Å; F334-W336 HydrophobicContact CE1-CZ3 3.82Å; F334-W336 AromaticContact CZ-CE3 3.86Å; F334-W336 HydrophobicContact CZ-CE3 3.86Å; F334-W336 HydrophobicContact CZ-CZ3 4.11Å
337	C	80.1	Confident	95.1	Very high	102 Å²	102	100.1 Å²	100.1	69%	0.689	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.5	78.9	-170.8	-158.9	0	0	0	0	116.7	H335	H335-C337 PolarHBondContact O-N 3.09Å
338	C	90.6	Very high	95.1	Very high	113 Å²	113	96.4 Å²	96.4	76%	0.764	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	cis	-154.4	48.1	-1.4	-73.9	0	0	0	0	108.4
339	Y	94.4	Very high	94.9	Very high	137 Å²	137	98 Å²	98	54%	0.537	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	154.8	-175.3	68	-85.8	0	0	0	112.2	H335	H335-Y339 HydrophobicContact CB-CD1 4.35Å; H335-Y339 HydrophobicContact CB-CE1 3.95Å; H335-Y339 HydrophobicContact CB-CE2 4.15Å; H335-Y339 AromaticContact CD2-CE2 3.56Å; H335-Y339 AromaticContact CD2-CZ 3.95Å; H335-Y339 AromaticContact CG-CE2 3.92Å; H335-Y339 AromaticContact CG-CZ 3.83Å; H335-Y339 PolarHBondContact N-O 3.43Å
340	V	96.8	Very high	94.8	Very high	88 Å²	88	96.7 Å²	96.7	53%	0.533	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	123.6	173	-178.3	0	0	0	0	107.4	C332 F334	C332-V340 HydrophobicContact CB-CG1 3.84Å; F334-V340 HydrophobicContact CD2-CG2 3.97Å
341	S	96.6	Very high	94.7	Very high	59 Å²	59	97.2 Å²	97.2	41%	0.413	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	120.7	171.3	-172.9	0	0	0	0	108.6	C332 I333	C332-S341 CarbonylContact C-O 3.53Å; C332-S341 WeakPolarHBondContact CA-O 3.02Å; I333-S341 PolarHBondContact N-O 3.45Å; I333-S341 PolarHBondContact O-N 3.46Å
342	C	97.7	Very high	94.7	Very high	40 Å²	40	92.4 Å²	92.4	27%	0.27	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	143.3	177.5	-59.6	0	0	0	0	110.1	K329 C332	K329-C342 HydrophobicContact CB-CB 3.81Å; K329-C342 HydrophobicContact CD-CB 4.07Å; K329-C342 HydrophobicContact CG-CB 4.25Å; C332-C342 HydrophobicContact CB-CB 4.12Å; C332-C342 WeakPolarHBondContact CB-SG 3Å; C332-C342 WeakPolarHBondContact SG-CB 3.33Å; C332-C342 CovalentContact SG-SG 2.04Å; C332-C342 PolarHBondContact SG-SG 3.29Å
343	Q	97.5	Very high	94.7	Very high	123 Å²	123	89.7 Å²	89.7	58%	0.575	45%	0.453	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82	158.3	168.1	-63.9	178.1	-4.1	0	0	110.1	K329 C330	K329-Q343 WeakPolarHBondContact CA-O 3.36Å; C330-Q343 PolarHBondContact N-O 2.94Å; C330-Q343 PolarHBondContact O-N 3.11Å; C330-Q343 PolarHBondContact SG-O 3.22Å
344	E	97.2	Very high	94.7	Very high	122 Å²	122	84.7 Å²	84.7	57%	0.57	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.2	117.2	169.6	-61.9	-159.3	158.1	0	0	109.8	K329	K329-E344 HydrophobicContact CD-CG 4.32Å; K329-E344 IonicContact NZ-OE1 3.66Å; K329-E344 PolarHBondContact NZ-OE1 2.93Å
345	C	97.2	Very high	94.6	Very high	31 Å²	31	84.3 Å²	84.3	21%	0.209	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	146.8	171.3	-71	0	0	0	0	110	K327 E328 C330	K327-C345 WeakPolarHBondContact CA-O 3.02Å; E328-C345 PolarHBondContact N-O 3.35Å; E328-C345 PolarHBondContact O-N 2.88Å; C330-C345 HydrophobicContact CB-CB 3.56Å; C330-C345 WeakPolarHBondContact CB-SG 3.27Å; C330-C345 WeakPolarHBondContact SG-CB 3.41Å; C330-C345 PolarHBondContact SG-N 2.8Å; C330-C345 CovalentContact SG-SG 2Å; C330-C345 PolarHBondContact SG-SG 3.03Å
346	V	96.9	Very high	94.6	Very high	84 Å²	84	85 Å²	85	51%	0.509	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	111.5	165.9	-177.5	0	0	0	0	107.3	K325 K327	K325-V346 HydrophobicContact CB-CG1 3.82Å; K325-V346 HydrophobicContact CD-CG1 4.19Å; K325-V346 HydrophobicContact CG-CG1 4.33Å; K327-V346 HydrophobicContact CG-CG2 4.16Å
347	R	95.8	Very high	94.8	Very high	131 Å²	131	77.3 Å²	77.3	49%	0.494	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	143.8	169.4	-73.6	-151.5	179.2	140.2	0.9	110.5	K325 R326 E328 Y349	K325-R347 WeakPolarHBondContact CA-O 3.36Å; R326-R347 PolarHBondContact N-O 2.9Å; R326-R347 PolarHBondContact O-N 3.19Å; E328-R347 HydrophobicContact CG-CB 4.44Å; E328-R347 HydrophobicContact CG-CG 4.11Å; E328-R347 WeakPolarHBondContact OE1-CD 3.42Å; E328-R347 WeakPolarHBondContact OE1-CG 3.46Å; E328-R347 IonicContact OE1-CZ 3.79Å; E328-R347 IonicContact OE1-NE 3.12Å; E328-R347 PolarHBondContact OE1-NE 2.98Å; E328-R347 VanDerWaalsContact OE1-NE 3.12Å; E328-R347 IonicContact OE1-NH1 3.72Å; E328-R347 PolarHBondContact OE1-NH1 3.36Å; E328-R347 IonicContact OE1-NH2 3.87Å; R347-Y349 HydrophobicContact CB-CD2 4.31Å; R347-Y349 HydrophobicContact CB-CE2 3.53Å
348	V	95.1	Very high	95.6	Very high	84 Å²	84	75.9 Å²	75.9	51%	0.509	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	124.4	-179	-172.5	0	0	0	0	107.2	T323 K325	T323-V348 HydrophobicContact CG2-CG1 3.11Å; K325-V348 HydrophobicContact CG-CG2 4.2Å
349	Y	93.7	Very high	95.9	Very high	83 Å²	83	73.7 Å²	73.7	33%	0.325	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	137.6	-179.7	-63.8	-81.2	0	0	0	109.5	T323 E324 R326 E328 R347	T323-Y349 CarbonylContact C-O 3.49Å; E324-Y349 PolarHBondContact N-O 3.15Å; E324-Y349 PolarHBondContact O-N 3Å; R326-Y349 HydrophobicContact CB-CD2 4.15Å; R326-Y349 HydrophobicContact CB-CE2 4.07Å; R326-Y349 HydrophobicContact CG-CD2 4.18Å; E328-Y349 PolarHBondContact OE2-OH 3.3Å; R347-Y349 HydrophobicContact CB-CD2 4.31Å; R347-Y349 HydrophobicContact CB-CE2 3.53Å
350	D	93.7	Very high	96	Very high	98 Å²	98	69.8 Å²	69.8	52%	0.524	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	123.3	167.9	-66.5	-39.6	0	0	0	109.2	T321 T323	T321-D350 HydrophobicContact CG2-CB 4.31Å; T323-D350 PolarHBondContact OG1-OD1 2.03Å
351	V	94.6	Very high	95.9	Very high	22 Å²	22	68.5 Å²	68.5	13%	0.133	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	120.5	179.1	-178.7	0	0	0	0	108	R322 E324 T353	R322-V351 HydrophobicContact CG-CB 3.99Å; R322-V351 PolarHBondContact N-O 3.48Å; R322-V351 PolarHBondContact O-N 2.03Å; E324-V351 HydrophobicContact CB-CG2 4.1Å; V351-T353 HydrophobicContact CG1-CG2 4.21Å
352	H	95.9	Very high	95.9	Very high	30 Å²	30	69.2 Å²	69.2	14%	0.139	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	130	177.6	-50.8	-70.7	0	0	0	109.8	A299 C300 H319 N320 T321	A299-H352 CarbonylContact C-O 3.6Å; A299-H352 VanDerWaalsContact CA-O 3.27Å; A299-H352 WeakPolarHBondContact CA-O 3.46Å; C300-H352 PolarHBondContact N-O 2.75Å; H319-H352 AromaticContact CE1-ND1 3.85Å; H319-H352 AromaticContact ND1-ND1 3.79Å; N320-H352 CarbonylContact O-C 3.29Å; N320-H352 VanDerWaalsContact O-CA 3.26Å; N320-H352 WeakPolarHBondContact O-CA 3.41Å; T321-H352 PolarHBondContact OG1-ND1 2.89Å
353	T	96.1	Very high	95.7	Very high	11 Å²	11	71.5 Å²	71.5	7%	0.067	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	135.7	180	57.4	0	0	0	0	111.3	R298 H319 N320 V351	R298-T353 CarbonylContact O-C 3.55Å; R298-T353 VanDerWaalsContact O-CA 3.23Å; R298-T353 WeakPolarHBondContact O-CA 3.47Å; H319-T353 CarbonylContact C-O 3.47Å; H319-T353 VanDerWaalsContact CA-O 3.26Å; H319-T353 WeakPolarHBondContact CA-O 3.28Å; H319-T353 WeakPolarHBondContact CB-O 3.26Å; N320-T353 PolarHBondContact N-O 2.92Å; N320-T353 PolarHBondContact O-N 3.35Å; V351-T353 HydrophobicContact CG1-CG2 4.21Å
354	C	96	Very high	95.6	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	143.5	179.4	-62.6	0	0	0	0	113.1	T295 D297 R298 C314	T295-C354 WeakPolarHBondContact O-CB 3.29Å; D297-C354 WeakPolarHBondContact CA-O 3.29Å; D297-C354 PolarHBondContact N-O 3.49Å; R298-C354 PolarHBondContact O-N 2.81Å; C314-C354 WeakPolarHBondContact CA-SG 3.42Å; C314-C354 HydrophobicContact CB-CB 3.53Å; C314-C354 WeakPolarHBondContact CB-SG 3.42Å; C314-C354 PolarHBondContact N-SG 3.45Å; C314-C354 WeakPolarHBondContact SG-CA 3Å; C314-C354 WeakPolarHBondContact SG-CB 3.42Å; C314-C354 CovalentContact SG-SG 2.03Å; C314-C354 PolarHBondContact SG-SG 3.38Å
355	K	94.9	Very high	95.4	Very high	110 Å²	110	62.2 Å²	62.2	48%	0.478	31%	0.308	S	S	.	.			trans	-75.9	0	175.2	-71.5	179	178.3	175.9	0	113.3	R296 R317 G318 H319 N320	R296-K355 VanDerWaalsContact CD-OXT 3.31Å; R296-K355 WeakPolarHBondContact CD-OXT 3.39Å; R296-K355 WeakPolarHBondContact CG-OXT 3.27Å; R296-K355 PolarHBondContact NE-OXT 3.47Å; R317-K355 HydrophobicContact CB-CB 4.47Å; R317-K355 PolarHBondContact NE-O 2.7Å; R317-K355 PolarHBondContact NH2-O 3.15Å; G318-K355 PolarHBondContact O-N 3.21Å; G318-K355 VanDerWaalsContact O-N 3.16Å; H319-K355 WeakPolarHBondContact O-CE 3.07Å; N320-K355 WeakPolarHBondContact OD1-CE 3.19Å

Retrieved 355 of 355 residues in 866.1 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).