A0A087Y5T6_POEFO Loading...

Ferredoxin-2, mitochondrial

Electron donor, of the core iron-sulfur cluster (ISC) assembly complex, that acts to reduce the persulfide into sulfide during [2Fe-2S] clusters assembly on the scaffolding protein ISCU. The core iron-sulfur cluster (ISC) assembly complex is involved in the de novo synthesis of a [2Fe-2S] cluster, the first step of the mitochondrial iron-sulfur protein biogenesis. This process is initiated by the cysteine desulfurase complex (NFS1:LYRM4:NDUFAB1) that produces persulfide which is delivered on the scaffold protein ISCU in a FXN-dependent manner. Then this complex is stabilized by FDX2 which provides reducing equivalents to accomplish the [2Fe-2S] cluster assembly. Finally, the [2Fe-2S] cluster is transferred from ISCU to chaperone proteins, including HSCB, HSPA9 and GLRX5. Essential for coenzyme Q biosynthesis: together with FDXR, transfers the electrons required for the hydroxylation reaction performed by COQ6.

AlphaFold DB (A0A3B3UPA8), UniProt , Accession A0A087Y5T6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 196 aa.

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(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	43.4	Very low	46.1	Very low	250 Å²	250	139.1 Å²	139.1	100%	1.232	89%	0.894	S	S	*	*				0	90.2	0	-74.5	169.2	177.4	0	0	108
2	A	39.4	Very low	46	Very low	111 Å²	111	133.7 Å²	133.7	92%	0.917	88%	0.883	S	S	*	*			trans	-86.5	126.8	-177.5	0	0	0	0	0	110.1
3	A	40.6	Very low	45.8	Very low	108 Å²	108	134.6 Å²	134.6	89%	0.893	87%	0.874	S	S	*	*			trans	-92.6	125.5	176.2	0	0	0	0	0	109.8
4	A	47.8	Very low	46	Very low	102 Å²	102	134.5 Å²	134.5	84%	0.843	87%	0.87	S	S	*	*			trans	-110.8	120.6	167.7	0	0	0	0	0	108.8
5	A	47.3	Very low	45.7	Very low	108 Å²	108	133.3 Å²	133.3	89%	0.893	85%	0.853	S	S	*	*			trans	-77.9	126.1	178.8	0	0	0	0	0	111
6	A	46.6	Very low	45.6	Very low	97 Å²	97	139.3 Å²	139.3	80%	0.802	85%	0.853	S	S	*	*			trans	-86.1	115.2	175.7	0	0	0	0	0	110.8
7	A	46.8	Very low	45.2	Very low	102 Å²	102	141.5 Å²	141.5	84%	0.843	85%	0.849	S	S	*	*			trans	-80.6	120.8	166.8	0	0	0	0	0	109.5
8	R	52.4	Low	45	Very low	247 Å²	247	139.1 Å²	139.1	93%	0.932	84%	0.84	S	S	*	*			trans	-90.4	113.2	174.7	-66.8	171.3	124.8	-176.2	-1	108.6
9	S	44.4	Very low	44.9	Very low	116 Å²	116	144.4 Å²	144.4	81%	0.811	84%	0.843	S	S	*	*			trans	-111.5	109	164.7	-81.6	0	0	0	0	109.6
10	S	52.7	Low	44.9	Very low	119 Å²	119	143.6 Å²	143.6	83%	0.832	84%	0.84	S	S	*	*			trans	-72	115.1	167.9	51.2	0	0	0	0	109.9
11	M	46	Very low	45.2	Very low	170 Å²	170	143.6 Å²	143.6	84%	0.837	84%	0.835	S	S	*	*			trans	-118.7	113.4	161.3	-60.4	-130.3	97.4	0	0	107.4	L13	M11-L13 PolarHBondContact O-N 3.13Å
12	G	45	Very low	45.6	Very low	74 Å²	74	136.7 Å²	136.7	76%	0.763	81%	0.809	S	S	*	*			trans	-65.5	120.6	178.9	0	0	0	0	0	110.8	T14	G12-T14 PolarHBondContact O-N 3.48Å; G12-T14 VanDerWaalsContact O-N 3.12Å
13	L	43	Very low	46.2	Very low	146 Å²	146	138.2 Å²	138.2	76%	0.764	80%	0.801	S	S	*	*			trans	-72.3	97.3	165.7	-96.8	90.7	0	0	0	108.8	M11 L15	M11-L13 PolarHBondContact O-N 3.13Å; L13-L15 VanDerWaalsContact C-N 3.28Å; L13-L15 HydrophobicContact CD2-CD1 3.94Å; L13-L15 HydrophobicContact CD2-CG 4.06Å; L13-L15 PolarHBondContact O-N 2.83Å
14	T	48.7	Very low	47	Very low	133 Å²	133	137.6 Å²	137.6	82%	0.816	79%	0.79	S	S	*	*			trans	-80.7	82.7	157.1	46.4	0	0	0	0	108	G12 R16	G12-T14 PolarHBondContact O-N 3.48Å; G12-T14 VanDerWaalsContact O-N 3.12Å; T14-R16 PolarHBondContact O-N 2.74Å
15	L	41.9	Very low	47.5	Very low	117 Å²	117	144.3 Å²	144.3	61%	0.613	79%	0.793	S	S	*	*			trans	-67.1	87.8	166.7	-84.7	159	0	0	0	108.4	L13 F17	L13-L15 VanDerWaalsContact C-N 3.28Å; L13-L15 HydrophobicContact CD2-CD1 3.94Å; L13-L15 HydrophobicContact CD2-CG 4.06Å; L13-L15 PolarHBondContact O-N 2.83Å; L15-F17 HydrophobicContact CB-CD2 4.11Å; L15-F17 HydrophobicContact CB-CE2 3.92Å; L15-F17 HydrophobicContact CD1-CE2 4.4Å; L15-F17 PolarHBondContact O-N 3.5Å
16	R	42.8	Very low	48.2	Very low	228 Å²	228	144.3 Å²	144.3	86%	0.86	79%	0.787	S	S	*	*			trans	-66	93.2	157.3	-78.8	-167.5	171.1	-162.9	-1.1	106.8	T14 S18	T14-R16 PolarHBondContact O-N 2.74Å; R16-S18 PolarHBondContact O-N 2.8Å
17	F	39.5	Very low	48.3	Very low	177 Å²	177	143.2 Å²	143.2	78%	0.776	77%	0.772	S	S	*	*			trans	-64	89	164.3	-80.7	-85.6	0	0	0	108.3	L15 R19	L15-F17 HydrophobicContact CB-CD2 4.11Å; L15-F17 HydrophobicContact CB-CE2 3.92Å; L15-F17 HydrophobicContact CD1-CE2 4.4Å; L15-F17 PolarHBondContact O-N 3.5Å; F17-R19 PolarHBondContact O-N 2.87Å; F17-R19 VanDerWaalsContact O-N 3.09Å
18	S	41.9	Very low	48.7	Very low	99 Å²	99	144.6 Å²	144.6	69%	0.692	77%	0.772	S	S	*	*			trans	-63.2	105.8	157.9	-55.9	0	0	0	0	106.3	R16 V20	R16-S18 PolarHBondContact O-N 2.8Å; S18-V20 VanDerWaalsContact C-N 3.27Å; S18-V20 PolarHBondContact O-N 2.91Å
19	R	42.1	Very low	48.6	Very low	240 Å²	240	139.9 Å²	139.9	91%	0.906	77%	0.765	S	S	*	*			trans	-61.5	96.3	165.2	-85.2	-178.4	175.7	171.4	-1.8	107.1	F17 I21	F17-R19 PolarHBondContact O-N 2.87Å; F17-R19 VanDerWaalsContact O-N 3.09Å; R19-I21 PolarHBondContact O-N 3.44Å
20	V	44.7	Very low	49	Very low	128 Å²	128	144.9 Å²	144.9	78%	0.776	77%	0.768	S	S	*	*			trans	-70.2	108.6	165.5	179	0	0	0	0	105.7	S18	S18-V20 VanDerWaalsContact C-N 3.27Å; S18-V20 PolarHBondContact O-N 2.91Å
21	I	51.4	Low	49	Very low	144 Å²	144	150.4 Å²	150.4	74%	0.738	77%	0.77	S	S	*	*			trans	-68.8	124.5	171.3	-59	170.2	0	0	0	105.9	R19 D23	R19-I21 PolarHBondContact O-N 3.44Å; I21-D23 PolarHBondContact O-N 3.27Å
22	P	51.7	Low	49.3	Very low	104 Å²	104	149.7 Å²	149.7	68%	0.675	77%	0.769	S	S	*	*			trans	-69	121.6	177.4	27	-31	0	0	0	109.3	C24	P22-C24 PolarHBondContact O-N 2.75Å
23	D	53.9	Low	49.8	Very low	143 Å²	143	157 Å²	157	77%	0.765	78%	0.78	S	S	*	*			trans	-61.3	106.3	167.4	-88	-39.4	0	0	0	109	I21 R25	I21-D23 PolarHBondContact O-N 3.27Å; D23-R25 PolarHBondContact O-N 3.26Å
24	C	57.5	Low	50.2	Low	96 Å²	96	153.2 Å²	153.2	65%	0.649	78%	0.776	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	59.2	176	-85	0	0	0	0	112.7	P22	P22-C24 PolarHBondContact O-N 2.75Å
25	R	57.1	Low	50	Low	243 Å²	243	153 Å²	153	92%	0.917	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.6	-5.4	171.3	-74.9	-171.9	173.9	-169.4	-0.5	114.4	D23	D23-R25 PolarHBondContact O-N 3.26Å
26	S	62.2	Low	50.2	Low	108 Å²	108	154.1 Å²	154.1	76%	0.755	79%	0.79	S	S	*	*	S	Bend	trans	-123.7	11.8	-177.9	41.3	0	0	0	0	114.6	P28	S26-P28 WeakPolarHBondContact O-CD 3.49Å
27	C	49.3	Very low	50.1	Low	73 Å²	73	150.9 Å²	150.9	49%	0.493	79%	0.79	S	S	.	*			trans	-71.2	121.2	171.3	-66.8	0	0	0	0	110.6	L29	C27-L29 PolarHBondContact O-N 3.26Å; C27-L29 VanDerWaalsContact O-N 3.13Å
28	P	54.1	Low	49.9	Very low	131 Å²	131	149.6 Å²	149.6	85%	0.851	79%	0.791	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	-2.2	178.2	4.2	7.4	0	0	0	113.6	S26 Y30	S26-P28 WeakPolarHBondContact O-CD 3.49Å; P28-Y30 VanDerWaalsContact C-N 3.35Å
29	L	50.4	Low	49.6	Very low	149 Å²	149	150.8 Å²	150.8	78%	0.78	80%	0.795	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	12.5	-178.6	-67.2	178.5	0	0	0	114.3	C27 R31 L32	C27-L29 PolarHBondContact O-N 3.26Å; C27-L29 VanDerWaalsContact O-N 3.13Å; L29-R31 PolarHBondContact O-N 2.75Å; L29-L32 PolarHBondContact O-N 2.95Å
30	Y	52.3	Low	49.2	Very low	220 Å²	220	144.6 Å²	144.6	86%	0.863	80%	0.795	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	23.6	174.4	-145.2	-92.1	0	0	0	114.5	P28	P28-Y30 VanDerWaalsContact C-N 3.35Å
31	R	53.8	Low	48.4	Very low	235 Å²	235	142.5 Å²	142.5	89%	0.887	80%	0.799	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.5	-0.7	172.1	-149.9	174.3	-175.7	169.8	1.3	114.8	L29	L29-R31 PolarHBondContact O-N 2.75Å
32	L	52.2	Low	47.5	Very low	156 Å²	156	140.8 Å²	140.8	82%	0.817	80%	0.8	S	S	*	*	S	Bend	trans	-129	101.3	164.7	-69.6	169	0	0	0	107.2	L29 G34	L29-L32 PolarHBondContact O-N 2.95Å; L32-G34 PolarHBondContact O-N 2.85Å
33	K	55.2	Low	46.6	Very low	226 Å²	226	142.6 Å²	142.6	98%	0.983	80%	0.799	S	S	*	*			trans	-49.8	94.3	177.9	-114.8	176	174.8	176.8	0	110.4
34	G	51.7	Low	45.6	Very low	67 Å²	67	146.6 Å²	146.6	69%	0.691	80%	0.803	S	S	*	*			trans	-146.2	21.1	-171.1	0	0	0	0	0	115.6	L32	L32-G34 PolarHBondContact O-N 2.85Å
35	C	44.4	Very low	44.6	Very low	128 Å²	128	154.1 Å²	154.1	87%	0.865	82%	0.818	S	S	*	*			trans	-136.3	99.8	167.8	-61.9	0	0	0	0	109.4
36	V	46.7	Very low	43.3	Very low	141 Å²	141	146.3 Å²	146.3	86%	0.855	81%	0.814	S	S	*	*			trans	-127	109	153	169.4	0	0	0	0	105.9	N38	V36-N38 PolarHBondContact O-N 2.88Å
37	D	39.5	Very low	41.9	Very low	160 Å²	160	146.7 Å²	146.7	86%	0.856	82%	0.816	S	S	*	*			trans	-66.7	121.2	157.3	-70.4	-50.4	0	0	0	107.8
38	N	36.5	Very low	41.1	Very low	151 Å²	151	152 Å²	152	81%	0.807	83%	0.831	S	S	*	*			trans	-158.4	131.1	136	-136.7	-0.4	0	0	0	113.5	V36	V36-N38 PolarHBondContact O-N 2.88Å
39	T	34.8	Very low	40.3	Very low	124 Å²	124	152.3 Å²	152.3	76%	0.761	83%	0.826	S	S	*	*			trans	-74.9	147.8	165.5	37.8	0	0	0	0	112.2
40	A	33.3	Very low	39.5	Very low	110 Å²	110	149.9 Å²	149.9	91%	0.909	82%	0.821	S	S	*	*			trans	86.6	118.3	157.9	0	0	0	0	0	119.9
41	G	29	Very low	39	Very low	83 Å²	83	146.5 Å²	146.5	86%	0.856	82%	0.817	S	S	*	*			trans	152.7	102.2	156.7	0	0	0	0	0	116.1
42	S	32.5	Very low	38.2	Very low	109 Å²	109	146.5 Å²	146.5	76%	0.762	82%	0.817	S	S	*	*			trans	-66.4	136.9	176.2	-179.8	0	0	0	0	114
43	Q	32	Very low	37.7	Very low	142 Å²	142	145 Å²	145	66%	0.664	82%	0.815	S	S	*	*				159.1	128.5	117.7	-84.4	-166.1	30.1	0	0	115.2
44	R	33.7	Very low	37.6	Very low	226 Å²	226	141.8 Å²	141.8	85%	0.853	81%	0.806	S	S	*	*			trans	81	136.8	138.2	-67.2	179.8	-166.6	-134.5	-1.2	122.4
45	R	35	Very low	37.4	Very low	254 Å²	254	145 Å²	145	96%	0.958	81%	0.808	S	S	*	*			trans	-68.6	149.8	174.9	-64.5	175.7	-178.7	-174.4	-0.9	112.1
46	G	30.6	Very low	37.6	Very low	80 Å²	80	149.9 Å²	149.9	83%	0.825	81%	0.808	S	S	*	*			trans	-167.7	121.8	162.5	0	0	0	0	0	110.7
47	S	34.1	Very low	37.7	Very low	115 Å²	115	150.2 Å²	150.2	80%	0.804	80%	0.8	S	S	*	*			trans	-85.7	161.2	-177.7	-180	0	0	0	0	111.7
48	F	31.8	Very low	38.4	Very low	186 Å²	186	149.9 Å²	149.9	82%	0.816	80%	0.798	S	S	*	*			trans	121.8	129.3	138	-144.6	-97.2	0	0	0	116.4
49	D	35.9	Very low	39.2	Very low	136 Å²	136	149.8 Å²	149.8	73%	0.727	79%	0.792	S	S	*	*			trans	-47.9	153.9	175.8	-69.8	-73.1	0	0	0	115
50	S	33.8	Very low	39.6	Very low	98 Å²	98	149.8 Å²	149.8	69%	0.685	79%	0.792	S	S	*	*				166.8	118.7	121.2	-170.9	0	0	0	0	112.9
51	L	43.5	Very low	40.5	Very low	149 Å²	149	149.2 Å²	149.2	78%	0.78	78%	0.781	S	S	*	*			trans	51.7	113.6	138.3	-56.3	173.4	0	0	0	120.3
52	R	36	Very low	41.5	Very low	236 Å²	236	152.4 Å²	152.4	89%	0.891	78%	0.777	S	S	*	*				172.1	116.8	99	-93.9	-178.6	-175.1	-161.5	-0	111.2
53	T	42.3	Very low	42.1	Very low	125 Å²	125	153.3 Å²	153.3	77%	0.767	78%	0.782	S	S	*	*			trans	12.5	127.2	134.8	-43.3	0	0	0	0	116.8
54	I	51.9	Low	42.5	Very low	157 Å²	157	154.5 Å²	154.5	81%	0.805	79%	0.792	S	S	*	*				-156.4	111.6	108	-49.6	-168	0	0	0	110.3
55	N	48.2	Very low	43	Very low	135 Å²	135	148.4 Å²	148.4	72%	0.722	78%	0.784	S	S	*	*			trans	-3.1	112.7	143.8	-157	5.7	0	0	0	116.8
56	R	49	Very low	43.2	Very low	231 Å²	231	143.8 Å²	143.8	87%	0.872	77%	0.774	S	S	*	*			trans	-132.3	94.2	152.1	-75.1	-165.8	-168.9	-147.1	2.1	110.2	L58	R56-L58 PolarHBondContact O-N 2.84Å; R56-L58 VanDerWaalsContact O-N 3.09Å
57	H	48.4	Very low	43.6	Very low	148 Å²	148	144.7 Å²	144.7	69%	0.685	77%	0.774	S	S	*	*			trans	-41.9	103.9	154.9	-155	-2.4	0	0	0	109.9	Q59	H57-Q59 PolarHBondContact O-N 2.77Å
58	L	54.3	Low	44.1	Very low	153 Å²	153	146.5 Å²	146.5	80%	0.801	77%	0.769	S	S	*	*			trans	-93.5	87.8	165.9	-87.7	158.6	0	0	0	107.2	R56 T60	R56-L58 PolarHBondContact O-N 2.84Å; R56-L58 VanDerWaalsContact O-N 3.09Å; L58-T60 PolarHBondContact O-N 2.87Å
59	Q	52.5	Low	44.6	Very low	149 Å²	149	146.7 Å²	146.7	70%	0.696	77%	0.773	S	S	*	*			trans	-74.8	108.6	155.2	-77.9	-176.1	-35.7	0	0	107.3	H57	H57-Q59 PolarHBondContact O-N 2.77Å
60	T	44.3	Very low	44.8	Very low	124 Å²	124	143.5 Å²	143.5	76%	0.761	77%	0.772	S	S	*	*			trans	-110.2	82.5	151	53.4	0	0	0	0	107	L58 I62	L58-T60 PolarHBondContact O-N 2.87Å; T60-I62 PolarHBondContact O-N 2.89Å
61	S	51.7	Low	45.6	Very low	97 Å²	97	145 Å²	145	68%	0.678	78%	0.782	S	S	*	*			trans	-63.2	116.5	151.7	48.7	0	0	0	0	107.5
62	I	49.9	Very low	45.8	Very low	151 Å²	151	142.3 Å²	142.3	77%	0.774	78%	0.776	S	S	*	*				-173.6	111.5	125	-87.6	149.1	0	0	0	105.1	T60 L64	T60-I62 PolarHBondContact O-N 2.89Å; I62-L64 PolarHBondContact O-N 2.89Å; I62-L64 VanDerWaalsContact O-N 3.16Å
63	C	45.4	Very low	46.6	Very low	128 Å²	128	137.5 Å²	137.5	87%	0.865	77%	0.768	S	S	*	*			trans	-55.3	113.8	171.4	-64.3	0	0	0	0	107.8	S65	C63-S65 PolarHBondContact O-N 2.65Å; C63-S65 VanDerWaalsContact O-N 3.17Å
64	L	39.4	Very low	46.9	Very low	166 Å²	166	135.4 Å²	135.4	87%	0.869	76%	0.763	S	S	*	*			trans	-76.7	104.5	164.9	-150.7	72.8	0	0	0	105.6	I62 Q66	I62-L64 PolarHBondContact O-N 2.89Å; I62-L64 VanDerWaalsContact O-N 3.16Å; L64-Q66 PolarHBondContact O-N 3.42Å
65	S	45.4	Very low	47.3	Very low	99 Å²	99	135.5 Å²	135.5	69%	0.692	76%	0.76	S	S	*	*			trans	-36.7	131.2	174.4	46.2	0	0	0	0	111.4	C63 A67	C63-S65 PolarHBondContact O-N 2.65Å; C63-S65 VanDerWaalsContact O-N 3.17Å; S65-A67 PolarHBondContact O-N 3.45Å; S65-A67 VanDerWaalsContact O-N 3.14Å
66	Q	38.7	Very low	48.1	Very low	156 Å²	156	134.1 Å²	134.1	73%	0.729	75%	0.753	S	S	*	*			trans	-39.6	120.6	157.9	-70.3	156.5	-47.9	0	0	108	L64 E68	L64-Q66 PolarHBondContact O-N 3.42Å; Q66-E68 HydrophobicContact CB-CG 4.19Å; Q66-E68 PolarHBondContact O-N 3.37Å
67	A	38.4	Very low	49	Very low	100 Å²	100	128 Å²	128	83%	0.826	74%	0.743	S	S	*	*			trans	-65.1	95.8	155	0	0	0	0	0	103.9	S65 E69	S65-A67 PolarHBondContact O-N 3.45Å; S65-A67 VanDerWaalsContact O-N 3.14Å; A67-E69 VanDerWaalsContact C-N 3.33Å; A67-E69 PolarHBondContact O-N 3.05Å
68	E	45.3	Very low	50	Low	153 Å²	153	128 Å²	128	72%	0.715	75%	0.748	S	S	*	*			trans	-67.6	103.4	171	-47.5	-137.8	143	0	0	104.2	Q66 G70	Q66-E68 HydrophobicContact CB-CG 4.19Å; Q66-E68 PolarHBondContact O-N 3.37Å; E68-G70 VanDerWaalsContact C-N 3.32Å; E68-G70 PolarHBondContact O-N 2.85Å
69	E	41.5	Very low	51.5	Low	190 Å²	190	124.2 Å²	124.2	89%	0.888	73%	0.729	S	S	*	*			trans	-54.5	110	158	-72.4	-165.3	161.7	0	0	105.4	A67 S71	A67-E69 VanDerWaalsContact C-N 3.33Å; A67-E69 PolarHBondContact O-N 3.05Å; E69-S71 VanDerWaalsContact C-N 3.26Å; E69-S71 PolarHBondContact O-N 3.28Å
70	G	41.9	Very low	53.4	Low	68 Å²	68	120.6 Å²	120.6	70%	0.701	72%	0.716	S	S	*	*			trans	-63.4	87.6	-173.5	0	0	0	0	0	110.3	E68 S72	E68-G70 VanDerWaalsContact C-N 3.32Å; E68-G70 PolarHBondContact O-N 2.85Å; G70-S72 PolarHBondContact O-N 3.39Å
71	S	49.3	Very low	55.8	Low	129 Å²	129	114.8 Å²	114.8	90%	0.902	68%	0.681	S	S	*	*			trans	-87.4	60	156.6	-143.4	0	0	0	0	107.8	E69	E69-S71 VanDerWaalsContact C-N 3.26Å; E69-S71 PolarHBondContact O-N 3.28Å
72	S	49	Very low	57.9	Low	93 Å²	93	113.5 Å²	113.5	65%	0.65	67%	0.666	S	S	*	*			trans	-112	88.5	166.2	62.4	0	0	0	0	107	G70	G70-S72 PolarHBondContact O-N 3.39Å
73	N	51.2	Low	60.1	Low	135 Å²	135	106.3 Å²	106.3	72%	0.722	63%	0.63	S	S	*	*			trans	-126.7	104.2	148.3	-80.4	-30.6	0	0	0	106.6	E75	N73-E75 PolarHBondContact O-N 2.78Å
74	A	50.1	Low	62.6	Low	81 Å²	81	101.3 Å²	101.3	67%	0.669	60%	0.595	S	S	*	*			trans	-47.9	136.3	158.4	0	0	0	0	0	107.4	D76	A74-D76 VanDerWaalsContact C-N 3.3Å; A74-D76 PolarHBondContact O-N 3.06Å
75	E	59.2	Low	65.4	Low	159 Å²	159	93.4 Å²	93.4	74%	0.743	55%	0.554	S	S	*	*			trans	-74.8	85.8	-170.8	-52.9	-145.3	128.1	0	0	110.2	N73 K98	N73-E75 PolarHBondContact O-N 2.78Å; E75-K98 WeakPolarHBondContact OE1-CE 3.38Å; E75-K98 IonicContact OE1-NZ 2.74Å; E75-K98 PolarHBondContact OE1-NZ 3.46Å
76	D	65.3	Low	67.9	Low	107 Å²	107	90.2 Å²	90.2	57%	0.572	53%	0.528	S	S	*	.			trans	-70.5	125.4	160.1	-69.4	-51.1	0	0	0	107.6	A74 D78	A74-D76 VanDerWaalsContact C-N 3.3Å; A74-D76 PolarHBondContact O-N 3.06Å; D76-D78 PolarHBondContact O-N 3.06Å; D76-D78 VanDerWaalsContact O-N 3.13Å
77	P	67.3	Low	70.6	Confident	103 Å²	103	84.4 Å²	84.4	67%	0.669	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-68.4	-10.7	-174	28.2	-35.4	0	0	0	113.6	D79	P77-D79 VanDerWaalsContact C-N 3.31Å; P77-D79 PolarHBondContact O-N 2.82Å
78	D	69.8	Low	73.2	Confident	147 Å²	147	82.8 Å²	82.8	79%	0.786	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-81.6	-8.5	-173	-61.3	-32.3	0	0	0	113.2	D76	D76-D78 PolarHBondContact O-N 3.06Å; D76-D78 VanDerWaalsContact O-N 3.13Å
79	D	85.5	Confident	75.5	Confident	74 Å²	74	80.5 Å²	80.5	40%	0.396	48%	0.476	S	S	.	.	G	3₁₀ helix	trans	-99.7	12.2	-177.5	-65.7	-33.6	0	0	0	114.2	P77 K98 V99	P77-D79 VanDerWaalsContact C-N 3.31Å; P77-D79 PolarHBondContact O-N 2.82Å; D79-K98 CarbonylContact O-C 3.54Å; D79-K98 WeakPolarHBondContact O-CA 3.44Å; D79-V99 HydrophobicContact CB-CG2 4.41Å; D79-V99 PolarHBondContact O-N 3.15Å
80	V	92.6	Very high	77.9	Confident	72 Å²	72	73.9 Å²	73.9	44%	0.436	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	123.1	-178.6	-176.2	0	0	0	0	111	K96 A97	V80-K96 HydrophobicContact CG1-CB 4.26Å; V80-K96 HydrophobicContact CG1-CD 4.49Å; V80-A97 WeakPolarHBondContact CA-O 3.2Å
81	V	95	Very high	80.5	Confident	3 Å²	3	77.2 Å²	77.2	2%	0.018	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	134.1	178.8	-175	0	0	0	0	109.5	A97 V99 D173	V81-A97 PolarHBondContact N-O 3.46Å; V81-A97 PolarHBondContact O-N 2.92Å; V81-V99 HydrophobicContact CG2-CG2 3.53Å; V81-D173 HydrophobicContact CG1-CB 4.22Å
82	N	95.6	Very high	82.8	Confident	69 Å²	69	78.4 Å²	78.4	37%	0.369	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	129.1	175.9	-57.3	-73.6	0	0	0	110.6	D173 G174 I175	N82-D173 WeakPolarHBondContact CB-OD1 3Å; N82-D173 PolarHBondContact N-OD1 3.13Å; N82-D173 PolarHBondContact ND2-OD1 3.19Å; N82-G174 VanDerWaalsContact O-CA 3.32Å; N82-G174 WeakPolarHBondContact O-CA 3.4Å; N82-G174 PolarHBondContact O-N 3.44Å; N82-I175 PolarHBondContact O-N 3.44Å
83	V	97.1	Very high	85.1	Confident	1 Å²	1	76 Å²	76	1%	0.006	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	135.1	177.8	-179.4	0	0	0	0	108.8	Y85 V95 A97 L106 L168 I175 L177	V83-Y85 HydrophobicContact CB-CE2 4.3Å; V83-Y85 HydrophobicContact CG1-CD2 4.01Å; V83-Y85 HydrophobicContact CG1-CE2 3.48Å; V83-Y85 VanDerWaalsContact CG1-CE2 3.48Å; V83-V95 PolarHBondContact N-O 3.18Å; V83-V95 PolarHBondContact O-N 2.94Å; V83-V95 VanDerWaalsContact O-O 3.12Å; V83-A97 HydrophobicContact CG2-CB 4.15Å; V83-L106 HydrophobicContact CB-CD2 4.17Å; V83-L106 HydrophobicContact CG1-CD2 4.4Å; V83-L106 HydrophobicContact CG2-CD2 3.97Å; V83-L168 HydrophobicContact CG2-CD1 3.68Å; V83-L168 HydrophobicContact CG2-CD2 3.82Å; V83-L168 HydrophobicContact CG2-CG 4.45Å; V83-I175 HydrophobicContact CB-CG2 4.24Å; V83-I175 HydrophobicContact CG1-CG2 4.03Å; V83-I175 HydrophobicContact CG2-CG2 3.85Å; V83-L177 HydrophobicContact CG1-CD1 4.02Å
84	V	97.6	Very high	87.3	Confident	22 Å²	22	74.6 Å²	74.6	13%	0.133	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	117.7	176.9	-176.3	0	0	0	0	109.7	R92 I175 E176 L177	V84-R92 HydrophobicContact CG1-CB 4.13Å; V84-I175 PolarHBondContact N-O 3.46Å; V84-E176 HydrophobicContact CB-CG 4.2Å; V84-E176 CarbonylContact O-C 3.57Å; V84-E176 WeakPolarHBondContact O-CA 3.38Å; V84-L177 PolarHBondContact O-N 2.93Å
85	Y	97.9	Very high	89.4	Confident	0 Å²	0	71 Å²	71	0%	0	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	135.2	171.8	-66.2	-90	0	0	0	110.4	V83 R92 I93 V95 I103 L106 A107 I112 L177 L179	V83-Y85 HydrophobicContact CB-CE2 4.3Å; V83-Y85 HydrophobicContact CG1-CD2 4.01Å; V83-Y85 HydrophobicContact CG1-CE2 3.48Å; V83-Y85 VanDerWaalsContact CG1-CE2 3.48Å; Y85-R92 CarbonylContact O-C 3.59Å; Y85-R92 WeakPolarHBondContact O-CA 3.42Å; Y85-I93 PolarHBondContact N-O 2.79Å; Y85-I93 PolarHBondContact O-N 2.93Å; Y85-V95 HydrophobicContact CD2-CB 4.4Å; Y85-V95 HydrophobicContact CD2-CG2 3.97Å; Y85-V95 HydrophobicContact CE2-CB 4.3Å; Y85-V95 HydrophobicContact CE2-CG2 4.19Å; Y85-I103 HydrophobicContact CE1-CG2 4.11Å; Y85-I103 PolarHBondContact OH-O 3.13Å; Y85-L106 HydrophobicContact CE2-CD2 4.2Å; Y85-A107 HydrophobicContact CE1-CB 3.99Å; Y85-I112 HydrophobicContact CD1-CD1 4.18Å; Y85-I112 HydrophobicContact CD1-CG2 4.33Å; Y85-I112 HydrophobicContact CD2-CD1 3.18Å; Y85-I112 HydrophobicContact CD2-CG1 4.47Å; Y85-I112 HydrophobicContact CE2-CD1 3.62Å; Y85-I112 HydrophobicContact CG-CD1 3.48Å; Y85-I112 VanDerWaalsContact CG-CD1 3.48Å; Y85-I112 HydrophobicContact CG-CG1 4.42Å; Y85-I112 HydrophobicContact CG-CG2 4.37Å; Y85-L177 CarbonylContact C-O 3.52Å; Y85-L177 WeakPolarHBondContact CA-O 3.1Å; Y85-L177 HydrophobicContact CD1-CB 4.16Å; Y85-L177 HydrophobicContact CD1-CD1 4.27Å; Y85-L177 HydrophobicContact CE1-CB 4.38Å; Y85-L177 HydrophobicContact CE1-CD1 3.7Å; Y85-L179 HydrophobicContact CD1-CD1 4.07Å
86	I	97.1	Very high	91.2	Very high	32 Å²	32	70.8 Å²	70.8	16%	0.164	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	106.9	170.5	-50.4	-172.6	0	0	0	106.6	K91 R92 L177 T178 L179	I86-K91 WeakPolarHBondContact CA-O 3.41Å; I86-R92 HydrophobicContact CD1-CG 4.48Å; I86-R92 HydrophobicContact CG1-CG 4.23Å; I86-L177 PolarHBondContact N-O 2.92Å; I86-T178 HydrophobicContact CB-CG2 4.09Å; I86-T178 HydrophobicContact CG2-CG2 4.22Å; I86-L179 PolarHBondContact O-N 3.08Å
87	D	95	Very high	92.6	Very high	34 Å²	34	65.9 Å²	65.9	18%	0.182	36%	0.356	C	S	.	.			trans	-65.3	167.4	-179.1	-176.2	32.2	0	0	0	111.7	S89 G90 K91 I93	D87-S89 PolarHBondContact O-N 3.26Å; D87-G90 WeakPolarHBondContact O-CA 3.25Å; D87-G90 PolarHBondContact O-N 2.92Å; D87-K91 HydrophobicContact CB-CB 4.4Å; D87-K91 PolarHBondContact N-O 3.37Å; D87-I93 HydrophobicContact CB-CD1 4.16Å
88	R	93.4	Very high	93.9	Very high	67 Å²	67	65 Å²	65	25%	0.253	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-26.3	178.1	-48.7	-175.7	-164.7	-161.5	4.7	112.5	G90 D113 E115 L179 T183	R88-G90 VanDerWaalsContact C-N 3.3Å; R88-D113 IonicContact CZ-OD2 3.4Å; R88-D113 IonicContact NE-OD2 3.64Å; R88-D113 PolarHBondContact NE-OD2 3.28Å; R88-D113 PolarHBondContact NH2-O 2.83Å; R88-D113 IonicContact NH2-OD2 3.63Å; R88-D113 PolarHBondContact NH2-OD2 3.35Å; R88-E115 IonicContact CZ-OE1 3.32Å; R88-E115 IonicContact NH1-OE1 2.93Å; R88-E115 IonicContact NH2-OE1 2.76Å; R88-E115 PolarHBondContact NH2-OE1 3.16Å; R88-L179 HydrophobicContact CG-CB 4.22Å; R88-T183 PolarHBondContact NH1-OG1 3.24Å; R88-T183 VanDerWaalsContact NH1-OG1 3.15Å
89	S	93.3	Very high	95.1	Very high	105 Å²	105	60.4 Å²	60.4	73%	0.734	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-6.3	174.9	-52.7	0	0	0	0	114.1	D87 K91	D87-S89 PolarHBondContact O-N 3.26Å; S89-K91 VanDerWaalsContact C-N 3.34Å
90	G	93.9	Very high	95.5	Very high	50 Å²	50	59.1 Å²	59.1	52%	0.515	32%	0.323	S	S	.	.	S	Bend	trans	82.6	6.3	-172.6	0	0	0	0	0	114.5	D87 R88	D87-G90 WeakPolarHBondContact O-CA 3.25Å; D87-G90 PolarHBondContact O-N 2.92Å; R88-G90 VanDerWaalsContact C-N 3.3Å
91	K	95.9	Very high	95.6	Very high	138 Å²	138	58.1 Å²	58.1	60%	0.6	32%	0.316	S	S	*	.			trans	-74.5	128	178.5	-176.4	-174.7	175.2	-170.9	0	109.9	I86 D87 S89 I93	I86-K91 WeakPolarHBondContact CA-O 3.41Å; D87-K91 HydrophobicContact CB-CB 4.4Å; D87-K91 PolarHBondContact N-O 3.37Å; S89-K91 VanDerWaalsContact C-N 3.34Å; K91-I93 HydrophobicContact CD-CG1 4.39Å; K91-I93 HydrophobicContact CG-CG1 4.34Å
92	R	97	Very high	95.7	Very high	154 Å²	154	59 Å²	59	58%	0.581	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.2	127.1	173.1	-60.7	176.8	76.9	-158.2	5.4	110.1	V84 Y85 I86 E176	V84-R92 HydrophobicContact CG1-CB 4.13Å; Y85-R92 CarbonylContact O-C 3.59Å; Y85-R92 WeakPolarHBondContact O-CA 3.42Å; I86-R92 HydrophobicContact CD1-CG 4.48Å; I86-R92 HydrophobicContact CG1-CG 4.23Å; R92-E176 IonicContact CZ-OE1 3Å; R92-E176 IonicContact NH2-OE1 2.77Å; R92-E176 PolarHBondContact NH2-OE1 3.4Å
93	I	97.1	Very high	95.7	Very high	42 Å²	42	55.7 Å²	55.7	22%	0.215	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	97.9	-177.5	-55	172	0	0	0	107.2	Y85 D87 K91 V95 I112	Y85-I93 PolarHBondContact N-O 2.79Å; Y85-I93 PolarHBondContact O-N 2.93Å; D87-I93 HydrophobicContact CB-CD1 4.16Å; K91-I93 HydrophobicContact CD-CG1 4.39Å; K91-I93 HydrophobicContact CG-CG1 4.34Å; I93-V95 HydrophobicContact CG2-CG2 4.26Å; I93-I112 HydrophobicContact CD1-CG1 4.23Å; I93-I112 HydrophobicContact CG2-CD1 4.45Å; I93-I112 HydrophobicContact CG2-CG1 4.34Å
94	P	96.9	Very high	95.7	Very high	106 Å²	106	55.7 Å²	55.7	69%	0.688	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.5	135	176.3	30.9	-33	0	0	0	110.4
95	V	96.1	Very high	95.6	Very high	6 Å²	6	59.6 Å²	59.6	4%	0.036	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	142.2	-177	174.7	0	0	0	0	108.8	V83 Y85 I93 L106 H110 I112	V83-V95 PolarHBondContact N-O 3.18Å; V83-V95 PolarHBondContact O-N 2.94Å; V83-V95 VanDerWaalsContact O-O 3.12Å; Y85-V95 HydrophobicContact CD2-CB 4.4Å; Y85-V95 HydrophobicContact CD2-CG2 3.97Å; Y85-V95 HydrophobicContact CE2-CB 4.3Å; Y85-V95 HydrophobicContact CE2-CG2 4.19Å; I93-V95 HydrophobicContact CG2-CG2 4.26Å; V95-L106 HydrophobicContact CG1-CD1 3.75Å; V95-L106 HydrophobicContact CG1-CD2 4Å; V95-L106 HydrophobicContact CG1-CG 3.85Å; V95-H110 HydrophobicContact CG1-CB 4.43Å; V95-H110 WeakPolarHBondContact CG1-CD2 3.35Å; V95-H110 WeakPolarHBondContact CG1-NE2 3.32Å; V95-H110 HydrophobicContact CG2-CB 4Å; V95-I112 HydrophobicContact CG2-CD1 3.96Å
96	K	95.3	Very high	95.5	Very high	155 Å²	155	59.9 Å²	59.9	67%	0.674	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.8	131.7	171.1	-65.3	-174.8	176.6	-170.9	0	108.9	V80	V80-K96 HydrophobicContact CG1-CB 4.26Å; V80-K96 HydrophobicContact CG1-CD 4.49Å
97	A	95.1	Very high	95.5	Very high	3 Å²	3	58.3 Å²	58.3	3%	0.025	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	164.9	-179	0	0	0	0	0	110.4	V80 V81 V83 D101 L106 L168	V80-A97 WeakPolarHBondContact CA-O 3.2Å; V81-A97 PolarHBondContact N-O 3.46Å; V81-A97 PolarHBondContact O-N 2.92Å; V83-A97 HydrophobicContact CG2-CB 4.15Å; A97-D101 HydrophobicContact CB-CB 4.46Å; A97-L106 HydrophobicContact CB-CD1 3.81Å; A97-L106 HydrophobicContact CB-CD2 3.47Å; A97-L106 VanDerWaalsContact CB-CD2 3.47Å; A97-L106 HydrophobicContact CB-CG 4.29Å; A97-L168 HydrophobicContact CB-CD1 3.26Å
98	K	94.3	Very high	95.4	Very high	84 Å²	84	58.9 Å²	58.9	37%	0.365	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	151.5	169.3	-64.4	-173.7	177.6	-172.7	0	109.9	E75 D79 G100 D101	E75-K98 WeakPolarHBondContact OE1-CE 3.38Å; E75-K98 IonicContact OE1-NZ 2.74Å; E75-K98 PolarHBondContact OE1-NZ 3.46Å; D79-K98 CarbonylContact O-C 3.54Å; D79-K98 WeakPolarHBondContact O-CA 3.44Å; K98-G100 PolarHBondContact O-N 2.92Å; K98-D101 PolarHBondContact N-OD2 3.02Å; K98-D101 VanDerWaalsContact O-CB 3.3Å; K98-D101 WeakPolarHBondContact O-CB 3.49Å; K98-D101 PolarHBondContact O-N 3.43Å
99	V	94.9	Very high	95.5	Very high	52 Å²	52	63.4 Å²	63.4	32%	0.315	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	134.4	165.4	176.3	0	0	0	0	108.7	D79 V81 P170	D79-V99 HydrophobicContact CB-CG2 4.41Å; D79-V99 PolarHBondContact O-N 3.15Å; V81-V99 HydrophobicContact CG2-CG2 3.53Å; V99-P170 HydrophobicContact CG2-CB 4.37Å
100	G	94.7	Very high	95.5	Very high	46 Å²	46	62.6 Å²	62.6	47%	0.474	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.1	-10.2	-175.3	0	0	0	0	0	114.8	K98 L168	K98-G100 PolarHBondContact O-N 2.92Å; G100-L168 PolarHBondContact N-O 2.95Å
101	D	95.4	Very high	95.4	Very high	52 Å²	52	63.5 Å²	63.5	28%	0.278	33%	0.326	S	S	.	.			trans	-67	143.3	175.2	-79	-18.9	0	0	0	111	A97 K98 L168	A97-D101 HydrophobicContact CB-CB 4.46Å; K98-D101 PolarHBondContact N-OD2 3.02Å; K98-D101 VanDerWaalsContact O-CB 3.3Å; K98-D101 WeakPolarHBondContact O-CB 3.49Å; K98-D101 PolarHBondContact O-N 3.43Å; D101-L168 HydrophobicContact CB-CD1 4.13Å; D101-L168 WeakPolarHBondContact O-CG 3.32Å; D101-L168 PolarHBondContact O-N 3.47Å
102	N	96.4	Very high	95.4	Very high	21 Å²	21	57.4 Å²	57.4	11%	0.112	30%	0.3	C	S	.	.	B	Isolated β-bridge	trans	-84.5	134.2	172.4	-171.7	-76.2	0	0	0	110.4	L104 Y105 L106 C164 I167	N102-L104 VanDerWaalsContact C-N 3.34Å; N102-L104 PolarHBondContact O-N 2.75Å; N102-L104 VanDerWaalsContact OD1-CB 3.29Å; N102-L104 WeakPolarHBondContact OD1-CB 3.36Å; N102-L104 PolarHBondContact OD1-N 3.37Å; N102-Y105 HydrophobicContact CB-CD2 3.67Å; N102-Y105 HydrophobicContact CB-CE2 4.46Å; N102-Y105 HydrophobicContact CB-CG 4.44Å; N102-Y105 PolarHBondContact O-N 2.85Å; N102-L106 VanDerWaalsContact O-CB 3.27Å; N102-L106 WeakPolarHBondContact O-CB 3.44Å; N102-L106 PolarHBondContact O-N 2.95Å; N102-C164 PolarHBondContact ND2-O 2.9Å; N102-I167 HydrophobicContact CB-CD1 4.16Å
103	I	96.2	Very high	95.1	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-60.9	-39.2	-178.8	-87.5	156.5	0	0	0	113	Y85 L106 A107 G163 I166 L168 L177	Y85-I103 HydrophobicContact CE1-CG2 4.11Å; Y85-I103 PolarHBondContact OH-O 3.13Å; I103-L106 PolarHBondContact O-N 3.09Å; I103-A107 WeakPolarHBondContact O-CB 3.38Å; I103-A107 PolarHBondContact O-N 3.23Å; I103-G163 WeakPolarHBondContact CB-O 3.25Å; I103-I166 HydrophobicContact CD1-CB 3.59Å; I103-I166 HydrophobicContact CD1-CD1 4.22Å; I103-I166 HydrophobicContact CD1-CG2 3.37Å; I103-I166 PolarHBondContact N-O 3.37Å; I103-L168 HydrophobicContact CD1-CD2 3.89Å; I103-L168 HydrophobicContact CG1-CD2 3.99Å; I103-L168 HydrophobicContact CG1-CG 4.3Å; I103-L177 HydrophobicContact CB-CD1 4.31Å; I103-L177 HydrophobicContact CD1-CD1 3.63Å; I103-L177 HydrophobicContact CG1-CD1 3.78Å; I103-L177 HydrophobicContact CG2-CD1 3.52Å
104	L	96.6	Very high	95	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-62.7	-51.4	178.5	177.2	62.6	0	0	0	111.3	N102 L106 A107 H108 L114 E115 A120 C127 C164	N102-L104 VanDerWaalsContact C-N 3.34Å; N102-L104 PolarHBondContact O-N 2.75Å; N102-L104 VanDerWaalsContact OD1-CB 3.29Å; N102-L104 WeakPolarHBondContact OD1-CB 3.36Å; N102-L104 PolarHBondContact OD1-N 3.37Å; L104-L106 VanDerWaalsContact C-N 3.31Å; L104-L106 PolarHBondContact O-N 2.92Å; L104-A107 WeakPolarHBondContact O-CB 3.35Å; L104-A107 PolarHBondContact O-N 3.38Å; L104-H108 WeakPolarHBondContact CD1-NE2 3.27Å; L104-H108 PolarHBondContact O-N 3.16Å; L104-H108 VanDerWaalsContact O-N 3.08Å; L104-L114 HydrophobicContact CD1-CD2 3.95Å; L104-L114 HydrophobicContact CD1-CG 3.97Å; L104-E115 WeakPolarHBondContact CD1-O 3.3Å; L104-A120 HydrophobicContact CD2-CB 4.42Å; L104-C127 HydrophobicContact CD1-CB 3.98Å; L104-C127 HydrophobicContact CD2-CB 4.26Å; L104-C164 HydrophobicContact CB-CB 4.07Å; L104-C164 HydrophobicContact CD2-CB 3.76Å
105	Y	95.8	Very high	94.8	Very high	104 Å²	104	48.4 Å²	48.4	41%	0.408	26%	0.257	S	S	.	.	H	α-helix	trans	-66.4	-35.4	-179.6	-65.3	-52.3	0	0	0	112.1	N102 A107 H108 K109 E119 A120	N102-Y105 HydrophobicContact CB-CD2 3.67Å; N102-Y105 HydrophobicContact CB-CE2 4.46Å; N102-Y105 HydrophobicContact CB-CG 4.44Å; N102-Y105 PolarHBondContact O-N 2.85Å; Y105-A107 VanDerWaalsContact C-N 3.35Å; Y105-H108 PolarHBondContact O-N 3.35Å; Y105-K109 WeakPolarHBondContact O-CB 3.3Å; Y105-K109 PolarHBondContact O-N 3.2Å; Y105-E119 PolarHBondContact OH-O 3.03Å; Y105-E119 VanDerWaalsContact OH-O 3.11Å; Y105-A120 HydrophobicContact CE2-CB 4.24Å
106	L	95.9	Very high	94.6	Very high	5 Å²	5	48.8 Å²	48.8	3%	0.026	26%	0.263	C	S	.	.	H	α-helix	trans	-61	-44.5	172.7	-176.7	70.8	0	0	0	111.2	V83 Y85 V95 A97 N102 I103 L104 H108 K109 H110 L168	V83-L106 HydrophobicContact CB-CD2 4.17Å; V83-L106 HydrophobicContact CG1-CD2 4.4Å; V83-L106 HydrophobicContact CG2-CD2 3.97Å; Y85-L106 HydrophobicContact CE2-CD2 4.2Å; V95-L106 HydrophobicContact CG1-CD1 3.75Å; V95-L106 HydrophobicContact CG1-CD2 4Å; V95-L106 HydrophobicContact CG1-CG 3.85Å; A97-L106 HydrophobicContact CB-CD1 3.81Å; A97-L106 HydrophobicContact CB-CD2 3.47Å; A97-L106 VanDerWaalsContact CB-CD2 3.47Å; A97-L106 HydrophobicContact CB-CG 4.29Å; N102-L106 VanDerWaalsContact O-CB 3.27Å; N102-L106 WeakPolarHBondContact O-CB 3.44Å; N102-L106 PolarHBondContact O-N 2.95Å; I103-L106 PolarHBondContact O-N 3.09Å; L104-L106 VanDerWaalsContact C-N 3.31Å; L104-L106 PolarHBondContact O-N 2.92Å; L106-H108 VanDerWaalsContact C-N 3.35Å; L106-H108 PolarHBondContact O-N 3.06Å; L106-K109 PolarHBondContact O-N 3.46Å; L106-H110 PolarHBondContact O-CD2 3.4Å; L106-H110 VanDerWaalsContact O-CD2 3.26Å; L106-H110 PolarHBondContact O-N 3.44Å; L106-H110 VanDerWaalsContact O-N 3.16Å; L106-L168 HydrophobicContact CD2-CD1 4.02Å
107	A	95.6	Very high	94.5	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-59.4	-46.1	176.8	0	0	0	0	0	111.5	Y85 I103 L104 Y105 H110 G111 I112 L114	Y85-A107 HydrophobicContact CE1-CB 3.99Å; I103-A107 WeakPolarHBondContact O-CB 3.38Å; I103-A107 PolarHBondContact O-N 3.23Å; L104-A107 WeakPolarHBondContact O-CB 3.35Å; L104-A107 PolarHBondContact O-N 3.38Å; Y105-A107 VanDerWaalsContact C-N 3.35Å; A107-H110 CarbonylContact O-C 3.41Å; A107-H110 PolarHBondContact O-N 3.11Å; A107-G111 PolarHBondContact O-N 3.14Å; A107-G111 VanDerWaalsContact O-N 3.13Å; A107-I112 HydrophobicContact CB-CB 4.03Å; A107-I112 HydrophobicContact CB-CD1 4.33Å; A107-I112 HydrophobicContact CB-CG2 4.26Å; A107-I112 WeakPolarHBondContact O-CB 3.44Å; A107-I112 PolarHBondContact O-N 3.17Å; A107-L114 HydrophobicContact CB-CB 3.82Å; A107-L114 HydrophobicContact CB-CD2 3.77Å; A107-L114 HydrophobicContact CB-CG 4.41Å
108	H	94.6	Very high	94.4	Very high	45 Å²	45	45 Å²	45	21%	0.208	26%	0.259	C	S	.	.	H	α-helix	trans	-62.7	-44.3	177.9	-66.5	172.8	0	0	0	112.5	L104 Y105 L106 H110 G111 L114 P195	L104-H108 WeakPolarHBondContact CD1-NE2 3.27Å; L104-H108 PolarHBondContact O-N 3.16Å; L104-H108 VanDerWaalsContact O-N 3.08Å; Y105-H108 PolarHBondContact O-N 3.35Å; L106-H108 VanDerWaalsContact C-N 3.35Å; L106-H108 PolarHBondContact O-N 3.06Å; H108-H110 PolarHBondContact O-N 3.16Å; H108-G111 PolarHBondContact O-N 3.47Å; H108-G111 VanDerWaalsContact O-N 3.08Å; H108-L114 PolarHBondContact CD2-O 3.18Å; H108-L114 VanDerWaalsContact CD2-O 3.28Å; H108-L114 PolarHBondContact NE2-O 2.88Å; H108-P195 HydrophobicContact CB-CB 4.22Å; H108-P195 HydrophobicContact CB-CG 4.09Å; H108-P195 WeakPolarHBondContact ND1-CB 3.49Å
109	K	94.4	Very high	94.3	Very high	163 Å²	163	45.6 Å²	45.6	71%	0.709	26%	0.263	S	S	*	.	H	α-helix	trans	-58.2	-33.8	177.1	-176.7	179.9	179.3	-178	0	112.8	Y105 L106	Y105-K109 WeakPolarHBondContact O-CB 3.3Å; Y105-K109 PolarHBondContact O-N 3.2Å; L106-K109 PolarHBondContact O-N 3.46Å
110	H	94.1	Very high	94.3	Very high	87 Å²	87	44.3 Å²	44.3	40%	0.403	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	6.4	-179.8	-73.3	-83.2	0	0	0	113.9	V95 L106 A107 H108 I112	V95-H110 HydrophobicContact CG1-CB 4.43Å; V95-H110 WeakPolarHBondContact CG1-CD2 3.35Å; V95-H110 WeakPolarHBondContact CG1-NE2 3.32Å; V95-H110 HydrophobicContact CG2-CB 4Å; L106-H110 PolarHBondContact O-CD2 3.4Å; L106-H110 VanDerWaalsContact O-CD2 3.26Å; L106-H110 PolarHBondContact O-N 3.44Å; L106-H110 VanDerWaalsContact O-N 3.16Å; A107-H110 CarbonylContact O-C 3.41Å; A107-H110 PolarHBondContact O-N 3.11Å; H108-H110 PolarHBondContact O-N 3.16Å; H110-I112 VanDerWaalsContact C-N 3.31Å; H110-I112 HydrophobicContact CB-CD1 4.09Å; H110-I112 PolarHBondContact O-N 3.06Å
111	G	92.2	Very high	94.3	Very high	70 Å²	70	46.3 Å²	46.3	72%	0.722	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.8	27.7	176.6	0	0	0	0	0	114	A107 H108	A107-G111 PolarHBondContact O-N 3.14Å; A107-G111 VanDerWaalsContact O-N 3.13Å; H108-G111 PolarHBondContact O-N 3.47Å; H108-G111 VanDerWaalsContact O-N 3.08Å
112	I	94.1	Very high	94.2	Very high	9 Å²	9	45.6 Å²	45.6	5%	0.046	26%	0.26	C	S	.	.			trans	-80.4	136.5	172.8	-65.5	150.9	0	0	0	108.3	Y85 I93 V95 A107 H110 L114 L179	Y85-I112 HydrophobicContact CD1-CD1 4.18Å; Y85-I112 HydrophobicContact CD1-CG2 4.33Å; Y85-I112 HydrophobicContact CD2-CD1 3.18Å; Y85-I112 HydrophobicContact CD2-CG1 4.47Å; Y85-I112 HydrophobicContact CE2-CD1 3.62Å; Y85-I112 HydrophobicContact CG-CD1 3.48Å; Y85-I112 VanDerWaalsContact CG-CD1 3.48Å; Y85-I112 HydrophobicContact CG-CG1 4.42Å; Y85-I112 HydrophobicContact CG-CG2 4.37Å; I93-I112 HydrophobicContact CD1-CG1 4.23Å; I93-I112 HydrophobicContact CG2-CD1 4.45Å; I93-I112 HydrophobicContact CG2-CG1 4.34Å; V95-I112 HydrophobicContact CG2-CD1 3.96Å; A107-I112 HydrophobicContact CB-CB 4.03Å; A107-I112 HydrophobicContact CB-CD1 4.33Å; A107-I112 HydrophobicContact CB-CG2 4.26Å; A107-I112 WeakPolarHBondContact O-CB 3.44Å; A107-I112 PolarHBondContact O-N 3.17Å; H110-I112 VanDerWaalsContact C-N 3.31Å; H110-I112 HydrophobicContact CB-CD1 4.09Å; H110-I112 PolarHBondContact O-N 3.06Å; I112-L114 HydrophobicContact CG2-CB 4.34Å; I112-L114 PolarHBondContact O-N 3.08Å; I112-L179 HydrophobicContact CG2-CD1 4.32Å; I112-L179 HydrophobicContact CG2-CD2 3.93Å
113	D	92.3	Very high	94.1	Very high	88 Å²	88	48 Å²	48	47%	0.471	28%	0.283	S	S	.	.			trans	-77.9	47.5	-177.1	-170.7	41.9	0	0	0	113	R88	R88-D113 IonicContact CZ-OD2 3.4Å; R88-D113 IonicContact NE-OD2 3.64Å; R88-D113 PolarHBondContact NE-OD2 3.28Å; R88-D113 PolarHBondContact NH2-O 2.83Å; R88-D113 IonicContact NH2-OD2 3.63Å; R88-D113 PolarHBondContact NH2-OD2 3.35Å
114	L	94.1	Very high	94	Very high	6 Å²	6	49 Å²	49	3%	0.031	29%	0.29	C	S	.	.			trans	-88.6	121	170.7	-177.8	61.8	0	0	0	108.5	L104 A107 H108 I112 V129 L179	L104-L114 HydrophobicContact CD1-CD2 3.95Å; L104-L114 HydrophobicContact CD1-CG 3.97Å; A107-L114 HydrophobicContact CB-CB 3.82Å; A107-L114 HydrophobicContact CB-CD2 3.77Å; A107-L114 HydrophobicContact CB-CG 4.41Å; H108-L114 PolarHBondContact CD2-O 3.18Å; H108-L114 VanDerWaalsContact CD2-O 3.28Å; H108-L114 PolarHBondContact NE2-O 2.88Å; I112-L114 HydrophobicContact CG2-CB 4.34Å; I112-L114 PolarHBondContact O-N 3.08Å; L114-V129 HydrophobicContact CD1-CG1 3.64Å; L114-V129 HydrophobicContact CD2-CG1 4.08Å; L114-L179 HydrophobicContact CB-CD2 4.24Å; L114-L179 HydrophobicContact CD1-CG 4.22Å
115	E	92.1	Very high	94	Very high	19 Å²	19	49.5 Å²	49.5	9%	0.089	29%	0.293	C	S	.	.			trans	-78.3	155.4	-178.9	-66.8	179.3	-135.2	0	0	111.7	R88 L104 T126 C127 T183 N185 Y187	R88-E115 IonicContact CZ-OE1 3.32Å; R88-E115 IonicContact NH1-OE1 2.93Å; R88-E115 IonicContact NH2-OE1 2.76Å; R88-E115 PolarHBondContact NH2-OE1 3.16Å; L104-E115 WeakPolarHBondContact CD1-O 3.3Å; E115-T126 CarbonylContact O-C 3.5Å; E115-C127 WeakPolarHBondContact O-CA 3.28Å; E115-C127 WeakPolarHBondContact O-CB 3.45Å; E115-C127 PolarHBondContact O-N 2.9Å; E115-T183 WeakPolarHBondContact OE1-CB 3.36Å; E115-T183 PolarHBondContact OE1-OG1 3.49Å; E115-N185 WeakPolarHBondContact OE2-CB 3.49Å; E115-N185 PolarHBondContact OE2-ND2 3.3Å; E115-Y187 PolarHBondContact OE2-OH 2.87Å
116	G	92.6	Very high	93.9	Very high	15 Å²	15	44.7 Å²	44.7	16%	0.155	28%	0.275	C	S	.	.			trans	-157.6	54.2	-176.1	0	0	0	0	0	112.2	C118 E119	G116-C118 PolarHBondContact O-N 2.88Å; G116-C118 VanDerWaalsContact O-N 3.13Å; G116-E119 PolarHBondContact O-N 3.48Å
117	A	92.4	Very high	93.9	Very high	58 Å²	58	44.5 Å²	44.5	48%	0.479	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-27.5	-169.5	0	0	0	0	0	114.8	T126	A117-T126 HydrophobicContact CB-CG2 4.08Å; A117-T126 PolarHBondContact N-OG1 2.77Å
118	C	93.6	Very high	94	Very high	20 Å²	20	44.6 Å²	44.6	14%	0.135	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	5.5	177.1	78	0	0	0	0	114.2	G116 A120 S121 A123 C124	G116-C118 PolarHBondContact O-N 2.88Å; G116-C118 VanDerWaalsContact O-N 3.13Å; C118-A120 PolarHBondContact O-N 2.89Å; C118-S121 WeakPolarHBondContact O-CB 3.38Å; C118-S121 PolarHBondContact O-N 2.66Å; C118-S121 PolarHBondContact O-OG 3.44Å; C118-A123 HydrophobicContact CB-CB 3.9Å; C118-A123 PolarHBondContact SG-N 2.85Å; C118-C124 HydrophobicContact CB-CB 4.13Å; C118-C124 PolarHBondContact SG-SG 3.48Å
119	E	92.9	Very high	94.1	Very high	97 Å²	97	42.4 Å²	42.4	45%	0.453	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.3	47.6	170.9	-44.8	-179.7	157.9	0	0	111.8	Y105 G116 S121 H196	Y105-E119 PolarHBondContact OH-O 3.03Å; Y105-E119 VanDerWaalsContact OH-O 3.11Å; G116-E119 PolarHBondContact O-N 3.48Å; E119-S121 PolarHBondContact O-N 2.85Å; E119-S121 VanDerWaalsContact O-N 3.17Å; E119-H196 VanDerWaalsContact CD-ND1 3.29Å; E119-H196 WeakPolarHBondContact CG-CE1 3.39Å; E119-H196 IonicContact OE1-CE1 2.65Å; E119-H196 PolarHBondContact OE1-CE1 3.12Å; E119-H196 IonicContact OE1-CG 3.91Å; E119-H196 IonicContact OE1-ND1 3.33Å; E119-H196 PolarHBondContact OE1-ND1 2.85Å; E119-H196 IonicContact OE2-CE1 3.45Å; E119-H196 PolarHBondContact OE2-CE1 3.35Å; E119-H196 IonicContact OE2-ND1 3.46Å; E119-H196 IonicContact OE2-NE2 3.68Å
120	A	93.9	Very high	94.2	Very high	25 Å²	25	35.5 Å²	35.5	21%	0.207	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.7	13.7	-176.4	0	0	0	0	0	116.8	L104 Y105 C118 L122 C164	L104-A120 HydrophobicContact CD2-CB 4.42Å; Y105-A120 HydrophobicContact CE2-CB 4.24Å; C118-A120 PolarHBondContact O-N 2.89Å; A120-L122 PolarHBondContact O-N 3.46Å; A120-L122 VanDerWaalsContact O-N 3.11Å; A120-C164 HydrophobicContact CB-CB 3.68Å
121	S	94.2	Very high	94.4	Very high	88 Å²	88	31.4 Å²	31.4	62%	0.615	22%	0.215	S	C	*	.	S	Bend	trans	-77.6	13.8	179.6	-56.1	0	0	0	0	115.5	C118 E119 A123	C118-S121 WeakPolarHBondContact O-CB 3.38Å; C118-S121 PolarHBondContact O-N 2.66Å; C118-S121 PolarHBondContact O-OG 3.44Å; E119-S121 PolarHBondContact O-N 2.85Å; E119-S121 VanDerWaalsContact O-N 3.17Å; S121-A123 PolarHBondContact O-N 3.48Å; S121-A123 VanDerWaalsContact O-N 3.14Å
122	L	94.4	Very high	94.6	Very high	37 Å²	37	30.5 Å²	30.5	19%	0.194	19%	0.194	C	C	.	.	S	Bend	trans	50.6	36.2	-176.7	-163.1	62.1	0	0	0	113.8	A120 R145 E146 L162 Q165	A120-L122 PolarHBondContact O-N 3.46Å; A120-L122 VanDerWaalsContact O-N 3.11Å; L122-R145 HydrophobicContact CD2-CB 3.71Å; L122-E146 HydrophobicContact CD1-CB 4.37Å; L122-L162 HydrophobicContact CD1-CD1 3.64Å; L122-Q165 HydrophobicContact CD1-CG 3.83Å
123	A	94.7	Very high	94.5	Very high	70 Å²	70	34.2 Å²	34.2	58%	0.579	22%	0.22	S	C	*	.	S	Bend	trans	-116.1	4.1	-176.4	0	0	0	0	0	113.5	C118 S121	C118-A123 HydrophobicContact CB-CB 3.9Å; C118-A123 PolarHBondContact SG-N 2.85Å; S121-A123 PolarHBondContact O-N 3.48Å; S121-A123 VanDerWaalsContact O-N 3.14Å
124	C	93.9	Very high	94.5	Very high	22 Å²	22	33 Å²	33	15%	0.149	22%	0.222	C	C	.	.			trans	-155.2	167.4	176.1	78.3	0	0	0	0	110.9	C118 T126	C118-C124 HydrophobicContact CB-CB 4.13Å; C118-C124 PolarHBondContact SG-SG 3.48Å; C124-T126 HydrophobicContact CB-CG2 4.47Å; C124-T126 PolarHBondContact SG-OG1 3.33Å
125	S	95.3	Very high	94.5	Very high	11 Å²	11	33.6 Å²	33.6	8%	0.077	23%	0.225	C	C	.	.	S	Bend	trans	-110.9	22.4	176	50.9	0	0	0	0	113.9	C127 H128 M149	S125-C127 VanDerWaalsContact C-N 3.26Å; S125-C127 PolarHBondContact O-N 3.46Å; S125-H128 VanDerWaalsContact O-CB 3.26Å; S125-H128 WeakPolarHBondContact O-CB 3.41Å; S125-H128 PolarHBondContact O-N 3.15Å; S125-M149 VanDerWaalsContact CB-O 3.24Å; S125-M149 WeakPolarHBondContact CB-O 3.42Å; S125-M149 PolarHBondContact OG-O 2.77Å
126	T	95.1	Very high	94.6	Very high	4 Å²	4	35 Å²	35	3%	0.025	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-22.3	179.6	59.6	0	0	0	0	113.5	E115 A117 C124 H128 N185	E115-T126 CarbonylContact O-C 3.5Å; A117-T126 HydrophobicContact CB-CG2 4.08Å; A117-T126 PolarHBondContact N-OG1 2.77Å; C124-T126 HydrophobicContact CB-CG2 4.47Å; C124-T126 PolarHBondContact SG-OG1 3.33Å; T126-H128 VanDerWaalsContact C-N 3.27Å; T126-H128 PolarHBondContact O-N 3.03Å; T126-N185 HydrophobicContact CG2-CB 3.99Å
127	C	95.9	Very high	94.6	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.007	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	16.1	175.9	64.3	0	0	0	0	113.7	L104 E115 S125 V129 G163 C164	L104-C127 HydrophobicContact CD1-CB 3.98Å; L104-C127 HydrophobicContact CD2-CB 4.26Å; E115-C127 WeakPolarHBondContact O-CA 3.28Å; E115-C127 WeakPolarHBondContact O-CB 3.45Å; E115-C127 PolarHBondContact O-N 2.9Å; S125-C127 VanDerWaalsContact C-N 3.26Å; S125-C127 PolarHBondContact O-N 3.46Å; C127-V129 PolarHBondContact O-N 2.93Å; C127-G163 PolarHBondContact O-N 3.32Å; C127-C164 HydrophobicContact CB-CB 4.35Å; C127-C164 PolarHBondContact SG-SG 2.76Å
128	H	96.8	Very high	94.7	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.005	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58	131.7	177.7	170	-135.7	0	0	0	111.2	S125 T126 Y130 A153 S160 P180	S125-H128 VanDerWaalsContact O-CB 3.26Å; S125-H128 WeakPolarHBondContact O-CB 3.41Å; S125-H128 PolarHBondContact O-N 3.15Å; T126-H128 VanDerWaalsContact C-N 3.27Å; T126-H128 PolarHBondContact O-N 3.03Å; H128-Y130 AromaticContact CE1-CE1 3.53Å; H128-Y130 AromaticContact CE1-CZ 3.68Å; H128-Y130 AromaticContact NE2-CD1 3.95Å; H128-Y130 AromaticContact NE2-CE1 3.54Å; H128-A153 HydrophobicContact CB-CB 4.29Å; H128-S160 WeakPolarHBondContact NE2-CB 3.29Å; H128-S160 PolarHBondContact NE2-OG 3Å; H128-P180 WeakPolarHBondContact O-CD 3.44Å; H128-P180 WeakPolarHBondContact O-CG 3.24Å
129	V	97.1	Very high	94.7	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	154.7	176.3	-65.7	0	0	0	0	110.2	L114 C127 S160 R161 I166 L177	L114-V129 HydrophobicContact CD1-CG1 3.64Å; L114-V129 HydrophobicContact CD2-CG1 4.08Å; C127-V129 PolarHBondContact O-N 2.93Å; V129-S160 WeakPolarHBondContact O-CA 3.41Å; V129-R161 PolarHBondContact N-O 3.34Å; V129-R161 PolarHBondContact O-N 2.78Å; V129-I166 HydrophobicContact CG2-CD1 4.45Å; V129-L177 HydrophobicContact CG2-CD2 4.36Å
130	Y	97.5	Very high	94.8	Very high	18 Å²	18	43.6 Å²	43.6	7%	0.071	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	123	168.7	-52.1	-67.1	0	0	0	109.9	H128 M155 Q157 S160 L177 T178 P180	H128-Y130 AromaticContact CE1-CE1 3.53Å; H128-Y130 AromaticContact CE1-CZ 3.68Å; H128-Y130 AromaticContact NE2-CD1 3.95Å; H128-Y130 AromaticContact NE2-CE1 3.54Å; Y130-M155 WeakPolarHBondContact CE1-O 3.36Å; Y130-M155 WeakPolarHBondContact OH-CB 3.39Å; Y130-M155 PolarHBondContact OH-O 3.11Å; Y130-Q157 HydrophobicContact CD1-CB 3.99Å; Y130-Q157 HydrophobicContact CD1-CG 4.17Å; Y130-Q157 HydrophobicContact CE1-CB 3.8Å; Y130-Q157 HydrophobicContact CE1-CG 3.62Å; Y130-Q157 VanDerWaalsContact CZ-NE2 3.34Å; Y130-S160 WeakPolarHBondContact CD1-OG 3.35Å; Y130-S160 WeakPolarHBondContact CE1-OG 3.38Å; Y130-L177 WeakPolarHBondContact O-CA 3.14Å; Y130-T178 HydrophobicContact CD2-CG2 4.37Å; Y130-T178 PolarHBondContact N-O 3.13Å; Y130-T178 PolarHBondContact O-N 2.83Å; Y130-P180 HydrophobicContact CE2-CB 3.88Å
131	V	97.3	Very high	94.7	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.006	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	138.9	176.4	-174	0	0	0	0	109.3	S133 H135 L136 L139 N159 R161 I166 I175 L177	V131-S133 PolarHBondContact O-N 3.3Å; V131-H135 HydrophobicContact CG1-CB 4.23Å; V131-L136 HydrophobicContact CB-CD1 4.27Å; V131-L139 HydrophobicContact CB-CD1 4.46Å; V131-L139 HydrophobicContact CG1-CD1 3.88Å; V131-L139 HydrophobicContact CG2-CD1 4.01Å; V131-N159 PolarHBondContact N-O 3.13Å; V131-N159 WeakPolarHBondContact O-CB 3.22Å; V131-N159 PolarHBondContact O-ND2 2.99Å; V131-R161 HydrophobicContact CG2-CB 4.02Å; V131-R161 HydrophobicContact CG2-CG 3.98Å; V131-I166 HydrophobicContact CG2-CD1 3.96Å; V131-I175 HydrophobicContact CG1-CD1 4.09Å; V131-I175 HydrophobicContact CG1-CG1 4.38Å; V131-L177 HydrophobicContact CB-CD2 4.39Å; V131-L177 HydrophobicContact CG1-CD2 4.37Å; V131-L177 HydrophobicContact CG2-CD2 3.9Å
132	N	95.7	Very high	94.7	Very high	51 Å²	51	48.7 Å²	48.7	27%	0.273	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-62.5	135	172.3	-175	-35.4	0	0	0	110.3	A134 H135 L136 E176	N132-A134 PolarHBondContact O-N 3.45Å; N132-A134 PolarHBondContact OD1-N 2.88Å; N132-A134 VanDerWaalsContact OD1-N 3.09Å; N132-H135 PolarHBondContact O-N 3.3Å; N132-L136 PolarHBondContact O-N 3.33Å; N132-E176 HydrophobicContact CB-CB 3.97Å; N132-E176 PolarHBondContact N-O 3.11Å; N132-E176 PolarHBondContact ND2-OE2 3.45Å
133	S	92.8	Very high	94.8	Very high	87 Å²	87	52.3 Å²	52.3	61%	0.608	30%	0.299	S	S	*	.	H	α-helix	trans	-54.1	-29.8	-178.1	52.5	0	0	0	0	113.6	V131 H135 L136	V131-S133 PolarHBondContact O-N 3.3Å; S133-H135 PolarHBondContact O-N 3.3Å; S133-H135 VanDerWaalsContact O-N 3.16Å; S133-L136 PolarHBondContact O-N 3.44Å
134	A	93.3	Very high	94.9	Very high	62 Å²	62	56.6 Å²	56.6	51%	0.512	31%	0.307	S	S	.	.	H	α-helix	trans	-62	-20.8	176.2	0	0	0	0	0	114.4	N132	N132-A134 PolarHBondContact O-N 3.45Å; N132-A134 PolarHBondContact OD1-N 2.88Å; N132-A134 VanDerWaalsContact OD1-N 3.09Å
135	H	94	Very high	94.9	Very high	19 Å²	19	63.5 Å²	63.5	9%	0.088	33%	0.33	C	S	.	.	H	α-helix	trans	-115.2	-9.7	-178.6	-62.5	86.9	0	0	0	112.9	V131 N132 S133 D137 K138 L139 L172 G174 I175	V131-H135 HydrophobicContact CG1-CB 4.23Å; N132-H135 PolarHBondContact O-N 3.3Å; S133-H135 PolarHBondContact O-N 3.3Å; S133-H135 VanDerWaalsContact O-N 3.16Å; H135-D137 VanDerWaalsContact C-N 3.35Å; H135-D137 PolarHBondContact O-N 2.62Å; H135-K138 PolarHBondContact O-N 2.94Å; H135-L139 PolarHBondContact O-N 3.17Å; H135-L172 HydrophobicContact CB-CD2 4.45Å; H135-G174 PolarHBondContact CE1-O 2.93Å; H135-I175 HydrophobicContact CB-CD1 4.28Å; H135-I175 HydrophobicContact CB-CG1 3.96Å
136	L	93.9	Very high	95	Very high	47 Å²	47	63.2 Å²	63.2	25%	0.246	33%	0.327	C	S	.	.	H	α-helix	trans	-62.3	-43.3	-178.3	-170.2	67.7	0	0	0	111.3	V131 N132 S133 K138 L139 N159	V131-L136 HydrophobicContact CB-CD1 4.27Å; N132-L136 PolarHBondContact O-N 3.33Å; S133-L136 PolarHBondContact O-N 3.44Å; L136-K138 PolarHBondContact O-N 2.96Å; L136-L139 PolarHBondContact O-N 2.96Å; L136-L139 VanDerWaalsContact O-N 3.11Å; L136-N159 HydrophobicContact CD2-CB 4.09Å
137	D	92.9	Very high	95.1	Very high	151 Å²	151	66.4 Å²	66.4	81%	0.807	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-17.4	179.4	-58.8	-24.9	0	0	0	113.6	H135	H135-D137 VanDerWaalsContact C-N 3.35Å; H135-D137 PolarHBondContact O-N 2.62Å
138	K	93.8	Very high	95	Very high	105 Å²	105	70.6 Å²	70.6	46%	0.457	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-17.1	177.6	-58.1	-179.2	-178.8	177	0	112.3	H135 L136 D171 L172	H135-K138 PolarHBondContact O-N 2.94Å; L136-K138 PolarHBondContact O-N 2.96Å; K138-D171 HydrophobicContact CD-CB 4.44Å; K138-D171 WeakPolarHBondContact CD-O 3.11Å; K138-D171 PolarHBondContact NZ-O 3.19Å; K138-L172 HydrophobicContact CB-CD2 3.9Å; K138-L172 HydrophobicContact CD-CD2 4.45Å
139	L	94.3	Very high	95	Very high	18 Å²	18	72.4 Å²	72.4	9%	0.094	38%	0.375	C	S	.	.	S	Bend	trans	-84.1	147.4	177.2	-69.1	175.7	0	0	0	109.9	V131 H135 L136 I166 L172	V131-L139 HydrophobicContact CB-CD1 4.46Å; V131-L139 HydrophobicContact CG1-CD1 3.88Å; V131-L139 HydrophobicContact CG2-CD1 4.01Å; H135-L139 PolarHBondContact O-N 3.17Å; L136-L139 PolarHBondContact O-N 2.96Å; L136-L139 VanDerWaalsContact O-N 3.11Å; L139-I166 HydrophobicContact CD1-CD1 4.17Å; L139-I166 HydrophobicContact CD1-CG2 4.4Å; L139-I166 HydrophobicContact CD2-CG2 3.62Å; L139-L172 HydrophobicContact CD2-CD1 3.52Å; L139-L172 HydrophobicContact CD2-CD2 3.8Å; L139-L172 HydrophobicContact CD2-CG 4.31Å; L139-L172 HydrophobicContact CG-CD2 4.16Å
140	P	93.2	Very high	94.9	Very high	97 Å²	97	72.7 Å²	72.7	63%	0.63	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-60.1	148.2	168.3	28	-34.4	0	0	0	109.5	R161	P140-R161 PolarHBondContact O-NH1 3Å
141	E	93.3	Very high	94.7	Very high	176 Å²	176	77.7 Å²	77.7	82%	0.822	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-55.8	147.3	171.8	-69.6	179.7	175.1	0	0	110.7
142	P	94.3	Very high	94.5	Very high	45 Å²	45	81.6 Å²	81.6	29%	0.292	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-60.6	144.6	176.5	27.3	-34	0	0	0	111	E146 D147	P142-E146 HydrophobicContact CB-CB 4.28Å; P142-E146 HydrophobicContact CB-CG 4.33Å; P142-D147 WeakPolarHBondContact CB-OD1 3.18Å; P142-D147 VanDerWaalsContact CG-OD1 3.25Å; P142-D147 WeakPolarHBondContact CG-OD1 3.37Å
143	E	95.8	Very high	94.4	Very high	112 Å²	112	79.7 Å²	79.7	52%	0.523	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-74.5	154.6	172.3	-63.7	-171.2	180	0	0	110.5	R145 E146 D147	E143-R145 PolarHBondContact O-N 3.47Å; E143-R145 VanDerWaalsContact O-N 3.11Å; E143-E146 HydrophobicContact CB-CB 4.5Å; E143-E146 WeakPolarHBondContact O-CA 3.48Å; E143-E146 VanDerWaalsContact O-CB 3.25Å; E143-E146 WeakPolarHBondContact O-CB 3.06Å; E143-E146 PolarHBondContact O-N 2.89Å; E143-D147 PolarHBondContact O-N 3.43Å
144	E	95.9	Very high	94.3	Very high	160 Å²	160	77 Å²	77	75%	0.748	40%	0.396	S	S	*	.	H	α-helix	trans	-51.9	-39.3	177	-175.4	-178.5	-166.2	0	0	112.7	E146 D147 D148	E144-E146 VanDerWaalsContact C-N 3.33Å; E144-E146 PolarHBondContact O-N 2.91Å; E144-D147 PolarHBondContact O-N 2.79Å; E144-D148 PolarHBondContact O-N 2.91Å
145	R	95.9	Very high	94.2	Very high	168 Å²	168	79.5 Å²	79.5	63%	0.634	40%	0.398	S	S	*	.	H	α-helix	trans	-68.8	-31.1	176.1	-63.8	-169.5	-164	100.5	2.7	113.2	L122 E143 M149	L122-R145 HydrophobicContact CD2-CB 3.71Å; E143-R145 PolarHBondContact O-N 3.47Å; E143-R145 VanDerWaalsContact O-N 3.11Å; R145-M149 WeakPolarHBondContact O-CG 3.43Å; R145-M149 PolarHBondContact O-N 2.96Å
146	E	97	Very high	94.3	Very high	5 Å²	5	82.3 Å²	82.3	2%	0.023	41%	0.413	C	S	.	.	H	α-helix	trans	-67.7	-45.6	173.7	-171.2	-175.8	164.5	0	0	109.7	L122 P142 E143 E144 M149 L150 R161 L162 Q165	L122-E146 HydrophobicContact CD1-CB 4.37Å; P142-E146 HydrophobicContact CB-CB 4.28Å; P142-E146 HydrophobicContact CB-CG 4.33Å; E143-E146 HydrophobicContact CB-CB 4.5Å; E143-E146 WeakPolarHBondContact O-CA 3.48Å; E143-E146 VanDerWaalsContact O-CB 3.25Å; E143-E146 WeakPolarHBondContact O-CB 3.06Å; E143-E146 PolarHBondContact O-N 2.89Å; E144-E146 VanDerWaalsContact C-N 3.33Å; E144-E146 PolarHBondContact O-N 2.91Å; E146-M149 WeakPolarHBondContact O-CB 3.42Å; E146-M149 PolarHBondContact O-N 3.01Å; E146-M149 VanDerWaalsContact O-N 3.1Å; E146-L150 HydrophobicContact CG-CD1 4.04Å; E146-L150 HydrophobicContact CG-CG 4.43Å; E146-L150 WeakPolarHBondContact O-CG 3.5Å; E146-L150 PolarHBondContact O-N 2.81Å; E146-R161 IonicContact OE1-CZ 3.5Å; E146-R161 IonicContact OE1-NE 3.86Å; E146-R161 PolarHBondContact OE1-NE 2.88Å; E146-R161 IonicContact OE1-NH2 2.81Å; E146-R161 IonicContact OE2-CZ 3.71Å; E146-R161 IonicContact OE2-NE 3.92Å; E146-R161 PolarHBondContact OE2-NE 3.14Å; E146-R161 IonicContact OE2-NH2 3.84Å; E146-R161 PolarHBondContact OE2-NH2 3.11Å; E146-L162 HydrophobicContact CG-CB 4.04Å; E146-L162 HydrophobicContact CG-CD1 3.75Å; E146-L162 HydrophobicContact CG-CG 3.72Å; E146-L162 PolarHBondContact OE1-N 3.37Å; E146-Q165 HydrophobicContact CG-CG 4.32Å
147	D	95.9	Very high	94.3	Very high	70 Å²	70	84.9 Å²	84.9	37%	0.374	42%	0.424	S	S	.	.	H	α-helix	trans	-61.5	-44.7	178.3	-76	-16.2	0	0	0	112.2	P142 E143 E144 M149 L150 D151	P142-D147 WeakPolarHBondContact CB-OD1 3.18Å; P142-D147 VanDerWaalsContact CG-OD1 3.25Å; P142-D147 WeakPolarHBondContact CG-OD1 3.37Å; E143-D147 PolarHBondContact O-N 3.43Å; E144-D147 PolarHBondContact O-N 2.79Å; D147-M149 PolarHBondContact O-N 3.2Å; D147-M149 VanDerWaalsContact O-N 3.15Å; D147-L150 PolarHBondContact O-N 3.09Å; D147-D151 PolarHBondContact O-N 2.89Å
148	D	95.2	Very high	94.4	Very high	89 Å²	89	87.1 Å²	87.1	48%	0.476	43%	0.43	S	S	.	.	H	α-helix	trans	-54.1	-36.5	174.1	-77.8	-22.9	0	0	0	112.1	E144	E144-D148 PolarHBondContact O-N 2.91Å
149	M	95	Very high	94.4	Very high	40 Å²	40	83.9 Å²	83.9	20%	0.197	42%	0.417	C	S	.	.	H	α-helix	trans	-79.7	-38.1	177.4	-67	-57.3	98.2	0	0	111.8	S125 R145 E146 D147 D151 M152 L162	S125-M149 VanDerWaalsContact CB-O 3.24Å; S125-M149 WeakPolarHBondContact CB-O 3.42Å; S125-M149 PolarHBondContact OG-O 2.77Å; R145-M149 WeakPolarHBondContact O-CG 3.43Å; R145-M149 PolarHBondContact O-N 2.96Å; E146-M149 WeakPolarHBondContact O-CB 3.42Å; E146-M149 PolarHBondContact O-N 3.01Å; E146-M149 VanDerWaalsContact O-N 3.1Å; D147-M149 PolarHBondContact O-N 3.2Å; D147-M149 VanDerWaalsContact O-N 3.15Å; M149-D151 VanDerWaalsContact C-N 3.28Å; M149-D151 PolarHBondContact O-N 3.4Å; M149-M152 HydrophobicContact CE-CE 3.4Å; M149-M152 PolarHBondContact O-N 2.95Å; M149-M152 HydrophobicContact SD-CE 3.38Å; M149-M152 WeakPolarHBondContact SD-CE 3.32Å; M149-L162 HydrophobicContact CB-CD1 3.91Å
150	L	95.4	Very high	94.5	Very high	5 Å²	5	83.4 Å²	83.4	3%	0.026	42%	0.416	C	S	.	.	H	α-helix	trans	-62.9	-31.7	176.6	-78.3	170.5	0	0	0	112.4	E146 D147 M152 A153 L156 L162	E146-L150 HydrophobicContact CG-CD1 4.04Å; E146-L150 HydrophobicContact CG-CG 4.43Å; E146-L150 WeakPolarHBondContact O-CG 3.5Å; E146-L150 PolarHBondContact O-N 2.81Å; D147-L150 PolarHBondContact O-N 3.09Å; L150-M152 PolarHBondContact O-N 2.53Å; L150-M152 VanDerWaalsContact O-N 3.13Å; L150-A153 WeakPolarHBondContact O-CA 3.38Å; L150-A153 WeakPolarHBondContact O-CB 3.47Å; L150-A153 PolarHBondContact O-N 3.19Å; L150-L156 HydrophobicContact CB-CD1 3.93Å; L150-L156 HydrophobicContact CD2-CD1 4.06Å; L150-L162 HydrophobicContact CD2-CD2 3.56Å; L150-L162 HydrophobicContact CD2-CG 3.93Å; L150-L162 HydrophobicContact CG-CD2 4.04Å; L150-L162 HydrophobicContact CG-CG 3.99Å
151	D	94.3	Very high	94.7	Very high	124 Å²	124	79.5 Å²	79.5	66%	0.663	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-24.9	175.1	-85.5	-7.7	0	0	0	113.5	D147 M149	D147-D151 PolarHBondContact O-N 2.89Å; M149-D151 VanDerWaalsContact C-N 3.28Å; M149-D151 PolarHBondContact O-N 3.4Å
152	M	91.8	Very high	94.9	Very high	83 Å²	83	71.1 Å²	71.1	41%	0.409	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-7.9	175.2	-63.1	-174	-76.9	0	0	113.4	M149 L150	M149-M152 HydrophobicContact CE-CE 3.4Å; M149-M152 PolarHBondContact O-N 2.95Å; M149-M152 HydrophobicContact SD-CE 3.38Å; M149-M152 WeakPolarHBondContact SD-CE 3.32Å; L150-M152 PolarHBondContact O-N 2.53Å; L150-M152 VanDerWaalsContact O-N 3.13Å
153	A	94.4	Very high	95	Very high	10 Å²	10	69 Å²	69	8%	0.083	34%	0.335	C	S	.	.	S	Bend	trans	-74.1	139.7	-176.3	0	0	0	0	0	111.6	H128 L150	H128-A153 HydrophobicContact CB-CB 4.29Å; L150-A153 WeakPolarHBondContact O-CA 3.38Å; L150-A153 WeakPolarHBondContact O-CB 3.47Å; L150-A153 PolarHBondContact O-N 3.19Å
154	P	90.5	Very high	95	Very high	31 Å²	31	63.8 Å²	63.8	20%	0.201	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70	140.3	174.6	30.2	-34.6	0	0	0	111.1	L156 V182	P154-L156 VanDerWaalsContact C-N 3.33Å; P154-L156 PolarHBondContact O-N 2.88Å; P154-V182 WeakPolarHBondContact CG-O 3.25Å
155	M	92.1	Very high	95.1	Very high	115 Å²	115	59.3 Å²	59.3	57%	0.567	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	43.7	175.3	-54.5	179.7	-177.5	0	0	113.3	Y130 V182	Y130-M155 WeakPolarHBondContact CE1-O 3.36Å; Y130-M155 WeakPolarHBondContact OH-CB 3.39Å; Y130-M155 PolarHBondContact OH-O 3.11Å; M155-V182 HydrophobicContact CE-CG2 4.28Å
156	L	94.9	Very high	95.1	Very high	78 Å²	78	51.5 Å²	51.5	41%	0.408	26%	0.261	S	S	.	.			trans	-56.6	139.4	176.8	-171.2	68.6	0	0	0	111.6	L150 P154 S160	L150-L156 HydrophobicContact CB-CD1 3.93Å; L150-L156 HydrophobicContact CD2-CD1 4.06Å; P154-L156 VanDerWaalsContact C-N 3.33Å; P154-L156 PolarHBondContact O-N 2.88Å; L156-S160 VanDerWaalsContact CD1-CB 3.41Å
157	Q	94.9	Very high	95.1	Very high	101 Å²	101	55.3 Å²	55.3	47%	0.472	28%	0.281	S	S	.	.			trans	-134	162.9	178.2	-64.9	178.5	35.1	0	0	109.5	Y130 N159 S160	Y130-Q157 HydrophobicContact CD1-CB 3.99Å; Y130-Q157 HydrophobicContact CD1-CG 4.17Å; Y130-Q157 HydrophobicContact CE1-CB 3.8Å; Y130-Q157 HydrophobicContact CE1-CG 3.62Å; Y130-Q157 VanDerWaalsContact CZ-NE2 3.34Å; Q157-N159 VanDerWaalsContact CB-OD1 3.31Å; Q157-N159 WeakPolarHBondContact CB-OD1 3.31Å; Q157-N159 PolarHBondContact O-N 2.97Å; Q157-N159 PolarHBondContact OE1-OD1 3.39Å; Q157-S160 PolarHBondContact N-OG 3.31Å; Q157-S160 WeakPolarHBondContact O-CB 3.06Å; Q157-S160 PolarHBondContact O-N 3.09Å; Q157-S160 PolarHBondContact O-OG 3.48Å
158	E	93.6	Very high	95	Very high	198 Å²	198	52 Å²	52	93%	0.925	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-29.5	-179.5	-62.9	175.3	179.6	0	0	113.6	S160	E158-S160 VanDerWaalsContact C-N 3.3Å
159	N	95.7	Very high	95	Very high	37 Å²	37	50.4 Å²	50.4	20%	0.198	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	17.1	176.9	69.5	-26.4	0	0	0	113.4	V131 L136 Q157	V131-N159 PolarHBondContact N-O 3.13Å; V131-N159 WeakPolarHBondContact O-CB 3.22Å; V131-N159 PolarHBondContact O-ND2 2.99Å; L136-N159 HydrophobicContact CD2-CB 4.09Å; Q157-N159 VanDerWaalsContact CB-OD1 3.31Å; Q157-N159 WeakPolarHBondContact CB-OD1 3.31Å; Q157-N159 PolarHBondContact O-N 2.97Å; Q157-N159 PolarHBondContact OE1-OD1 3.39Å
160	S	96.6	Very high	95	Very high	8 Å²	8	52.5 Å²	52.5	6%	0.056	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	135.3	178.7	-64	0	0	0	0	111.1	H128 V129 Y130 L156 Q157 E158	H128-S160 WeakPolarHBondContact NE2-CB 3.29Å; H128-S160 PolarHBondContact NE2-OG 3Å; V129-S160 WeakPolarHBondContact O-CA 3.41Å; Y130-S160 WeakPolarHBondContact CD1-OG 3.35Å; Y130-S160 WeakPolarHBondContact CE1-OG 3.38Å; L156-S160 VanDerWaalsContact CD1-CB 3.41Å; Q157-S160 PolarHBondContact N-OG 3.31Å; Q157-S160 WeakPolarHBondContact O-CB 3.06Å; Q157-S160 PolarHBondContact O-N 3.09Å; Q157-S160 PolarHBondContact O-OG 3.48Å; E158-S160 VanDerWaalsContact C-N 3.3Å
161	R	97.2	Very high	94.9	Very high	14 Å²	14	57.5 Å²	57.5	5%	0.053	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	159	173.3	-69.1	-60.5	-62.9	-96.5	7.5	110.6	V129 V131 P140 E146 G163 I166	V129-R161 PolarHBondContact N-O 3.34Å; V129-R161 PolarHBondContact O-N 2.78Å; V131-R161 HydrophobicContact CG2-CB 4.02Å; V131-R161 HydrophobicContact CG2-CG 3.98Å; P140-R161 PolarHBondContact O-NH1 3Å; E146-R161 IonicContact OE1-CZ 3.5Å; E146-R161 IonicContact OE1-NE 3.86Å; E146-R161 PolarHBondContact OE1-NE 2.88Å; E146-R161 IonicContact OE1-NH2 2.81Å; E146-R161 IonicContact OE2-CZ 3.71Å; E146-R161 IonicContact OE2-NE 3.92Å; E146-R161 PolarHBondContact OE2-NE 3.14Å; E146-R161 IonicContact OE2-NH2 3.84Å; E146-R161 PolarHBondContact OE2-NH2 3.11Å; R161-G163 PolarHBondContact O-N 2.85Å; R161-I166 HydrophobicContact CB-CD1 3.85Å; R161-I166 HydrophobicContact CB-CG1 4.43Å
162	L	97.1	Very high	94.9	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	112.6	167.3	-63.2	-171.8	0	0	0	108.6	L122 E146 M149 L150 C164 Q165	L122-L162 HydrophobicContact CD1-CD1 3.64Å; E146-L162 HydrophobicContact CG-CB 4.04Å; E146-L162 HydrophobicContact CG-CD1 3.75Å; E146-L162 HydrophobicContact CG-CG 3.72Å; E146-L162 PolarHBondContact OE1-N 3.37Å; M149-L162 HydrophobicContact CB-CD1 3.91Å; L150-L162 HydrophobicContact CD2-CD2 3.56Å; L150-L162 HydrophobicContact CD2-CG 3.93Å; L150-L162 HydrophobicContact CG-CD2 4.04Å; L150-L162 HydrophobicContact CG-CG 3.99Å; L162-C164 PolarHBondContact O-N 3.03Å; L162-Q165 HydrophobicContact CB-CG 4.14Å; L162-Q165 PolarHBondContact O-N 3.1Å
163	G	96.1	Very high	95	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-22.7	-177.7	0	0	0	0	0	113.5	I103 C127 R161 Q165 I166	I103-G163 WeakPolarHBondContact CB-O 3.25Å; C127-G163 PolarHBondContact O-N 3.32Å; R161-G163 PolarHBondContact O-N 2.85Å; G163-Q165 VanDerWaalsContact C-N 3.33Å; G163-I166 PolarHBondContact O-N 3.32Å
164	C	96.4	Very high	95.1	Very high	4 Å²	4	52.4 Å²	52.4	3%	0.027	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-17.9	175.5	72.2	0	0	0	0	114.7	N102 L104 A120 C127 L162	N102-C164 PolarHBondContact ND2-O 2.9Å; L104-C164 HydrophobicContact CB-CB 4.07Å; L104-C164 HydrophobicContact CD2-CB 3.76Å; A120-C164 HydrophobicContact CB-CB 3.68Å; C127-C164 HydrophobicContact CB-CB 4.35Å; C127-C164 PolarHBondContact SG-SG 2.76Å; L162-C164 PolarHBondContact O-N 3.03Å
165	Q	96.9	Very high	95.3	Very high	66 Å²	66	50.9 Å²	50.9	31%	0.308	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-9.4	176.5	-60.2	-51.2	-62.3	0	0	112.3	L122 E146 L162 G163	L122-Q165 HydrophobicContact CD1-CG 3.83Å; E146-Q165 HydrophobicContact CG-CG 4.32Å; L162-Q165 HydrophobicContact CB-CG 4.14Å; L162-Q165 PolarHBondContact O-N 3.1Å; G163-Q165 VanDerWaalsContact C-N 3.33Å
166	I	96.3	Very high	95.6	Very high	4 Å²	4	47.6 Å²	47.6	2%	0.021	25%	0.253	C	S	.	.			trans	-90.8	115.2	-179.2	-48.6	173.4	0	0	0	109.7	I103 V129 V131 L139 R161 G163 L172	I103-I166 HydrophobicContact CD1-CB 3.59Å; I103-I166 HydrophobicContact CD1-CD1 4.22Å; I103-I166 HydrophobicContact CD1-CG2 3.37Å; I103-I166 PolarHBondContact N-O 3.37Å; V129-I166 HydrophobicContact CG2-CD1 4.45Å; V131-I166 HydrophobicContact CG2-CD1 3.96Å; L139-I166 HydrophobicContact CD1-CD1 4.17Å; L139-I166 HydrophobicContact CD1-CG2 4.4Å; L139-I166 HydrophobicContact CD2-CG2 3.62Å; R161-I166 HydrophobicContact CB-CD1 3.85Å; R161-I166 HydrophobicContact CB-CG1 4.43Å; G163-I166 PolarHBondContact O-N 3.32Å; I166-L172 HydrophobicContact CG2-CD1 4.46Å
167	I	96.1	Very high	95.7	Very high	84 Å²	84	43.9 Å²	43.9	43%	0.431	23%	0.234	S	C	.	.	B	Isolated β-bridge	trans	-100	133.2	171.4	-54.5	-56.8	0	0	0	108.6	N102 T169	N102-I167 HydrophobicContact CB-CD1 4.16Å; I167-T169 PolarHBondContact O-N 2.99Å
168	L	95.5	Very high	95.8	Very high	1 Å²	1	41.4 Å²	41.4	1%	0.005	23%	0.226	C	C	.	.			trans	-70.8	125.5	-178.5	-67.2	174.8	0	0	0	111.3	V83 A97 G100 D101 I103 L106 I175	V83-L168 HydrophobicContact CG2-CD1 3.68Å; V83-L168 HydrophobicContact CG2-CD2 3.82Å; V83-L168 HydrophobicContact CG2-CG 4.45Å; A97-L168 HydrophobicContact CB-CD1 3.26Å; G100-L168 PolarHBondContact N-O 2.95Å; D101-L168 HydrophobicContact CB-CD1 4.13Å; D101-L168 WeakPolarHBondContact O-CG 3.32Å; D101-L168 PolarHBondContact O-N 3.47Å; I103-L168 HydrophobicContact CD1-CD2 3.89Å; I103-L168 HydrophobicContact CG1-CD2 3.99Å; I103-L168 HydrophobicContact CG1-CG 4.3Å; L106-L168 HydrophobicContact CD2-CD1 4.02Å; L168-I175 HydrophobicContact CD2-CG2 4.17Å
169	T	95.1	Very high	95.9	Very high	55 Å²	55	32.3 Å²	32.3	34%	0.337	18%	0.184	S	C	.	.			trans	-110.9	160.7	171.3	63	0	0	0	0	108.9	I167 D171 L172	I167-T169 PolarHBondContact O-N 2.99Å; T169-D171 PolarHBondContact O-N 3.21Å; T169-D171 VanDerWaalsContact O-N 3.15Å; T169-L172 PolarHBondContact O-N 2.86Å; T169-L172 WeakPolarHBondContact OG1-CG 3.34Å
170	P	93.9	Very high	95.9	Very high	84 Å²	84	30.7 Å²	30.7	55%	0.545	18%	0.175	S	C	.	.	G	3₁₀ helix	trans	-58.5	-27.2	178.8	23	-35.3	0	0	0	113.3	V99 L172 D173	V99-P170 HydrophobicContact CG2-CB 4.37Å; P170-L172 PolarHBondContact O-N 2.82Å; P170-D173 PolarHBondContact O-N 3.09Å
171	D	93.8	Very high	95.6	Very high	111 Å²	111	37.8 Å²	37.8	59%	0.594	21%	0.205	S	C	*	.	G	3₁₀ helix	trans	-71	-15.2	179.6	-60.1	-40.1	0	0	0	113.6	K138 T169 D173	K138-D171 HydrophobicContact CD-CB 4.44Å; K138-D171 WeakPolarHBondContact CD-O 3.11Å; K138-D171 PolarHBondContact NZ-O 3.19Å; T169-D171 PolarHBondContact O-N 3.21Å; T169-D171 VanDerWaalsContact O-N 3.15Å; D171-D173 VanDerWaalsContact C-N 3.34Å
172	L	94.3	Very high	95.3	Very high	1 Å²	1	40.7 Å²	40.7	1%	0.005	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-93.3	15.3	-179	-58.8	175.2	0	0	0	113.1	H135 K138 L139 I166 T169 P170 G174 I175	H135-L172 HydrophobicContact CB-CD2 4.45Å; K138-L172 HydrophobicContact CB-CD2 3.9Å; K138-L172 HydrophobicContact CD-CD2 4.45Å; L139-L172 HydrophobicContact CD2-CD1 3.52Å; L139-L172 HydrophobicContact CD2-CD2 3.8Å; L139-L172 HydrophobicContact CD2-CG 4.31Å; L139-L172 HydrophobicContact CG-CD2 4.16Å; I166-L172 HydrophobicContact CG2-CD1 4.46Å; T169-L172 PolarHBondContact O-N 2.86Å; T169-L172 WeakPolarHBondContact OG1-CG 3.34Å; P170-L172 PolarHBondContact O-N 2.82Å; L172-G174 PolarHBondContact O-N 3.42Å; L172-I175 HydrophobicContact CB-CB 4.41Å; L172-I175 HydrophobicContact CB-CG2 4.48Å; L172-I175 HydrophobicContact CD2-CD1 4.38Å; L172-I175 VanDerWaalsContact O-CB 3.28Å; L172-I175 WeakPolarHBondContact O-CB 3.08Å; L172-I175 VanDerWaalsContact O-CG2 3.3Å; L172-I175 WeakPolarHBondContact O-CG2 3.26Å; L172-I175 PolarHBondContact O-N 2.96Å
173	D	94.6	Very high	94.8	Very high	79 Å²	79	41.9 Å²	41.9	42%	0.422	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	125.6	173.5	-175	46.5	0	0	0	111.8	V81 N82 P170 D171	V81-D173 HydrophobicContact CG1-CB 4.22Å; N82-D173 WeakPolarHBondContact CB-OD1 3Å; N82-D173 PolarHBondContact N-OD1 3.13Å; N82-D173 PolarHBondContact ND2-OD1 3.19Å; P170-D173 PolarHBondContact O-N 3.09Å; D171-D173 VanDerWaalsContact C-N 3.34Å
174	G	94.8	Very high	94.1	Very high	29 Å²	29	49 Å²	49	30%	0.299	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.7	14.9	-175.1	0	0	0	0	0	114.4	N82 H135 L172 E176	N82-G174 VanDerWaalsContact O-CA 3.32Å; N82-G174 WeakPolarHBondContact O-CA 3.4Å; N82-G174 PolarHBondContact O-N 3.44Å; H135-G174 PolarHBondContact CE1-O 2.93Å; L172-G174 PolarHBondContact O-N 3.42Å; G174-E176 PolarHBondContact O-N 3.15Å
175	I	96.5	Very high	93.4	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	134	176.7	-172.1	172.8	0	0	0	111.4	N82 V83 V84 V131 H135 L168 L172 L177	N82-I175 PolarHBondContact O-N 3.44Å; V83-I175 HydrophobicContact CB-CG2 4.24Å; V83-I175 HydrophobicContact CG1-CG2 4.03Å; V83-I175 HydrophobicContact CG2-CG2 3.85Å; V84-I175 PolarHBondContact N-O 3.46Å; V131-I175 HydrophobicContact CG1-CD1 4.09Å; V131-I175 HydrophobicContact CG1-CG1 4.38Å; H135-I175 HydrophobicContact CB-CD1 4.28Å; H135-I175 HydrophobicContact CB-CG1 3.96Å; L168-I175 HydrophobicContact CD2-CG2 4.17Å; L172-I175 HydrophobicContact CB-CB 4.41Å; L172-I175 HydrophobicContact CB-CG2 4.48Å; L172-I175 HydrophobicContact CD2-CD1 4.38Å; L172-I175 VanDerWaalsContact O-CB 3.28Å; L172-I175 WeakPolarHBondContact O-CB 3.08Å; L172-I175 VanDerWaalsContact O-CG2 3.3Å; L172-I175 WeakPolarHBondContact O-CG2 3.26Å; L172-I175 PolarHBondContact O-N 2.96Å; I175-L177 HydrophobicContact CD1-CD2 3.87Å; I175-L177 HydrophobicContact CD1-CG 4.48Å; I175-L177 HydrophobicContact CG1-CD2 4.03Å; I175-L177 HydrophobicContact CG1-CG 4.32Å
176	E	97.1	Very high	92	Very high	45 Å²	45	56.4 Å²	56.4	21%	0.21	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	129.9	175.3	-52.6	-170.3	141.7	0	0	110.3	V84 R92 N132 G174	V84-E176 HydrophobicContact CB-CG 4.2Å; V84-E176 CarbonylContact O-C 3.57Å; V84-E176 WeakPolarHBondContact O-CA 3.38Å; R92-E176 IonicContact CZ-OE1 3Å; R92-E176 IonicContact NH2-OE1 2.77Å; R92-E176 PolarHBondContact NH2-OE1 3.4Å; N132-E176 HydrophobicContact CB-CB 3.97Å; N132-E176 PolarHBondContact N-O 3.11Å; N132-E176 PolarHBondContact ND2-OE2 3.45Å; G174-E176 PolarHBondContact O-N 3.15Å
177	L	97.4	Very high	90.7	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	123.3	-176.6	-59.5	173.2	0	0	0	109.2	V83 V84 Y85 I86 I103 V129 Y130 V131 I175	V83-L177 HydrophobicContact CG1-CD1 4.02Å; V84-L177 PolarHBondContact O-N 2.93Å; Y85-L177 CarbonylContact C-O 3.52Å; Y85-L177 WeakPolarHBondContact CA-O 3.1Å; Y85-L177 HydrophobicContact CD1-CB 4.16Å; Y85-L177 HydrophobicContact CD1-CD1 4.27Å; Y85-L177 HydrophobicContact CE1-CB 4.38Å; Y85-L177 HydrophobicContact CE1-CD1 3.7Å; I86-L177 PolarHBondContact N-O 2.92Å; I103-L177 HydrophobicContact CB-CD1 4.31Å; I103-L177 HydrophobicContact CD1-CD1 3.63Å; I103-L177 HydrophobicContact CG1-CD1 3.78Å; I103-L177 HydrophobicContact CG2-CD1 3.52Å; V129-L177 HydrophobicContact CG2-CD2 4.36Å; Y130-L177 WeakPolarHBondContact O-CA 3.14Å; V131-L177 HydrophobicContact CB-CD2 4.39Å; V131-L177 HydrophobicContact CG1-CD2 4.37Å; V131-L177 HydrophobicContact CG2-CD2 3.9Å; I175-L177 HydrophobicContact CD1-CD2 3.87Å; I175-L177 HydrophobicContact CD1-CG 4.48Å; I175-L177 HydrophobicContact CG1-CD2 4.03Å; I175-L177 HydrophobicContact CG1-CG 4.32Å
178	T	97.4	Very high	89.4	Confident	50 Å²	50	61.3 Å²	61.3	31%	0.307	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	129	178	-54.5	0	0	0	0	110.6	I86 Y130	I86-T178 HydrophobicContact CB-CG2 4.09Å; I86-T178 HydrophobicContact CG2-CG2 4.22Å; Y130-T178 HydrophobicContact CD2-CG2 4.37Å; Y130-T178 PolarHBondContact N-O 3.13Å; Y130-T178 PolarHBondContact O-N 2.83Å
179	L	96.2	Very high	88.4	Confident	7 Å²	7	68.8 Å²	68.8	4%	0.037	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-77.1	136.9	176	-82.8	65.3	0	0	0	110.1	Y85 I86 R88 I112 L114	Y85-L179 HydrophobicContact CD1-CD1 4.07Å; I86-L179 PolarHBondContact O-N 3.08Å; R88-L179 HydrophobicContact CG-CB 4.22Å; I112-L179 HydrophobicContact CG2-CD1 4.32Å; I112-L179 HydrophobicContact CG2-CD2 3.93Å; L114-L179 HydrophobicContact CB-CD2 4.24Å; L114-L179 HydrophobicContact CD1-CG 4.22Å
180	P	94.6	Very high	87.1	Confident	2 Å²	2	69.1 Å²	69.1	1%	0.013	37%	0.372	C	S	.	.	P	Polyproline II helix	trans	-65.3	149.2	172.6	29.5	-35.3	0	0	0	110.7	H128 Y130 V182 T183	H128-P180 WeakPolarHBondContact O-CD 3.44Å; H128-P180 WeakPolarHBondContact O-CG 3.24Å; Y130-P180 HydrophobicContact CE2-CB 3.88Å; P180-V182 PolarHBondContact O-N 2.79Å; P180-T183 HydrophobicContact CG-CG2 4.23Å
181	K	91.4	Very high	86.3	Confident	157 Å²	157	71.6 Å²	71.6	68%	0.683	38%	0.375	S	S	*	.	S	Bend	trans	-65.4	-28.4	-179.2	-68.1	-175.8	178.4	179.3	0	112.8
182	V	88.9	Confident	85.5	Confident	76 Å²	76	70.6 Å²	70.6	46%	0.461	37%	0.373	S	S	.	.			trans	-133.4	138.4	-175.7	-175.4	0	0	0	0	107.8	P154 M155 P180	P154-V182 WeakPolarHBondContact CG-O 3.25Å; M155-V182 HydrophobicContact CE-CG2 4.28Å; P180-V182 PolarHBondContact O-N 2.79Å
183	T	86.7	Confident	84.5	Confident	24 Å²	24	74 Å²	74	15%	0.147	40%	0.395	C	S	.	.			trans	-122.5	138	177.2	39	0	0	0	0	107.9	R88 E115 P180 N185	R88-T183 PolarHBondContact NH1-OG1 3.24Å; R88-T183 VanDerWaalsContact NH1-OG1 3.15Å; E115-T183 WeakPolarHBondContact OE1-CB 3.36Å; E115-T183 PolarHBondContact OE1-OG1 3.49Å; P180-T183 HydrophobicContact CG-CG2 4.23Å; T183-N185 PolarHBondContact O-N 3.05Å
184	R	81.9	Confident	83.7	Confident	151 Å²	151	79.3 Å²	79.3	57%	0.57	42%	0.415	S	S	*	.			trans	-87.8	85.9	178.9	-173.5	-177.2	176.8	-172.2	-2.4	109.3
185	N	81.1	Confident	82.6	Confident	46 Å²	46	81.4 Å²	81.4	25%	0.246	42%	0.423	C	S	.	.			trans	-127.6	122.5	172.2	-160.8	-1.5	0	0	0	110.1	E115 T126 T183 Y187	E115-N185 WeakPolarHBondContact OE2-CB 3.49Å; E115-N185 PolarHBondContact OE2-ND2 3.3Å; T126-N185 HydrophobicContact CG2-CB 3.99Å; T183-N185 PolarHBondContact O-N 3.05Å; N185-Y187 HydrophobicContact CB-CD2 4.4Å; N185-Y187 HydrophobicContact CB-CE2 3.77Å; N185-Y187 PolarHBondContact ND2-OH 3.09Å; N185-Y187 PolarHBondContact O-N 3.2Å
186	F	68.1	Low	80.9	Confident	178 Å²	178	89.9 Å²	89.9	78%	0.781	46%	0.462	S	S	*	.			trans	-86	89.7	-177.6	-106.7	-91.3	0	0	0	109.1	V188	F186-V188 PolarHBondContact O-N 3.27Å
187	Y	69.8	Low	80.1	Confident	77 Å²	77	92.1 Å²	92.1	30%	0.302	48%	0.475	S	S	.	.			trans	-78.7	99	168.5	-59.5	-72.6	0	0	0	109.1	E115 N185 D189 H191 P193	E115-Y187 PolarHBondContact OE2-OH 2.87Å; N185-Y187 HydrophobicContact CB-CD2 4.4Å; N185-Y187 HydrophobicContact CB-CE2 3.77Å; N185-Y187 PolarHBondContact ND2-OH 3.09Å; N185-Y187 PolarHBondContact O-N 3.2Å; Y187-D189 PolarHBondContact O-N 2.96Å; Y187-H191 WeakPolarHBondContact CD1-O 3.38Å; Y187-P193 VanDerWaalsContact CE1-CD 3.44Å; Y187-P193 HydrophobicContact CE1-CG 4.33Å
188	V	67.4	Low	79.2	Confident	115 Å²	115	96.9 Å²	96.9	70%	0.697	50%	0.5	S	S	*	.	G	3₁₀ helix	trans	-67.9	123.2	160	-144.3	0	0	0	0	105	F186	F186-V188 PolarHBondContact O-N 3.27Å
189	D	75.2	Confident	78.2	Confident	158 Å²	158	99.6 Å²	99.6	85%	0.845	51%	0.51	S	S	*	.	G	3₁₀ helix	trans	81.4	6.2	177.2	-41.8	-38.5	0	0	0	118	Y187 H191	Y187-D189 PolarHBondContact O-N 2.96Å; D189-H191 PolarHBondContact O-N 2.87Å; D189-H191 VanDerWaalsContact O-N 3.09Å
190	G	69	Low	77.1	Confident	62 Å²	62	105 Å²	105	64%	0.639	54%	0.538	S	S	*	.	G	3₁₀ helix	trans	65.2	13.1	174.1	0	0	0	0	0	114.9
191	H	77.3	Confident	76.1	Confident	135 Å²	135	111.4 Å²	111.4	63%	0.625	57%	0.571	S	S	*	*			trans	-79.8	118.5	173.7	-177.6	70.9	0	0	0	109.8	Y187 D189 P193	Y187-H191 WeakPolarHBondContact CD1-O 3.38Å; D189-H191 PolarHBondContact O-N 2.87Å; D189-H191 VanDerWaalsContact O-N 3.09Å; H191-P193 WeakPolarHBondContact O-CD 3.39Å
192	V	75.1	Confident	75	Confident	91 Å²	91	108.4 Å²	108.4	55%	0.552	56%	0.564	S	S	*	*			trans	-87.7	108.4	170.5	-176.6	0	0	0	0	107.6
193	P	75	Confident	74	Confident	71 Å²	71	110.7 Å²	110.7	46%	0.461	57%	0.571	S	S	.	*	P	Polyproline II helix	trans	-65.5	139.7	176.5	29.9	-30.9	0	0	0	108.4	Y187 H191	Y187-P193 VanDerWaalsContact CE1-CD 3.44Å; Y187-P193 HydrophobicContact CE1-CG 4.33Å; H191-P193 WeakPolarHBondContact O-CD 3.39Å
194	K	77.2	Confident	73.1	Confident	192 Å²	192	117.4 Å²	117.4	84%	0.835	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-73.7	136.8	170.2	-68.1	-178.1	179.7	179.1	0	108.2	H196	K194-H196 PolarHBondContact O-N 3.19Å
195	P	70.9	Confident	72.3	Confident	73 Å²	73	114.6 Å²	114.6	47%	0.474	61%	0.606	S	S	.	*	P	Polyproline II helix	trans	-56.7	139.4	166.2	24.4	-30.5	0	0	0	108.8	H108	H108-P195 HydrophobicContact CB-CB 4.22Å; H108-P195 HydrophobicContact CB-CG 4.09Å; H108-P195 WeakPolarHBondContact ND1-CB 3.49Å
196	H	62	Low	71.5	Confident	177 Å²	177	120.8 Å²	120.8	82%	0.819	64%	0.639	S	S	*	*			trans	-80.2	0	-175.6	58.6	-83.5	0	0	0	111.8	E119 K194	E119-H196 VanDerWaalsContact CD-ND1 3.29Å; E119-H196 WeakPolarHBondContact CG-CE1 3.39Å; E119-H196 IonicContact OE1-CE1 2.65Å; E119-H196 PolarHBondContact OE1-CE1 3.12Å; E119-H196 IonicContact OE1-CG 3.91Å; E119-H196 IonicContact OE1-ND1 3.33Å; E119-H196 PolarHBondContact OE1-ND1 2.85Å; E119-H196 IonicContact OE2-CE1 3.45Å; E119-H196 PolarHBondContact OE2-CE1 3.35Å; E119-H196 IonicContact OE2-ND1 3.46Å; E119-H196 IonicContact OE2-NE2 3.68Å; K194-H196 PolarHBondContact O-N 3.19Å

Retrieved 196 of 196 residues in 486.4 ms (Link to these results)

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