A0A096MDL2_POEFO Loading...

Deoxyuridine 5'-triphosphate nucleotidohydrolase

Catalyzes the cleavage of 2'-deoxyuridine 5'-triphosphate (dUTP) into 2'-deoxyuridine 5'-monophosphate (dUMP) and inorganic pyrophosphate and through its action efficiently prevents uracil misincorporation into DNA and at the same time provides dUMP, the substrate for de novo thymidylate biosynthesis. Inhibits peroxisome proliferator-activated receptor (PPAR) activity by binding of its N-terminal to PPAR, preventing the latter's dimerization with retinoid X receptor. Essential for embryonic development. Involved in nucleotide metabolism via production of dUMP, the immediate precursor of thymidine nucleotides, and decreases the intracellular concentration of dUTP so that uracil cannot be incorporated into DNA.

AlphaFold DB , UniProt , Accession A0A096MDL2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 200 aa.

Structure Viewer

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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	46.2	Very low	38.6	Very low	244 Å²	244	182.4 Å²	182.4	100%	1.202	90%	0.9	S	S	*	*				0	100.4	0	-78.5	176.8	158.2	0	0	110.3
2	K	36.1	Very low	38.2	Very low	212 Å²	212	181.3 Å²	181.3	92%	0.922	90%	0.899	S	S	*	*			trans	-146.9	111.1	161.5	-79.5	-172	178.2	174.8	0	106.8
3	G	32.8	Very low	37.5	Very low	83 Å²	83	172.5 Å²	172.5	86%	0.856	88%	0.882	S	S	*	*			trans	-80.6	137.8	-175	0	0	0	0	0	112.2
4	I	42.1	Very low	37.1	Very low	158 Å²	158	169.8 Å²	169.8	81%	0.81	88%	0.878	S	S	*	*			trans	-96.7	114.6	172.6	-66.3	171.4	0	0	0	107.3	V6	I4-V6 HydrophobicContact CG2-CG2 4.17Å
5	R	42	Very low	36.5	Very low	243 Å²	243	169 Å²	169	92%	0.917	87%	0.874	S	S	*	*			trans	-90.5	113.6	167.9	-92.4	179.7	173.9	173	-2	108.3
6	V	40.1	Very low	36	Very low	133 Å²	133	164.5 Å²	164.5	81%	0.806	86%	0.862	S	S	*	*			trans	-89.1	126.2	167.1	-179	0	0	0	0	108.3	I4	I4-V6 HydrophobicContact CG2-CG2 4.17Å
7	R	41.1	Very low	35.7	Very low	237 Å²	237	161.5 Å²	161.5	89%	0.894	85%	0.852	S	S	*	*			trans	-86.3	122.2	177.7	-78.7	-172.2	-101.1	-158.6	-3.4	109.5	K9	R7-K9 PolarHBondContact O-N 3.04Å
8	L	36.6	Very low	35.3	Very low	174 Å²	174	163.7 Å²	163.7	91%	0.911	85%	0.854	S	S	*	*			trans	-76	102.5	173.3	-170.1	79.6	0	0	0	108.9
9	K	37.3	Very low	35.2	Very low	190 Å²	190	165.7 Å²	165.7	83%	0.826	86%	0.855	S	S	*	*			trans	-169.7	17.1	166.7	-110.2	163.7	-163.2	-166.2	0	119.4	R7	R7-K9 PolarHBondContact O-N 3.04Å
10	D	35.3	Very low	35	Very low	159 Å²	159	165 Å²	165	85%	0.85	86%	0.858	S	S	*	*			trans	-102.6	83.1	174.2	-63.6	-30.8	0	0	0	110.9
11	L	35	Very low	35.2	Very low	173 Å²	173	161.6 Å²	161.6	91%	0.906	86%	0.855	S	S	*	*			trans	-162.4	90.2	154.9	-128.2	94.4	0	0	0	110.2
12	L	34	Very low	34.8	Very low	170 Å²	170	156.3 Å²	156.3	89%	0.89	84%	0.838	S	S	*	*			trans	-107.1	135.7	149.6	-91.6	81.5	0	0	0	105
13	G	29.4	Very low	34.5	Very low	66 Å²	66	150 Å²	150	68%	0.68	83%	0.834	S	S	*	*			cis	105.6	82.7	23.2	0	0	0	0	0	110
14	V	31.1	Very low	34.4	Very low	135 Å²	135	151.4 Å²	151.4	82%	0.818	83%	0.83	S	S	*	*			trans	-163.5	130.7	161.5	-163.1	0	0	0	0	104.8
15	L	28.7	Very low	33.8	Very low	158 Å²	158	152.9 Å²	152.9	83%	0.827	83%	0.831	S	S	*	*			cis	-161	147.5	41.3	-161.2	71.9	0	0	0	109.5
16	S	28	Very low	33.2	Very low	97 Å²	97	149.6 Å²	149.6	68%	0.678	83%	0.827	S	S	*	*			trans	-75.2	165	171.6	60.6	0	0	0	0	114
17	V	30.9	Very low	32.8	Very low	114 Å²	114	152.5 Å²	152.5	69%	0.691	82%	0.823	S	S	*	*			trans	133.1	103.5	142.3	176.9	0	0	0	0	110.9
18	F	29.4	Very low	32.3	Very low	201 Å²	201	149.5 Å²	149.5	88%	0.882	82%	0.819	S	S	*	*				-172.5	117.5	124.7	-96.9	-71.6	0	0	0	109
19	K	32	Very low	32	Very low	201 Å²	201	150.3 Å²	150.3	87%	0.874	82%	0.815	S	S	*	*			trans	-109.5	131.5	165.9	-101.5	-177.7	174.3	179.2	0	106.6
20	T	32.2	Very low	31.5	Very low	151 Å²	151	149.1 Å²	149.1	93%	0.926	81%	0.812	S	S	*	*			trans	-160.8	147.2	145.6	19.7	0	0	0	0	110.4
21	A	38.2	Very low	31.2	Very low	95 Å²	95	146.7 Å²	146.7	79%	0.785	80%	0.804	S	S	*	*			trans	-89.7	-179.3	-156.5	0	0	0	0	0	114.9
22	P	39.2	Very low	31	Very low	132 Å²	132	147.6 Å²	147.6	86%	0.857	80%	0.803	S	S	*	*			trans	-95	158.3	-165.3	38	-31.3	0	0	0	113.8
23	G	29.1	Very low	30.7	Very low	80 Å²	80	147.4 Å²	147.4	83%	0.825	80%	0.8	S	S	*	*			trans	-141.8	114.4	179.8	0	0	0	0	0	112.9
24	S	30.9	Very low	30.6	Very low	112 Å²	112	151.6 Å²	151.6	78%	0.783	81%	0.806	S	S	*	*			trans	-69.2	148	170.5	49.4	0	0	0	0	114
25	F	28.7	Very low	30.5	Very low	189 Å²	189	150.1 Å²	150.1	83%	0.829	80%	0.801	S	S	*	*			trans	-155.3	98.6	150.2	-136	-97.5	0	0	0	112.8
26	E	30.7	Very low	30.6	Very low	175 Å²	175	150.2 Å²	150.2	82%	0.818	80%	0.798	S	S	*	*			trans	-91.2	144.6	152.5	-88.7	-167.2	149.4	0	0	109.8
27	R	30.7	Very low	30.8	Very low	194 Å²	194	151.6 Å²	151.6	73%	0.732	80%	0.798	S	S	*	*			trans	171.9	104.7	142.9	-101.4	176.2	-90.1	-131.1	2	108
28	Q	31.9	Very low	30.8	Very low	174 Å²	174	154.7 Å²	154.7	81%	0.813	80%	0.802	S	S	*	*				43.3	121.3	83	-86.5	-174.3	-21.5	0	0	115.1
29	F	28.9	Very low	30.7	Very low	190 Å²	190	153 Å²	153	83%	0.833	80%	0.802	S	S	*	*			trans	-170.4	107.1	130	-88	-69.8	0	0	0	108.1
30	H	28.3	Very low	30.9	Very low	165 Å²	165	149.8 Å²	149.8	76%	0.764	80%	0.799	S	S	*	*				83.2	99.5	92.3	-133.4	59.4	0	0	0	113.2
31	T	28.2	Very low	30.9	Very low	109 Å²	109	148 Å²	148	67%	0.669	79%	0.793	S	S	*	*				67.8	112.3	95.7	-57.4	0	0	0	0	113.9
32	Q	30.3	Very low	31	Very low	192 Å²	192	148.3 Å²	148.3	90%	0.897	80%	0.795	S	S	*	*				-157.7	137.1	121.7	-145	160.1	-7.4	0	0	113.1
33	M	28	Very low	30.9	Very low	165 Å²	165	148.9 Å²	148.9	81%	0.813	80%	0.795	S	S	*	*			trans	-99.7	172.8	-178	-106.2	-93.8	-177.5	0	0	111
34	L	28.4	Very low	31.2	Very low	155 Å²	155	149.8 Å²	149.8	81%	0.812	79%	0.789	S	S	*	*			trans	98.6	128.7	167.2	-55	162.3	0	0	0	113.6
35	S	28.5	Very low	31.6	Very low	103 Å²	103	150.4 Å²	150.4	72%	0.72	79%	0.791	S	S	*	*			cis	-155.6	145.1	28.4	61.3	0	0	0	0	113.6
36	Q	31.2	Very low	32.2	Very low	161 Å²	161	146.9 Å²	146.9	75%	0.752	79%	0.789	S	S	*	*				30.3	142.9	130	-56.4	-175.7	6.9	0	0	119.2
37	N	31.6	Very low	32.7	Very low	126 Å²	126	148.3 Å²	148.3	67%	0.674	79%	0.793	S	S	*	*			cis	-170.2	150.6	12.2	-119.2	-25.5	0	0	0	108.3
38	K	30.1	Very low	33.1	Very low	178 Å²	178	150.4 Å²	150.4	77%	0.774	80%	0.801	S	S	*	*			trans	20.8	123	150.8	-67.9	176.6	177.1	176.8	0	120
39	D	28.5	Very low	33.5	Very low	167 Å²	167	145.8 Å²	145.8	89%	0.893	79%	0.792	S	S	*	*				-148.3	140.7	113.8	-127.7	-23.3	0	0	0	111.9
40	V	34.6	Very low	34.2	Very low	133 Å²	133	147.9 Å²	147.9	81%	0.806	80%	0.795	S	S	*	*			trans	-108.8	111.5	-171.9	-148	0	0	0	0	106.9
41	S	33.2	Very low	34.7	Very low	114 Å²	114	145.7 Å²	145.7	80%	0.797	79%	0.793	S	S	*	*			trans	-138.9	113.4	162.2	66.2	0	0	0	0	109.4
42	A	41.3	Very low	35.6	Very low	100 Å²	100	148.7 Å²	148.7	83%	0.826	80%	0.799	S	S	*	*			trans	-59.7	129	-178.3	0	0	0	0	0	112.9
43	V	35.6	Very low	36.2	Very low	144 Å²	144	144.5 Å²	144.5	87%	0.873	79%	0.787	S	S	*	*			trans	-143.7	129.8	146.3	-174.6	0	0	0	0	108.2
44	S	36.3	Very low	36.9	Very low	100 Å²	100	144.1 Å²	144.1	70%	0.699	78%	0.781	S	S	*	*			trans	-47.7	144.3	-168.8	-54.9	0	0	0	0	116.3	S46	S44-S46 PolarHBondContact O-N 2.93Å; S44-S46 VanDerWaalsContact O-N 3.11Å
45	P	37.8	Very low	37.9	Very low	125 Å²	125	143.2 Å²	143.2	81%	0.812	78%	0.784	S	S	*	*			trans	-65.9	115.8	163	27.5	-29.1	0	0	0	107.3	K47	P45-K47 VanDerWaalsContact C-N 3.34Å; P45-K47 PolarHBondContact O-N 2.75Å
46	S	41.4	Very low	39.1	Very low	114 Å²	114	144 Å²	144	80%	0.797	78%	0.777	S	S	*	*			trans	-51.5	104.6	168.3	-51.1	0	0	0	0	107.4	S44 R48	S44-S46 PolarHBondContact O-N 2.93Å; S44-S46 VanDerWaalsContact O-N 3.11Å; S46-R48 PolarHBondContact O-N 3.05Å
47	K	41.9	Very low	40.2	Very low	205 Å²	205	144 Å²	144	89%	0.891	78%	0.781	S	S	*	*			trans	-55.7	92.2	163.1	-130.6	176.6	-176.5	-179.7	0	104.2	P45 A49	P45-K47 VanDerWaalsContact C-N 3.34Å; P45-K47 PolarHBondContact O-N 2.75Å; K47-A49 PolarHBondContact O-N 2.55Å
48	R	40	Very low	41.5	Very low	238 Å²	238	145 Å²	145	90%	0.898	78%	0.782	S	S	*	*			trans	-58.5	96.8	156.4	-82.7	-176.8	178.2	-177.9	-0.8	102.8	S46 R50	S46-R48 PolarHBondContact O-N 3.05Å; R48-R50 VanDerWaalsContact C-N 3.34Å; R48-R50 PolarHBondContact O-N 3.26Å
49	A	40	Very low	43.6	Very low	77 Å²	77	145.2 Å²	145.2	64%	0.636	78%	0.783	S	S	*	*			trans	-49.4	112.5	163.5	0	0	0	0	0	104.1	K47 T51	K47-A49 PolarHBondContact O-N 2.55Å; A49-T51 PolarHBondContact O-N 2.77Å
50	R	43	Very low	46.5	Very low	235 Å²	235	143.8 Å²	143.8	89%	0.887	77%	0.766	S	S	*	*			trans	-54.9	101.1	153.3	-116.5	177.6	176.1	175.7	-2.2	102.2	R48 E52	R48-R50 VanDerWaalsContact C-N 3.34Å; R48-R50 PolarHBondContact O-N 3.26Å; R50-E52 PolarHBondContact O-N 3.49Å
51	T	38.8	Very low	49.5	Very low	118 Å²	118	140.3 Å²	140.3	72%	0.724	75%	0.745	S	S	*	*			trans	-61.5	94.9	161.6	-46.9	0	0	0	0	102.7	A49 T53	A49-T51 PolarHBondContact O-N 2.77Å; T51-T53 PolarHBondContact O-N 3.42Å
52	E	47.6	Very low	52.6	Low	172 Å²	172	136.6 Å²	136.6	80%	0.804	72%	0.716	S	S	*	*			trans	-56.8	89.2	155.5	-69.3	177	178.3	0	0	103.8	R50 K54	R50-E52 PolarHBondContact O-N 3.49Å; E52-K54 PolarHBondContact O-N 3.37Å
53	T	42.8	Very low	55.3	Low	105 Å²	105	139.4 Å²	139.4	64%	0.644	71%	0.705	S	S	*	*			trans	-53.2	114.6	158.4	37.7	0	0	0	0	104	T51 E56	T51-T53 PolarHBondContact O-N 3.42Å; T53-E56 WeakPolarHBondContact CA-OE1 3.39Å
54	K	41.6	Very low	58.3	Low	157 Å²	157	136.7 Å²	136.7	68%	0.683	68%	0.682	S	S	*	*			trans	-54.1	155.9	163.1	-70	173	175.2	177.1	0	105.6	E52 E56	E52-K54 PolarHBondContact O-N 3.37Å; K54-E56 PolarHBondContact N-OE1 2.88Å; K54-E56 WeakPolarHBondContact O-CG 3.43Å; K54-E56 PolarHBondContact O-N 2.9Å
55	P	50.8	Low	61.3	Low	135 Å²	135	134.7 Å²	134.7	88%	0.877	67%	0.668	S	S	*	*			trans	-66.6	79.9	166.5	27.6	-30.1	0	0	0	107.2	D57	P55-D57 PolarHBondContact O-N 3.42Å
56	E	53.3	Low	64.2	Low	121 Å²	121	133.3 Å²	133.3	57%	0.565	65%	0.649	S	S	*	*			trans	-71.1	116.5	178.6	-13.9	-88.5	161.8	0	0	106.7	T53 K54 E58	T53-E56 WeakPolarHBondContact CA-OE1 3.39Å; K54-E56 PolarHBondContact N-OE1 2.88Å; K54-E56 WeakPolarHBondContact O-CG 3.43Å; K54-E56 PolarHBondContact O-N 2.9Å; E56-E58 PolarHBondContact O-N 3.06Å
57	D	54.1	Low	66.9	Low	159 Å²	159	131.7 Å²	131.7	85%	0.85	63%	0.631	S	S	*	*			trans	33.7	67.8	162.7	-65.5	-33.7	0	0	0	116.2	P55 K59	P55-D57 PolarHBondContact O-N 3.42Å; D57-K59 VanDerWaalsContact C-N 3.27Å; D57-K59 PolarHBondContact O-N 2.98Å
58	E	59.8	Low	69.6	Low	148 Å²	148	123.6 Å²	123.6	69%	0.692	60%	0.601	S	S	*	*			trans	-61.4	97.5	163.4	-86.4	-164.5	162.4	0	0	108.8	E56 Y60	E56-E58 PolarHBondContact O-N 3.06Å; E58-Y60 WeakPolarHBondContact O-CD2 3.27Å; E58-Y60 PolarHBondContact O-N 2.74Å
59	K	74.4	Confident	72.4	Confident	182 Å²	182	120.6 Å²	120.6	79%	0.791	60%	0.597	S	S	*	*			trans	-65	109.3	175	-166.1	175.6	-176.4	175.4	0	107.2	D57 V61	D57-K59 VanDerWaalsContact C-N 3.27Å; D57-K59 PolarHBondContact O-N 2.98Å; K59-V61 HydrophobicContact CB-CG2 4.23Å; K59-V61 HydrophobicContact CD-CG2 4.17Å; K59-V61 HydrophobicContact CG-CG2 3.89Å; K59-V61 WeakPolarHBondContact O-CG2 3.4Å; K59-V61 PolarHBondContact O-N 3.07Å
60	Y	89.2	Confident	75.2	Confident	137 Å²	137	119.3 Å²	119.3	54%	0.537	58%	0.577	S	S	.	*			trans	-63.6	98.9	172.1	-63.1	-86.9	0	0	0	109.2	E58 P111 K172	E58-Y60 WeakPolarHBondContact O-CD2 3.27Å; E58-Y60 PolarHBondContact O-N 2.74Å; Y60-P111 HydrophobicContact CD1-CB 3.95Å; Y60-P111 HydrophobicContact CD1-CG 4.42Å; Y60-K172 PolarHBondContact OH-NZ 2.8Å
61	V	96.2	Very high	77.8	Confident	61 Å²	61	108.2 Å²	108.2	37%	0.37	54%	0.536	S	S	.	.			trans	-109.4	113.6	180	-179.4	0	0	0	0	109.6	K59 R63	K59-V61 HydrophobicContact CB-CG2 4.23Å; K59-V61 HydrophobicContact CD-CG2 4.17Å; K59-V61 HydrophobicContact CG-CG2 3.89Å; K59-V61 WeakPolarHBondContact O-CG2 3.4Å; K59-V61 PolarHBondContact O-N 3.07Å; V61-R63 HydrophobicContact CG1-CG 3.99Å; V61-R63 PolarHBondContact O-N 3.03Å
62	L	97.9	Very high	80.7	Confident	35 Å²	35	105.1 Å²	105.1	18%	0.183	52%	0.517	C	S	.	.			trans	-76.9	116.7	163.5	175.4	62.5	0	0	0	108.9	Y84 I108 V110 L168	L62-Y84 HydrophobicContact CD2-CD2 4.04Å; L62-Y84 HydrophobicContact CD2-CE2 4.25Å; L62-I108 HydrophobicContact CD1-CB 4.31Å; L62-V110 HydrophobicContact CD1-CB 4.48Å; L62-V110 HydrophobicContact CD1-CG1 3.92Å; L62-L168 HydrophobicContact CD1-CD2 4.34Å; L62-L168 HydrophobicContact CD2-CD2 3.92Å
63	R	98.5	Very high	83.1	Confident	159 Å²	159	100 Å²	100	60%	0.6	50%	0.498	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.1	146	174.3	-69.7	175.4	-87.1	-117.7	-1.3	109.7	V61 I108 A109	V61-R63 HydrophobicContact CG1-CG 3.99Å; V61-R63 PolarHBondContact O-N 3.03Å; R63-I108 CarbonylContact O-C 3.43Å; R63-I108 WeakPolarHBondContact O-CA 3.45Å; R63-A109 HydrophobicContact CB-CB 4.24Å; R63-A109 PolarHBondContact N-O 3.35Å; R63-A109 PolarHBondContact O-N 2.72Å
64	F	98.8	Very high	85.8	Confident	87 Å²	87	95.8 Å²	95.8	38%	0.382	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	158.4	174.1	77.2	-77.1	0	0	0	111.1	K66 T73 I106 Q107 I108	F64-K66 HydrophobicContact CE2-CG 4.36Å; F64-T73 HydrophobicContact CE1-CG2 4.09Å; F64-T73 HydrophobicContact CE2-CG2 4.22Å; F64-T73 HydrophobicContact CZ-CG2 3.48Å; F64-T73 VanDerWaalsContact CZ-CG2 3.48Å; F64-I106 HydrophobicContact CD2-CG2 4.17Å; F64-Q107 CarbonylContact C-O 3.53Å; F64-Q107 WeakPolarHBondContact CA-O 3.3Å; F64-Q107 WeakPolarHBondContact CB-O 3.33Å; F64-I108 HydrophobicContact CB-CG2 4.01Å
65	S	98.8	Very high	88.5	Confident	58 Å²	58	90.9 Å²	90.9	41%	0.406	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	146.8	168.6	-173.6	0	0	0	0	109.7	I106 Q107	S65-I106 VanDerWaalsContact O-CA 3.27Å; S65-I106 WeakPolarHBondContact O-CA 3.49Å; S65-Q107 PolarHBondContact N-O 2.74Å; S65-Q107 PolarHBondContact O-N 3.46Å
66	K	98.8	Very high	90.7	Very high	97 Å²	97	89.5 Å²	89.5	42%	0.422	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	133.8	173.9	-64.5	-174.4	178.1	-164.9	0	109.5	F64 A71 T73 I106	F64-K66 HydrophobicContact CE2-CG 4.36Å; K66-A71 HydrophobicContact CB-CB 3.87Å; K66-A71 HydrophobicContact CD-CB 4Å; K66-A71 VanDerWaalsContact CE-O 3.32Å; K66-A71 WeakPolarHBondContact CE-O 3.4Å; K66-A71 HydrophobicContact CG-CB 3.77Å; K66-A71 PolarHBondContact NZ-O 2.78Å; K66-T73 WeakPolarHBondContact CE-OG1 3.37Å; K66-I106 HydrophobicContact CG-CG2 4.38Å
67	L	98.8	Very high	92.7	Very high	80 Å²	80	86.7 Å²	86.7	42%	0.419	44%	0.436	S	S	.	.	S	Bend	trans	-94	-14.6	178	-60.2	175.9	0	0	0	112.2	D105 Q107 N144	L67-D105 HydrophobicContact CB-CB 4.46Å; L67-D105 WeakPolarHBondContact CB-O 3.44Å; L67-D105 PolarHBondContact N-O 3.41Å; L67-Q107 HydrophobicContact CD1-CB 4.36Å; L67-Q107 HydrophobicContact CD2-CB 4.3Å; L67-Q107 HydrophobicContact CD2-CG 3.99Å; L67-Q107 HydrophobicContact CG-CB 4.48Å; L67-Q107 HydrophobicContact CG-CG 4.48Å; L67-N144 HydrophobicContact CD1-CB 3.62Å
68	S	98.8	Very high	94.7	Very high	35 Å²	35	82.2 Å²	82.2	25%	0.245	42%	0.418	C	S	.	.	S	Bend	trans	-151.4	171	176.7	81.6	0	0	0	0	111.5	H70 A71 D105	S68-H70 PolarHBondContact O-N 3.07Å; S68-H70 WeakPolarHBondContact OG-CB 3.38Å; S68-H70 PolarHBondContact OG-N 2.85Å; S68-A71 PolarHBondContact O-N 2.83Å; S68-D105 VanDerWaalsContact CB-OD2 3.27Å; S68-D105 WeakPolarHBondContact CB-OD2 3.48Å; S68-D105 WeakPolarHBondContact OG-CB 3.35Å; S68-D105 PolarHBondContact OG-OD2 3.5Å
69	E	98.5	Very high	96.5	Very high	174 Å²	174	79.5 Å²	79.5	81%	0.813	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-13.6	171.2	68.2	-175.9	-172.4	0	0	113.5
70	H	98.7	Very high	97.6	Very high	50 Å²	50	80 Å²	80	23%	0.231	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-16.9	179.9	-54.4	-25.2	0	0	0	112.8	S68 A89 Y90 K161	S68-H70 PolarHBondContact O-N 3.07Å; S68-H70 WeakPolarHBondContact OG-CB 3.38Å; S68-H70 PolarHBondContact OG-N 2.85Å; H70-A89 HydrophobicContact CB-CB 4.04Å; H70-A89 WeakPolarHBondContact CB-O 3.46Å; H70-Y90 AromaticContact CD2-CE1 3.39Å; H70-Y90 WeakPolarHBondContact CD2-CE1 3.4Å; H70-Y90 AromaticContact CD2-CZ 3.9Å; H70-K161 HydrophobicContact CB-CD 4.48Å; H70-K161 PolarHBondContact ND1-NZ 3.18Å
71	A	98.8	Very high	98	Very high	3 Å²	3	74.6 Å²	74.6	3%	0.025	41%	0.406	C	S	.	.			trans	-67.2	136.3	-179.8	0	0	0	0	0	112.5	K66 S68 D105 I106	K66-A71 HydrophobicContact CB-CB 3.87Å; K66-A71 HydrophobicContact CD-CB 4Å; K66-A71 VanDerWaalsContact CE-O 3.32Å; K66-A71 WeakPolarHBondContact CE-O 3.4Å; K66-A71 HydrophobicContact CG-CB 3.77Å; K66-A71 PolarHBondContact NZ-O 2.78Å; S68-A71 PolarHBondContact O-N 2.83Å; A71-D105 HydrophobicContact CB-CB 3.8Å; A71-D105 WeakPolarHBondContact CB-O 3.31Å; A71-I106 HydrophobicContact CB-CG2 3.98Å
72	T	98.9	Very high	98.1	Very high	53 Å²	53	75.5 Å²	75.5	33%	0.325	42%	0.42	S	S	.	.			trans	-109.3	138.6	175.5	-59.5	0	0	0	0	110.1	P74 Y87	T72-P74 WeakPolarHBondContact O-CD 3.26Å; T72-Y87 HydrophobicContact CG2-CD1 3.75Å; T72-Y87 HydrophobicContact CG2-CD2 3.87Å; T72-Y87 HydrophobicContact CG2-CE1 3.96Å; T72-Y87 HydrophobicContact CG2-CE2 4.1Å; T72-Y87 HydrophobicContact CG2-CG 3.69Å
73	T	98.8	Very high	98.1	Very high	64 Å²	64	74 Å²	74	39%	0.393	41%	0.412	S	S	.	.			trans	-62.8	126.6	178.3	-63.8	0	0	0	0	109.7	F64 K66 T75	F64-T73 HydrophobicContact CE1-CG2 4.09Å; F64-T73 HydrophobicContact CE2-CG2 4.22Å; F64-T73 HydrophobicContact CZ-CG2 3.48Å; F64-T73 VanDerWaalsContact CZ-CG2 3.48Å; K66-T73 WeakPolarHBondContact CE-OG1 3.37Å; T73-T75 WeakPolarHBondContact O-CG2 3.32Å
74	P	98.8	Very high	98.1	Very high	16 Å²	16	70.6 Å²	70.6	10%	0.104	40%	0.4	C	S	.	.			trans	-57.7	141.3	176.1	-25.1	34.7	0	0	0	111.9	T72 Y84 D85 L86 I106	T72-P74 WeakPolarHBondContact O-CD 3.26Å; P74-Y84 HydrophobicContact CB-CD1 4.24Å; P74-Y84 HydrophobicContact CB-CG 4.38Å; P74-D85 VanDerWaalsContact CA-O 3.3Å; P74-D85 WeakPolarHBondContact CA-O 3.28Å; P74-D85 WeakPolarHBondContact CB-O 3.38Å; P74-L86 HydrophobicContact CB-CD2 4.41Å; P74-L86 HydrophobicContact CG-CD2 4.13Å; P74-I106 HydrophobicContact CG-CD1 3.57Å
75	T	98.6	Very high	98.1	Very high	55 Å²	55	67 Å²	67	34%	0.337	39%	0.385	S	S	.	.	B	Isolated β-bridge	trans	-126.9	158.9	-176.6	67.2	0	0	0	0	111.5	T73 Y84 D85 Y87	T73-T75 WeakPolarHBondContact O-CG2 3.32Å; T75-Y84 CarbonylContact O-C 3.57Å; T75-Y84 VanDerWaalsContact O-CA 3.24Å; T75-Y84 WeakPolarHBondContact O-CA 3.28Å; T75-D85 PolarHBondContact N-O 2.96Å; T75-D85 PolarHBondContact O-N 2.82Å; T75-Y87 HydrophobicContact CG2-CE2 4.23Å; T75-Y87 WeakPolarHBondContact CG2-OH 3.48Å; T75-Y87 PolarHBondContact OG1-OH 2.89Å
76	R	97.4	Very high	98.1	Very high	105 Å²	105	64.3 Å²	64.3	40%	0.396	37%	0.366	S	S	.	.			trans	-100.8	132.6	172.4	-68.7	179.9	72.2	-149.4	4.2	109.6	S78 A79 K80 A81 Y84	R76-S78 PolarHBondContact O-N 2.65Å; R76-A79 PolarHBondContact NH1-O 2.97Å; R76-A79 PolarHBondContact NH2-O 3.37Å; R76-K80 VanDerWaalsContact NH2-C 3.27Å; R76-K80 VanDerWaalsContact NH2-CA 3.3Å; R76-A81 HydrophobicContact CB-CB 4.34Å; R76-A81 PolarHBondContact NE-O 2.91Å; R76-A81 VanDerWaalsContact NE-O 3.12Å; R76-A81 PolarHBondContact NH2-O 2.59Å; R76-Y84 HydrophobicContact CG-CD1 3.63Å; R76-Y84 HydrophobicContact CG-CD2 4.3Å; R76-Y84 HydrophobicContact CG-CE1 3.55Å; R76-Y84 HydrophobicContact CG-CE2 4.22Å; R76-Y84 HydrophobicContact CG-CG 4.01Å
77	G	94.1	Very high	98.1	Very high	62 Å²	62	61.3 Å²	61.3	64%	0.639	35%	0.352	S	S	*	.	S	Bend	trans	-68.8	-20.5	176.5	0	0	0	0	0	114.1
78	S	97.3	Very high	98.1	Very high	66 Å²	66	57.5 Å²	57.5	46%	0.462	33%	0.333	S	S	.	.	S	Bend	trans	-157.6	167.4	175.3	75.8	0	0	0	0	111.2	R76 K80 A81	R76-S78 PolarHBondContact O-N 2.65Å; S78-K80 PolarHBondContact O-N 3.25Å; S78-K80 VanDerWaalsContact O-N 3.09Å; S78-A81 WeakPolarHBondContact O-CB 3.23Å; S78-A81 PolarHBondContact O-N 2.63Å; S78-A81 VanDerWaalsContact O-N 3.12Å; S78-A81 PolarHBondContact OG-N 3.26Å; S78-A81 VanDerWaalsContact OG-N 3.09Å
79	A	96.6	Very high	98.1	Very high	91 Å²	91	55.9 Å²	55.9	75%	0.752	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-24.3	-179.9	0	0	0	0	0	114.1	R76	R76-A79 PolarHBondContact NH1-O 2.97Å; R76-A79 PolarHBondContact NH2-O 3.37Å
80	K	96.9	Very high	98.1	Very high	193 Å²	193	51.6 Å²	51.6	84%	0.839	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.9	14	179.3	-64.2	-173.1	179.7	-178.2	0	113	R76 S78 A82	R76-K80 VanDerWaalsContact NH2-C 3.27Å; R76-K80 VanDerWaalsContact NH2-CA 3.3Å; S78-K80 PolarHBondContact O-N 3.25Å; S78-K80 VanDerWaalsContact O-N 3.09Å; K80-A82 PolarHBondContact O-N 2.84Å
81	A	97.8	Very high	98.1	Very high	22 Å²	22	54 Å²	54	18%	0.182	31%	0.313	C	S	.	.			trans	-57.8	131.4	174.1	0	0	0	0	0	110.2	R76 S78 G83	R76-A81 HydrophobicContact CB-CB 4.34Å; R76-A81 PolarHBondContact NE-O 2.91Å; R76-A81 VanDerWaalsContact NE-O 3.12Å; R76-A81 PolarHBondContact NH2-O 2.59Å; S78-A81 WeakPolarHBondContact O-CB 3.23Å; S78-A81 PolarHBondContact O-N 2.63Å; S78-A81 VanDerWaalsContact O-N 3.12Å; S78-A81 PolarHBondContact OG-N 3.26Å; S78-A81 VanDerWaalsContact OG-N 3.09Å; A81-G83 VanDerWaalsContact C-N 3.35Å
82	A	98	Very high	98.1	Very high	81 Å²	81	56.1 Å²	56.1	67%	0.669	32%	0.321	S	S	*	.	S	Bend	trans	-67.3	-37	-177.3	0	0	0	0	0	112.2	K80	K80-A82 PolarHBondContact O-N 2.84Å
83	G	98.1	Very high	98.1	Very high	2 Å²	2	57.5 Å²	57.5	2%	0.021	33%	0.332	C	S	.	.	S	Bend	trans	-114.9	161.3	-178.5	0	0	0	0	0	114.3	A81 L168	A81-G83 VanDerWaalsContact C-N 3.35Å; G83-L168 CarbonylContact C-O 3.56Å; G83-L168 WeakPolarHBondContact CA-O 3.41Å
84	Y	98.8	Very high	98.1	Very high	88 Å²	88	54.5 Å²	54.5	35%	0.345	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	123.6	165.3	-73	-98.3	0	0	0	109.4	L62 P74 T75 R76 L86 Q167 L168	L62-Y84 HydrophobicContact CD2-CD2 4.04Å; L62-Y84 HydrophobicContact CD2-CE2 4.25Å; P74-Y84 HydrophobicContact CB-CD1 4.24Å; P74-Y84 HydrophobicContact CB-CG 4.38Å; T75-Y84 CarbonylContact O-C 3.57Å; T75-Y84 VanDerWaalsContact O-CA 3.24Å; T75-Y84 WeakPolarHBondContact O-CA 3.28Å; R76-Y84 HydrophobicContact CG-CD1 3.63Å; R76-Y84 HydrophobicContact CG-CD2 4.3Å; R76-Y84 HydrophobicContact CG-CE1 3.55Å; R76-Y84 HydrophobicContact CG-CE2 4.22Å; R76-Y84 HydrophobicContact CG-CG 4.01Å; Y84-L86 PolarHBondContact O-N 3.41Å; Y84-Q167 CarbonylContact O-C 3.58Å; Y84-Q167 WeakPolarHBondContact O-CA 3.14Å; Y84-L168 PolarHBondContact N-O 2.88Å; Y84-L168 PolarHBondContact O-N 2.65Å
85	D	98.9	Very high	98.1	Very high	12 Å²	12	54.6 Å²	54.6	6%	0.064	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.6	128.2	172.5	-77.5	-40.6	0	0	0	109.7	P74 T75 Y87 R121 R164	P74-D85 VanDerWaalsContact CA-O 3.3Å; P74-D85 WeakPolarHBondContact CA-O 3.28Å; P74-D85 WeakPolarHBondContact CB-O 3.38Å; T75-D85 PolarHBondContact N-O 2.96Å; T75-D85 PolarHBondContact O-N 2.82Å; D85-Y87 HydrophobicContact CB-CE2 4.25Å; D85-Y87 WeakPolarHBondContact O-CD2 3.38Å; D85-Y87 WeakPolarHBondContact O-CE2 3.46Å; D85-R121 IonicContact OD1-CZ 3.9Å; D85-R121 IonicContact OD1-NE 3.79Å; D85-R121 PolarHBondContact OD1-NE 3.28Å; D85-R121 IonicContact OD1-NH2 2.99Å; D85-R164 HydrophobicContact CB-CB 4.35Å; D85-R164 HydrophobicContact CB-CG 4.01Å; D85-R164 WeakPolarHBondContact OD2-CD 3.47Å; D85-R164 IonicContact OD2-CZ 2.86Å; D85-R164 IonicContact OD2-NE 2.78Å; D85-R164 IonicContact OD2-NH1 3.86Å; D85-R164 PolarHBondContact OD2-NH1 2.94Å
86	L	98.9	Very high	98.1	Very high	1 Å²	1	54.9 Å²	54.9	1%	0.005	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	139.9	173.4	-65.5	-179.5	0	0	0	109.9	P74 Y84 T104 I106 V118 V145 V147 R164 V165 A166 L168	P74-L86 HydrophobicContact CB-CD2 4.41Å; P74-L86 HydrophobicContact CG-CD2 4.13Å; Y84-L86 PolarHBondContact O-N 3.41Å; L86-T104 HydrophobicContact CB-CG2 4.2Å; L86-T104 HydrophobicContact CD1-CG2 4.45Å; L86-I106 HydrophobicContact CD2-CD1 4.06Å; L86-V118 HydrophobicContact CD1-CG1 4.08Å; L86-V118 HydrophobicContact CD1-CG2 4.37Å; L86-V145 HydrophobicContact CD1-CG1 4.31Å; L86-V147 HydrophobicContact CB-CG2 4.48Å; L86-V147 HydrophobicContact CD1-CG2 3.99Å; L86-R164 CarbonylContact O-C 3.39Å; L86-R164 WeakPolarHBondContact O-CA 3.11Å; L86-V165 PolarHBondContact O-N 2.8Å; L86-A166 PolarHBondContact N-O 3.25Å; L86-L168 HydrophobicContact CD1-CB 4.1Å; L86-L168 HydrophobicContact CD2-CB 4.07Å; L86-L168 HydrophobicContact CG-CB 4.07Å
87	Y	98.9	Very high	98.2	Very high	34 Å²	34	56.7 Å²	56.7	13%	0.133	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	140	-171.4	-65.7	-101.6	0	0	0	110.7	T72 T75 D85 T104 G162 D163 R164	T72-Y87 HydrophobicContact CG2-CD1 3.75Å; T72-Y87 HydrophobicContact CG2-CD2 3.87Å; T72-Y87 HydrophobicContact CG2-CE1 3.96Å; T72-Y87 HydrophobicContact CG2-CE2 4.1Å; T72-Y87 HydrophobicContact CG2-CG 3.69Å; T75-Y87 HydrophobicContact CG2-CE2 4.23Å; T75-Y87 WeakPolarHBondContact CG2-OH 3.48Å; T75-Y87 PolarHBondContact OG1-OH 2.89Å; D85-Y87 HydrophobicContact CB-CE2 4.25Å; D85-Y87 WeakPolarHBondContact O-CD2 3.38Å; D85-Y87 WeakPolarHBondContact O-CE2 3.46Å; Y87-T104 WeakPolarHBondContact O-CA 3.38Å; Y87-G162 VanDerWaalsContact CD1-O 3.28Å; Y87-G162 WeakPolarHBondContact CD1-O 3.26Å; Y87-D163 CarbonylContact C-O 3.53Å; Y87-D163 VanDerWaalsContact CA-O 3.27Å; Y87-D163 WeakPolarHBondContact CA-O 3.36Å; Y87-R164 HydrophobicContact CD1-CG 3.72Å; Y87-R164 HydrophobicContact CE1-CG 3.31Å; Y87-R164 HydrophobicContact CE2-CG 4.26Å; Y87-R164 HydrophobicContact CG-CG 4.36Å
88	S	98.9	Very high	98.4	Very high	1 Å²	1	58 Å²	58	1%	0.007	33%	0.33	C	S	.	.			trans	-68.3	131.9	170.3	-171.8	0	0	0	0	110.6	Y90 Y92 V102 V159 G162 D163	S88-Y90 VanDerWaalsContact C-N 3.34Å; S88-Y90 PolarHBondContact OG-N 3.46Å; S88-Y90 PolarHBondContact OG-O 2.95Å; S88-Y92 WeakPolarHBondContact OG-CE2 3.4Å; S88-V102 WeakPolarHBondContact OG-CG1 3.48Å; S88-V159 VanDerWaalsContact CB-CG1 3.46Å; S88-G162 PolarHBondContact O-N 3.12Å; S88-D163 PolarHBondContact N-O 3.06Å
89	A	98.9	Very high	98.5	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	33%	0.333	C	S	.	.	S	Bend	trans	-81.2	-15.7	171.3	0	0	0	0	0	112.7	H70 K103 D105 K161	H70-A89 HydrophobicContact CB-CB 4.04Å; H70-A89 WeakPolarHBondContact CB-O 3.46Å; A89-K103 WeakPolarHBondContact CB-O 3.21Å; A89-K103 PolarHBondContact N-O 2.94Å; A89-D105 HydrophobicContact CB-CB 3.84Å; A89-K161 WeakPolarHBondContact O-CD 3.46Å; A89-K161 WeakPolarHBondContact O-CG 3.47Å
90	Y	98.9	Very high	98.6	Very high	85 Å²	85	57.2 Å²	57.2	33%	0.333	30%	0.304	S	S	.	.	S	Bend	trans	-142.2	171.5	-172.5	-53.5	-84.9	0	0	0	112.6	H70 S88 Y92 K103 D105 K161	H70-Y90 AromaticContact CD2-CE1 3.39Å; H70-Y90 WeakPolarHBondContact CD2-CE1 3.4Å; H70-Y90 AromaticContact CD2-CZ 3.9Å; S88-Y90 VanDerWaalsContact C-N 3.34Å; S88-Y90 PolarHBondContact OG-N 3.46Å; S88-Y90 PolarHBondContact OG-O 2.95Å; Y90-Y92 WeakPolarHBondContact O-CD2 3.26Å; Y90-Y92 WeakPolarHBondContact O-CE2 3.46Å; Y90-K103 HydrophobicContact CD2-CB 4.07Å; Y90-K103 HydrophobicContact CE2-CB 4.02Å; Y90-K103 HydrophobicContact CE2-CD 4.14Å; Y90-D105 WeakPolarHBondContact CE2-OD2 3.36Å; Y90-D105 PolarHBondContact OH-OD2 2.83Å; Y90-K161 PolarHBondContact O-N 2.64Å
91	D	98.9	Very high	98.7	Very high	101 Å²	101	53.2 Å²	53.2	54%	0.54	29%	0.291	S	S	.	.			trans	-84.5	140.1	171.7	-68.9	5	0	0	0	110.4	V159 K160 K161	D91-V159 CarbonylContact C-O 3.55Å; D91-V159 VanDerWaalsContact CA-O 3.26Å; D91-V159 WeakPolarHBondContact CA-O 3.27Å; D91-K160 WeakPolarHBondContact OD1-CA 3.21Å; D91-K161 PolarHBondContact OD1-N 2.96Å
92	Y	98.8	Very high	98.7	Very high	47 Å²	47	52.1 Å²	52.1	18%	0.184	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	145.3	174.7	-57.6	-100.7	0	0	0	110.1	S88 Y90 A100 V102 K103 V159	S88-Y92 WeakPolarHBondContact OG-CE2 3.4Å; Y90-Y92 WeakPolarHBondContact O-CD2 3.26Å; Y90-Y92 WeakPolarHBondContact O-CE2 3.46Å; Y92-A100 HydrophobicContact CD1-CB 4.42Å; Y92-V102 HydrophobicContact CD1-CG2 4.5Å; Y92-V102 HydrophobicContact CD2-CB 4.41Å; Y92-V102 HydrophobicContact CD2-CG1 4.04Å; Y92-V102 HydrophobicContact CD2-CG2 3.98Å; Y92-V102 HydrophobicContact CE2-CB 4.2Å; Y92-V102 HydrophobicContact CE2-CG1 3.75Å; Y92-V102 HydrophobicContact CE2-CG2 4.25Å; Y92-V102 HydrophobicContact CG-CG2 4.14Å; Y92-K103 PolarHBondContact OH-N 3.33Å; Y92-V159 HydrophobicContact CD2-CB 4.43Å; Y92-V159 HydrophobicContact CD2-CG1 4.27Å; Y92-V159 PolarHBondContact N-O 2.87Å; Y92-V159 PolarHBondContact O-N 3.39Å
93	S	98.7	Very high	98.8	Very high	81 Å²	81	53.2 Å²	53.2	57%	0.566	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.9	117.1	167.8	-61	0	0	0	0	108.1	E158	S93-E158 VanDerWaalsContact CB-OE1 3.23Å; S93-E158 WeakPolarHBondContact CB-OE1 3.26Å; S93-E158 VanDerWaalsContact OG-CD 3.24Å; S93-E158 PolarHBondContact OG-OE1 3.09Å; S93-E158 PolarHBondContact OG-OE2 2.85Å
94	I	98.8	Very high	98.8	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	109.5	-178.3	-46.3	-177.9	0	0	0	108.3	D98 A100 L149 N151 T156 F157 V159	I94-D98 HydrophobicContact CG2-CB 4.38Å; I94-A100 HydrophobicContact CD1-CB 3.73Å; I94-A100 HydrophobicContact CG1-CB 3.77Å; I94-L149 HydrophobicContact CD1-CB 3.72Å; I94-L149 HydrophobicContact CD1-CD1 3.85Å; I94-L149 HydrophobicContact CD1-CG 4.42Å; I94-N151 HydrophobicContact CB-CB 4.34Å; I94-N151 HydrophobicContact CG2-CB 3.71Å; I94-N151 PolarHBondContact O-ND2 3.34Å; I94-T156 CarbonylContact O-C 3.6Å; I94-T156 WeakPolarHBondContact O-CA 3.46Å; I94-F157 HydrophobicContact CD1-CD1 4.38Å; I94-F157 PolarHBondContact N-O 3.43Å; I94-F157 PolarHBondContact O-N 3.14Å; I94-V159 HydrophobicContact CD1-CG2 4.34Å
95	G	98.8	Very high	98.8	Very high	19 Å²	19	49.4 Å²	49.4	20%	0.196	26%	0.257	C	S	.	.			trans	-61.5	164	-179.7	0	0	0	0	0	113.1	L97 D98 N151	G95-L97 PolarHBondContact O-N 2.85Å; G95-D98 WeakPolarHBondContact O-CB 3.49Å; G95-D98 PolarHBondContact O-N 3.27Å; G95-N151 WeakPolarHBondContact O-CB 3.21Å; G95-N151 PolarHBondContact O-ND2 2.76Å; G95-N151 VanDerWaalsContact O-ND2 3.12Å
96	P	98.7	Very high	98.8	Very high	61 Å²	61	48.9 Å²	48.9	40%	0.396	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	134.7	171.1	-23.6	34.5	0	0	0	111.4	D98 G153 K154	P96-D98 PolarHBondContact O-N 2.86Å; P96-G153 WeakPolarHBondContact CA-O 3.5Å; P96-G153 WeakPolarHBondContact CB-O 3.28Å; P96-K154 VanDerWaalsContact CG-O 3.25Å; P96-K154 WeakPolarHBondContact CG-O 3.33Å
97	L	98.3	Very high	98.8	Very high	143 Å²	143	51.9 Å²	51.9	75%	0.749	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	25.3	-178.6	-51.7	178	0	0	0	114.3	G95 N151	G95-L97 PolarHBondContact O-N 2.85Å; L97-N151 WeakPolarHBondContact CA-O 3.41Å; L97-N151 PolarHBondContact N-O 2.8Å
98	D	98.7	Very high	98.8	Very high	88 Å²	88	50.5 Å²	50.5	47%	0.471	26%	0.263	S	S	.	.			trans	-115.3	178.4	179.9	-160.1	6	0	0	0	111.8	I94 G95 P96 N151	I94-D98 HydrophobicContact CG2-CB 4.38Å; G95-D98 WeakPolarHBondContact O-CB 3.49Å; G95-D98 PolarHBondContact O-N 3.27Å; P96-D98 PolarHBondContact O-N 2.86Å; D98-N151 PolarHBondContact O-N 3.02Å
99	K	98.8	Very high	98.8	Very high	124 Å²	124	51.2 Å²	51.2	54%	0.539	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	150.6	-179.7	67.8	-176.8	174.5	53.7	0	112.6	L149 F150	K99-L149 WeakPolarHBondContact CA-O 3.47Å; K99-L149 WeakPolarHBondContact CB-O 3.37Å; K99-F150 HydrophobicContact CB-CD1 3.62Å; K99-F150 HydrophobicContact CB-CE1 3.83Å; K99-F150 HydrophobicContact CD-CD1 4.44Å; K99-F150 HydrophobicContact CD-CE1 3.8Å; K99-F150 HydrophobicContact CG-CE1 4.44Å
100	A	98.8	Very high	98.8	Very high	18 Å²	18	51.6 Å²	51.6	15%	0.149	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	151.3	169.6	0	0	0	0	0	111.5	Y92 I94 V148 L149	Y92-A100 HydrophobicContact CD1-CB 4.42Å; I94-A100 HydrophobicContact CD1-CB 3.73Å; I94-A100 HydrophobicContact CG1-CB 3.77Å; A100-V148 WeakPolarHBondContact O-CA 3.15Å; A100-L149 PolarHBondContact N-O 3.3Å; A100-L149 PolarHBondContact O-N 2.78Å
101	I	98.8	Very high	98.7	Very high	108 Å²	108	48.1 Å²	48.1	55%	0.554	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.6	98.4	167.9	-53.5	-178.9	0	0	0	107.2	K103 V147 V148	I101-K103 PolarHBondContact O-N 3.33Å; I101-V147 CarbonylContact C-O 3.56Å; I101-V147 WeakPolarHBondContact CA-O 3.48Å; I101-V148 HydrophobicContact CG1-CG2 4.35Å
102	V	98.9	Very high	98.6	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	112.4	178.6	177.2	0	0	0	0	109	S88 Y92 V147 L149 V159 V165	S88-V102 WeakPolarHBondContact OG-CG1 3.48Å; Y92-V102 HydrophobicContact CD1-CG2 4.5Å; Y92-V102 HydrophobicContact CD2-CB 4.41Å; Y92-V102 HydrophobicContact CD2-CG1 4.04Å; Y92-V102 HydrophobicContact CD2-CG2 3.98Å; Y92-V102 HydrophobicContact CE2-CB 4.2Å; Y92-V102 HydrophobicContact CE2-CG1 3.75Å; Y92-V102 HydrophobicContact CE2-CG2 4.25Å; Y92-V102 HydrophobicContact CG-CG2 4.14Å; V102-V147 HydrophobicContact CB-CB 4.29Å; V102-V147 PolarHBondContact N-O 2.98Å; V102-V147 PolarHBondContact O-N 3.15Å; V102-L149 HydrophobicContact CG2-CD1 3.75Å; V102-L149 HydrophobicContact CG2-CG 4.12Å; V102-V159 HydrophobicContact CG1-CG1 4.39Å; V102-V165 HydrophobicContact CG1-CG1 4.47Å; V102-V165 HydrophobicContact CG1-CG2 4.05Å
103	K	98.9	Very high	98.5	Very high	104 Å²	104	48.4 Å²	48.4	45%	0.452	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	138.9	176.6	-65	-179.9	-179.6	177.5	0	111.2	A89 Y90 Y92 I101	A89-K103 WeakPolarHBondContact CB-O 3.21Å; A89-K103 PolarHBondContact N-O 2.94Å; Y90-K103 HydrophobicContact CD2-CB 4.07Å; Y90-K103 HydrophobicContact CE2-CB 4.02Å; Y90-K103 HydrophobicContact CE2-CD 4.14Å; Y92-K103 PolarHBondContact OH-N 3.33Å; I101-K103 PolarHBondContact O-N 3.33Å
104	T	98.9	Very high	98.5	Very high	3 Å²	3	44.7 Å²	44.7	2%	0.018	24%	0.237	C	C	.	.			trans	-97.9	-18.1	174	63.4	0	0	0	0	112.8	L86 Y87 I106 V145 V147	L86-T104 HydrophobicContact CB-CG2 4.2Å; L86-T104 HydrophobicContact CD1-CG2 4.45Å; Y87-T104 WeakPolarHBondContact O-CA 3.38Å; T104-I106 PolarHBondContact O-N 3.31Å; T104-I106 VanDerWaalsContact OG1-CG1 3.26Å; T104-I106 WeakPolarHBondContact OG1-CG1 3.42Å; T104-I106 PolarHBondContact OG1-N 2.83Å; T104-V145 WeakPolarHBondContact CB-O 3.25Å; T104-V145 VanDerWaalsContact CG2-O 3.31Å; T104-V145 WeakPolarHBondContact CG2-O 3.26Å; T104-V145 PolarHBondContact N-O 2.84Å; T104-V145 PolarHBondContact OG1-O 2.98Å; T104-V147 HydrophobicContact CG2-CG2 3.91Å
105	D	98.9	Very high	98.5	Very high	6 Å²	6	46.5 Å²	46.5	3%	0.032	24%	0.244	C	C	.	.			trans	55	30.2	-172.4	-72.8	2.1	0	0	0	113.5	L67 S68 A71 A89 Y90 N144	L67-D105 HydrophobicContact CB-CB 4.46Å; L67-D105 WeakPolarHBondContact CB-O 3.44Å; L67-D105 PolarHBondContact N-O 3.41Å; S68-D105 VanDerWaalsContact CB-OD2 3.27Å; S68-D105 WeakPolarHBondContact CB-OD2 3.48Å; S68-D105 WeakPolarHBondContact OG-CB 3.35Å; S68-D105 PolarHBondContact OG-OD2 3.5Å; A71-D105 HydrophobicContact CB-CB 3.8Å; A71-D105 WeakPolarHBondContact CB-O 3.31Å; A89-D105 HydrophobicContact CB-CB 3.84Å; Y90-D105 WeakPolarHBondContact CE2-OD2 3.36Å; Y90-D105 PolarHBondContact OH-OD2 2.83Å; D105-N144 PolarHBondContact N-OD1 3.11Å; D105-N144 PolarHBondContact OD1-ND2 2.9Å
106	I	98.9	Very high	98.5	Very high	2 Å²	2	45.6 Å²	45.6	1%	0.01	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	148.5	164.4	63.3	166.5	0	0	0	110.2	F64 S65 K66 A71 P74 L86 T104 I108 V145	F64-I106 HydrophobicContact CD2-CG2 4.17Å; S65-I106 VanDerWaalsContact O-CA 3.27Å; S65-I106 WeakPolarHBondContact O-CA 3.49Å; K66-I106 HydrophobicContact CG-CG2 4.38Å; A71-I106 HydrophobicContact CB-CG2 3.98Å; P74-I106 HydrophobicContact CG-CD1 3.57Å; L86-I106 HydrophobicContact CD2-CD1 4.06Å; T104-I106 PolarHBondContact O-N 3.31Å; T104-I106 VanDerWaalsContact OG1-CG1 3.26Å; T104-I106 WeakPolarHBondContact OG1-CG1 3.42Å; T104-I106 PolarHBondContact OG1-N 2.83Å; I106-I108 HydrophobicContact CD1-CG2 3.88Å; I106-I108 HydrophobicContact CG1-CG2 4.38Å; I106-V145 HydrophobicContact CG1-CB 4.38Å; I106-V145 PolarHBondContact O-N 3.43Å
107	Q	98.9	Very high	98.5	Very high	64 Å²	64	46.6 Å²	46.6	30%	0.299	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	151.3	159.5	62.9	-178	25.8	0	0	108.4	F64 S65 L67 R142 G143	F64-Q107 CarbonylContact C-O 3.53Å; F64-Q107 WeakPolarHBondContact CA-O 3.3Å; F64-Q107 WeakPolarHBondContact CB-O 3.33Å; S65-Q107 PolarHBondContact N-O 2.74Å; S65-Q107 PolarHBondContact O-N 3.46Å; L67-Q107 HydrophobicContact CD1-CB 4.36Å; L67-Q107 HydrophobicContact CD2-CB 4.3Å; L67-Q107 HydrophobicContact CD2-CG 3.99Å; L67-Q107 HydrophobicContact CG-CB 4.48Å; L67-Q107 HydrophobicContact CG-CG 4.48Å; Q107-R142 WeakPolarHBondContact CB-O 3.24Å; Q107-R142 PolarHBondContact OE1-O 3.4Å; Q107-G143 WeakPolarHBondContact CA-O 3.22Å; Q107-G143 VanDerWaalsContact CB-O 3.28Å; Q107-G143 WeakPolarHBondContact CB-O 3.46Å
108	I	98.8	Very high	98.5	Very high	5 Å²	5	40.1 Å²	40.1	3%	0.026	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	160	-176.6	66.2	172.8	0	0	0	111.9	L62 R63 F64 I106 V110 V137 Y141 R142 V145 L168	L62-I108 HydrophobicContact CD1-CB 4.31Å; R63-I108 CarbonylContact O-C 3.43Å; R63-I108 WeakPolarHBondContact O-CA 3.45Å; F64-I108 HydrophobicContact CB-CG2 4.01Å; I106-I108 HydrophobicContact CD1-CG2 3.88Å; I106-I108 HydrophobicContact CG1-CG2 4.38Å; I108-V110 HydrophobicContact CD1-CG1 3.83Å; I108-V137 HydrophobicContact CD1-CB 4.37Å; I108-V137 HydrophobicContact CD1-CG1 3.78Å; I108-V137 HydrophobicContact CG1-CG1 4.1Å; I108-Y141 VanDerWaalsContact O-O 3.13Å; I108-R142 PolarHBondContact O-NH1 3.15Å; I108-V145 HydrophobicContact CB-CG2 4.47Å; I108-V145 HydrophobicContact CD1-CG2 4.11Å; I108-V145 HydrophobicContact CG1-CG2 3.85Å; I108-V145 HydrophobicContact CG2-CG2 4.03Å; I108-L168 HydrophobicContact CD1-CD1 4.24Å; I108-L168 HydrophobicContact CD1-CD2 3.65Å
109	A	98.7	Very high	98.5	Very high	16 Å²	16	36.1 Å²	36.1	13%	0.132	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	105.3	161.6	0	0	0	0	0	107.2	R63	R63-A109 HydrophobicContact CB-CB 4.24Å; R63-A109 PolarHBondContact N-O 3.35Å; R63-A109 PolarHBondContact O-N 2.72Å
110	V	98.4	Very high	98.5	Very high	7 Å²	7	32.5 Å²	32.5	4%	0.042	17%	0.165	C	C	.	.	P	Polyproline II helix	trans	-69.3	159.8	177.1	-63.6	0	0	0	0	110.5	L62 I108 C114 E139	L62-V110 HydrophobicContact CD1-CB 4.48Å; L62-V110 HydrophobicContact CD1-CG1 3.92Å; I108-V110 HydrophobicContact CD1-CG1 3.83Å; V110-C114 VanDerWaalsContact CG2-O 3.24Å; V110-C114 WeakPolarHBondContact CG2-O 3.35Å; V110-E139 HydrophobicContact CG2-CB 4.02Å; V110-E139 HydrophobicContact CG2-CG 3.99Å
111	P	97.8	Very high	98.5	Very high	13 Å²	13	34.1 Å²	34.1	8%	0.084	17%	0.168	C	C	.	.	P	Polyproline II helix	trans	-59.9	150	172	-19.9	31.9	0	0	0	111.4	Y60 C114	Y60-P111 HydrophobicContact CD1-CB 3.95Å; Y60-P111 HydrophobicContact CD1-CG 4.42Å; P111-C114 WeakPolarHBondContact O-CB 3.27Å; P111-C114 PolarHBondContact O-N 3.46Å; P111-C114 VanDerWaalsContact O-N 3.15Å
112	H	96.6	Very high	98.5	Very high	136 Å²	136	33.8 Å²	33.8	63%	0.63	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.6	141.2	175.9	-175.7	59.5	0	0	0	111.7	C114 E139	H112-C114 PolarHBondContact O-N 2.86Å; H112-E139 WeakPolarHBondContact CA-OE1 3.39Å; H112-E139 IonicContact CE1-OE1 2.78Å; H112-E139 IonicContact CG-OE1 3.41Å; H112-E139 IonicContact ND1-OE1 3.59Å; H112-E139 PolarHBondContact ND1-OE1 3.25Å; H112-E139 IonicContact ND1-OE2 3.91Å; H112-E139 PolarHBondContact ND1-OE2 3.23Å
113	G	96.8	Very high	98.4	Very high	17 Å²	17	35.4 Å²	35.4	18%	0.175	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.3	16	-177.1	0	0	0	0	0	113.2	E139 K172 I173	G113-E139 PolarHBondContact N-OE2 2.78Å; G113-K172 WeakPolarHBondContact O-CA 3.36Å; G113-I173 PolarHBondContact O-N 2.84Å
114	C	98.2	Very high	98.4	Very high	3 Å²	3	31.6 Å²	31.6	2%	0.02	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	153	169.4	-55.8	0	0	0	0	110.4	V110 P111 H112 C170 E171	V110-C114 VanDerWaalsContact CG2-O 3.24Å; V110-C114 WeakPolarHBondContact CG2-O 3.35Å; P111-C114 WeakPolarHBondContact O-CB 3.27Å; P111-C114 PolarHBondContact O-N 3.46Å; P111-C114 VanDerWaalsContact O-N 3.15Å; H112-C114 PolarHBondContact O-N 2.86Å; C114-C170 HydrophobicContact CB-CB 4.36Å; C114-E171 CarbonylContact C-O 3.49Å; C114-E171 WeakPolarHBondContact CA-O 3.46Å
115	Y	98.8	Very high	98.3	Very high	40 Å²	40	33.3 Å²	33.3	16%	0.157	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	161.4	156.7	79.6	-75.1	0	0	0	109.9	R117 V136 E171 I173	Y115-R117 HydrophobicContact CD2-CB 4.45Å; Y115-R117 HydrophobicContact CE2-CB 3.63Å; Y115-R117 HydrophobicContact CE2-CG 4.19Å; Y115-V136 HydrophobicContact CD2-CB 4.4Å; Y115-V136 HydrophobicContact CD2-CG1 3.83Å; Y115-V136 HydrophobicContact CE2-CB 4.49Å; Y115-V136 HydrophobicContact CE2-CG1 4.27Å; Y115-V136 HydrophobicContact CE2-CG2 4.21Å; Y115-E171 HydrophobicContact CD1-CB 3.9Å; Y115-E171 HydrophobicContact CE1-CB 3.35Å; Y115-E171 HydrophobicContact CE1-CG 4.28Å; Y115-E171 PolarHBondContact N-O 2.83Å; Y115-E171 PolarHBondContact O-N 2.93Å; Y115-E171 PolarHBondContact OH-OE2 2.97Å; Y115-I173 HydrophobicContact CD1-CD1 4.38Å; Y115-I173 HydrophobicContact CD1-CG2 3.53Å; Y115-I173 HydrophobicContact CE1-CG2 3.78Å
116	G	98.8	Very high	98.3	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	105.3	174.3	0	0	0	0	0	110.7	V137	G116-V137 PolarHBondContact N-O 3.15Å; G116-V137 VanDerWaalsContact O-CB 3.32Å; G116-V137 WeakPolarHBondContact O-CB 3.35Å; G116-V137 PolarHBondContact O-N 2.81Å
117	R	98.9	Very high	98.2	Very high	82 Å²	82	45.1 Å²	45.1	31%	0.309	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	118.4	171.2	-169.5	172.5	55.4	93.1	2.2	111.3	Y115 A119 G135 L168 V169 E171	Y115-R117 HydrophobicContact CD2-CB 4.45Å; Y115-R117 HydrophobicContact CE2-CB 3.63Å; Y115-R117 HydrophobicContact CE2-CG 4.19Å; R117-A119 PolarHBondContact O-N 2.88Å; R117-G135 CarbonylContact C-O 3.54Å; R117-G135 WeakPolarHBondContact CA-O 3.44Å; R117-L168 CarbonylContact O-C 3.6Å; R117-L168 WeakPolarHBondContact O-CA 3.4Å; R117-V169 PolarHBondContact N-O 3.19Å; R117-V169 PolarHBondContact O-N 2.86Å; R117-E171 HydrophobicContact CB-CG 4.19Å; R117-E171 IonicContact CZ-OE1 3.11Å; R117-E171 VanDerWaalsContact NE-CD 3.27Å; R117-E171 IonicContact NE-OE1 2.64Å; R117-E171 PolarHBondContact NE-OE1 3.11Å; R117-E171 IonicContact NE-OE2 3.66Å; R117-E171 IonicContact NH2-OE1 2.75Å; R117-E171 PolarHBondContact NH2-OE1 2.75Å
118	V	98.9	Very high	98.2	Very high	7 Å²	7	46.4 Å²	46.4	4%	0.042	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	114.5	166.1	-168.9	0	0	0	0	108.3	L86 V132 G135 V137 V147 A166 L168	L86-V118 HydrophobicContact CD1-CG1 4.08Å; L86-V118 HydrophobicContact CD1-CG2 4.37Å; V118-V132 HydrophobicContact CB-CG1 4.19Å; V118-V132 HydrophobicContact CG1-CG1 3.85Å; V118-V132 WeakPolarHBondContact O-CG1 3.43Å; V118-G135 PolarHBondContact N-O 3.24Å; V118-V137 HydrophobicContact CG2-CG2 3.86Å; V118-V147 HydrophobicContact CG1-CB 4.43Å; V118-V147 HydrophobicContact CG1-CG1 4.08Å; V118-V147 HydrophobicContact CG1-CG2 3.98Å; V118-A166 HydrophobicContact CG1-CB 3.6Å; V118-L168 HydrophobicContact CG2-CD1 4.16Å
119	A	98.8	Very high	98.2	Very high	4 Å²	4	52.3 Å²	52.3	3%	0.033	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	149.8	-173.3	0	0	0	0	0	111.7	R117 Q167 V169	R117-A119 PolarHBondContact O-N 2.88Å; A119-Q167 HydrophobicContact CB-CG 3.85Å; A119-Q167 PolarHBondContact N-O 2.87Å; A119-Q167 PolarHBondContact O-N 3.03Å; A119-V169 HydrophobicContact CB-CG2 4.36Å
120	P	98.8	Very high	98.2	Very high	47 Å²	47	51.8 Å²	51.8	31%	0.305	29%	0.285	S	S	.	.			trans	-66.5	151.4	176.6	28.2	-34.6	0	0	0	111.7	V132 Q167	P120-V132 HydrophobicContact CB-CB 4.4Å; P120-V132 HydrophobicContact CB-CG2 4.06Å; P120-Q167 PolarHBondContact O-NE2 2.99Å
121	R	98.6	Very high	98.2	Very high	52 Å²	52	54.5 Å²	54.5	20%	0.196	30%	0.299	C	S	.	.			trans	-91.5	126.4	169.8	-63.9	176.4	77.3	-122.5	-8.3	108.4	D85 G123 L124 A125 R164	D85-R121 IonicContact OD1-CZ 3.9Å; D85-R121 IonicContact OD1-NE 3.79Å; D85-R121 PolarHBondContact OD1-NE 3.28Å; D85-R121 IonicContact OD1-NH2 2.99Å; R121-G123 PolarHBondContact O-N 3.25Å; R121-G123 VanDerWaalsContact O-N 3.15Å; R121-L124 HydrophobicContact CB-CD1 4.34Å; R121-L124 HydrophobicContact CB-CG 4.25Å; R121-L124 PolarHBondContact O-N 2.86Å; R121-A125 PolarHBondContact O-N 3.36Å; R121-A125 VanDerWaalsContact O-N 3.11Å; R121-R164 WeakPolarHBondContact CD-O 3.46Å; R121-R164 PolarHBondContact NH1-O 2.8Å; R121-R164 VanDerWaalsContact NH2-CZ 3.35Å
122	S	97.8	Very high	98.3	Very high	102 Å²	102	54.8 Å²	54.8	71%	0.713	30%	0.301	S	S	*	.	H	α-helix	trans	-57	-35.3	-174.6	57.7	0	0	0	0	113.7	L124 A125 A126	S122-L124 VanDerWaalsContact C-N 3.35Å; S122-L124 PolarHBondContact O-N 2.86Å; S122-A125 PolarHBondContact O-N 3.37Å; S122-A126 VanDerWaalsContact O-CB 3.32Å; S122-A126 WeakPolarHBondContact O-CB 3.35Å; S122-A126 PolarHBondContact O-N 2.78Å
123	G	97.8	Very high	98.3	Very high	34 Å²	34	48.8 Å²	48.8	35%	0.351	28%	0.275	S	S	.	.	H	α-helix	trans	-63.6	-37.4	176.5	0	0	0	0	0	113.4	R121 K127	R121-G123 PolarHBondContact O-N 3.25Å; R121-G123 VanDerWaalsContact O-N 3.15Å; G123-K127 VanDerWaalsContact O-CB 3.26Å; G123-K127 WeakPolarHBondContact O-CB 3.21Å; G123-K127 VanDerWaalsContact O-CG 3.3Å; G123-K127 WeakPolarHBondContact O-CG 3.11Å; G123-K127 PolarHBondContact O-N 2.97Å
124	L	98	Very high	98.4	Very high	23 Å²	23	52.5 Å²	52.5	12%	0.12	31%	0.305	C	S	.	.	H	α-helix	trans	-74.4	-41.2	177.3	-60.1	-176.8	0	0	0	111	R121 S122 H128 F129 I130 F157 V165	R121-L124 HydrophobicContact CB-CD1 4.34Å; R121-L124 HydrophobicContact CB-CG 4.25Å; R121-L124 PolarHBondContact O-N 2.86Å; S122-L124 VanDerWaalsContact C-N 3.35Å; S122-L124 PolarHBondContact O-N 2.86Å; L124-H128 CarbonylContact O-C 3.47Å; L124-H128 WeakPolarHBondContact O-CA 3.34Å; L124-H128 WeakPolarHBondContact O-CB 3.37Å; L124-H128 PolarHBondContact O-N 2.97Å; L124-F129 PolarHBondContact O-N 2.76Å; L124-I130 HydrophobicContact CB-CB 4.11Å; L124-I130 PolarHBondContact O-N 2.87Å; L124-F157 HydrophobicContact CD1-CZ 4.42Å; L124-F157 HydrophobicContact CD2-CE2 4.32Å; L124-F157 HydrophobicContact CD2-CZ 3.95Å; L124-V165 WeakPolarHBondContact CD1-O 3.44Å
125	A	98.1	Very high	98.4	Very high	40 Å²	40	52.9 Å²	52.9	33%	0.331	31%	0.309	S	S	.	.	H	α-helix	trans	-60.7	-50.2	175.6	0	0	0	0	0	112.2	R121 S122 F129 I130	R121-A125 PolarHBondContact O-N 3.36Å; R121-A125 VanDerWaalsContact O-N 3.11Å; S122-A125 PolarHBondContact O-N 3.37Å; A125-F129 VanDerWaalsContact O-CA 3.26Å; A125-F129 WeakPolarHBondContact O-CA 3.32Å; A125-F129 PolarHBondContact O-N 2.72Å; A125-F129 VanDerWaalsContact O-N 3.15Å; A125-I130 WeakPolarHBondContact CA-O 3.43Å; A125-I130 WeakPolarHBondContact CB-O 3.32Å
126	A	98	Very high	98.4	Very high	89 Å²	89	55.2 Å²	55.2	74%	0.736	33%	0.327	S	S	*	.	H	α-helix	trans	-73.4	-33.8	-174.8	0	0	0	0	0	113.9	S122	S122-A126 VanDerWaalsContact O-CB 3.32Å; S122-A126 WeakPolarHBondContact O-CB 3.35Å; S122-A126 PolarHBondContact O-N 2.78Å
127	K	98	Very high	98.4	Very high	166 Å²	166	55.9 Å²	55.9	72%	0.722	33%	0.331	S	S	*	.	H	α-helix	trans	-97.5	-30.3	-173.1	-61	179.2	-179.2	-176.1	0	113.9	G123	G123-K127 VanDerWaalsContact O-CB 3.26Å; G123-K127 WeakPolarHBondContact O-CB 3.21Å; G123-K127 VanDerWaalsContact O-CG 3.3Å; G123-K127 WeakPolarHBondContact O-CG 3.11Å; G123-K127 PolarHBondContact O-N 2.97Å
128	H	98.1	Very high	98.4	Very high	91 Å²	91	56.1 Å²	56.1	42%	0.421	34%	0.338	S	S	.	.	H	α-helix	trans	-124.5	0.3	-171.8	-56.9	-67.8	0	0	0	112.8	L124 I130 F157	L124-H128 CarbonylContact O-C 3.47Å; L124-H128 WeakPolarHBondContact O-CA 3.34Å; L124-H128 WeakPolarHBondContact O-CB 3.37Å; L124-H128 PolarHBondContact O-N 2.97Å; H128-I130 VanDerWaalsContact C-N 3.26Å; H128-I130 HydrophobicContact CB-CG1 3.79Å; H128-I130 PolarHBondContact O-N 2.99Å; H128-F157 HydrophobicContact CB-CD2 3.86Å; H128-F157 HydrophobicContact CB-CE2 3.91Å; H128-F157 AromaticContact CD2-CE2 3.96Å; H128-F157 AromaticContact CG-CE2 3.82Å
129	F	98.4	Very high	98.4	Very high	130 Å²	130	57.8 Å²	57.8	57%	0.57	35%	0.346	S	S	*	.			trans	56.9	39	-178.6	-150.4	-1	0	0	0	113.3	L124 A125 F152	L124-F129 PolarHBondContact O-N 2.76Å; A125-F129 VanDerWaalsContact O-CA 3.26Å; A125-F129 WeakPolarHBondContact O-CA 3.32Å; A125-F129 PolarHBondContact O-N 2.72Å; A125-F129 VanDerWaalsContact O-N 3.15Å; F129-F152 HydrophobicContact CD1-CB 3.74Å; F129-F152 HydrophobicContact CD1-CD2 4.37Å; F129-F152 HydrophobicContact CD2-CB 3.92Å; F129-F152 VanDerWaalsContact CD2-O 3.31Å; F129-F152 WeakPolarHBondContact CD2-O 3.32Å; F129-F152 HydrophobicContact CE1-CB 3.86Å; F129-F152 HydrophobicContact CE1-CD2 4.33Å; F129-F152 HydrophobicContact CE2-CB 4.03Å; F129-F152 HydrophobicContact CG-CB 3.78Å; F129-F152 HydrophobicContact CZ-CB 4.01Å; F129-F152 PolarHBondContact O-N 2.84Å
130	I	98.8	Very high	98.3	Very high	4 Å²	4	63.8 Å²	63.8	2%	0.021	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	134.4	178.5	-56.8	-54.2	0	0	0	110.8	L124 A125 H128 L149 F150 N151 F157	L124-I130 HydrophobicContact CB-CB 4.11Å; L124-I130 PolarHBondContact O-N 2.87Å; A125-I130 WeakPolarHBondContact CA-O 3.43Å; A125-I130 WeakPolarHBondContact CB-O 3.32Å; H128-I130 VanDerWaalsContact C-N 3.26Å; H128-I130 HydrophobicContact CB-CG1 3.79Å; H128-I130 PolarHBondContact O-N 2.99Å; I130-L149 HydrophobicContact CG2-CB 4.44Å; I130-L149 HydrophobicContact CG2-CD1 4.48Å; I130-L149 HydrophobicContact CG2-CD2 3.97Å; I130-F150 WeakPolarHBondContact CA-O 3.16Å; I130-N151 HydrophobicContact CD1-CB 3.72Å; I130-F157 HydrophobicContact CD1-CB 3.72Å; I130-F157 HydrophobicContact CD1-CD1 3.76Å; I130-F157 HydrophobicContact CD1-CD2 4.08Å; I130-F157 HydrophobicContact CD1-CE1 4.39Å; I130-F157 HydrophobicContact CD1-CG 3.58Å; I130-F157 HydrophobicContact CG1-CB 4.5Å; I130-F157 HydrophobicContact CG1-CD1 3.89Å; I130-F157 HydrophobicContact CG1-CD2 3.94Å; I130-F157 HydrophobicContact CG1-CE1 4.02Å; I130-F157 HydrophobicContact CG1-CE2 4.09Å; I130-F157 HydrophobicContact CG1-CG 3.85Å; I130-F157 HydrophobicContact CG1-CZ 4.14Å
131	D	98.8	Very high	98.3	Very high	64 Å²	64	66 Å²	66	34%	0.342	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	167.9	173.8	-160	12.3	0	0	0	111.8	L149 F150 F152	D131-L149 WeakPolarHBondContact O-CA 3.45Å; D131-F150 HydrophobicContact CB-CB 4.49Å; D131-F150 PolarHBondContact N-O 3.48Å; D131-F150 PolarHBondContact O-N 2.9Å; D131-F152 HydrophobicContact CB-CD2 4.04Å; D131-F152 HydrophobicContact CB-CE2 3.55Å
132	V	98.8	Very high	98.3	Very high	20 Å²	20	69.3 Å²	69.3	12%	0.121	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	124.1	177.2	175.7	0	0	0	0	110.1	V118 P120 V147 V148 L149 A166	V118-V132 HydrophobicContact CB-CG1 4.19Å; V118-V132 HydrophobicContact CG1-CG1 3.85Å; V118-V132 WeakPolarHBondContact O-CG1 3.43Å; P120-V132 HydrophobicContact CB-CB 4.4Å; P120-V132 HydrophobicContact CB-CG2 4.06Å; V132-V147 HydrophobicContact CG2-CG1 4.37Å; V132-V148 CarbonylContact C-O 3.55Å; V132-V148 WeakPolarHBondContact CA-O 3.38Å; V132-L149 HydrophobicContact CG2-CD2 3.93Å; V132-A166 HydrophobicContact CG2-CB 4.08Å
133	G	98.3	Very high	98.4	Very high	9 Å²	9	65.7 Å²	65.7	9%	0.093	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	171.9	171.2	0	0	0	0	0	114.1	G135 V148	G133-G135 PolarHBondContact O-N 2.86Å; G133-V148 PolarHBondContact N-O 2.91Å
134	A	98.3	Very high	98.4	Very high	96 Å²	96	66.1 Å²	66.1	79%	0.793	37%	0.366	S	S	*	.			trans	52.8	-95.9	-179.3	0	0	0	0	0	111.8	V136 V148	A134-V136 VanDerWaalsContact C-N 3.29Å; A134-V136 PolarHBondContact O-N 3.35Å; A134-V148 HydrophobicContact CB-CG2 4.09Å
135	G	97.6	Very high	98.5	Very high	10 Å²	10	65.1 Å²	65.1	10%	0.103	36%	0.36	C	S	.	.			trans	75.8	5.5	165	0	0	0	0	0	116.2	R117 V118 G133	R117-G135 CarbonylContact C-O 3.54Å; R117-G135 WeakPolarHBondContact CA-O 3.44Å; V118-G135 PolarHBondContact N-O 3.24Å; G133-G135 PolarHBondContact O-N 2.86Å
136	V	98.8	Very high	98.5	Very high	90 Å²	90	64.5 Å²	64.5	55%	0.545	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	111.6	170.4	-178.5	0	0	0	0	108.5	Y115 A134	Y115-V136 HydrophobicContact CD2-CB 4.4Å; Y115-V136 HydrophobicContact CD2-CG1 3.83Å; Y115-V136 HydrophobicContact CE2-CB 4.49Å; Y115-V136 HydrophobicContact CE2-CG1 4.27Å; Y115-V136 HydrophobicContact CE2-CG2 4.21Å; A134-V136 VanDerWaalsContact C-N 3.29Å; A134-V136 PolarHBondContact O-N 3.35Å
137	V	98.8	Very high	98.5	Very high	14 Å²	14	60.3 Å²	60.3	9%	0.085	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	108.5	171.2	-173	0	0	0	0	108.4	I108 G116 V118 Y141 V145	I108-V137 HydrophobicContact CD1-CB 4.37Å; I108-V137 HydrophobicContact CD1-CG1 3.78Å; I108-V137 HydrophobicContact CG1-CG1 4.1Å; G116-V137 PolarHBondContact N-O 3.15Å; G116-V137 VanDerWaalsContact O-CB 3.32Å; G116-V137 WeakPolarHBondContact O-CB 3.35Å; G116-V137 PolarHBondContact O-N 2.81Å; V118-V137 HydrophobicContact CG2-CG2 3.86Å; V137-Y141 HydrophobicContact CG1-CD1 3.8Å; V137-Y141 HydrophobicContact CG1-CG 4.34Å; V137-V145 HydrophobicContact CG1-CG2 4.46Å; V137-V145 HydrophobicContact CG2-CG1 4.29Å
138	D	98.8	Very high	98.6	Very high	86 Å²	86	53.9 Å²	53.9	46%	0.46	30%	0.298	S	S	.	.			trans	-66.7	154.9	-175.2	-57.1	-57.3	0	0	0	112.9	D140 Y141	D138-D140 WeakPolarHBondContact CB-OD1 3.44Å; D138-D140 PolarHBondContact O-N 3.41Å; D138-Y141 WeakPolarHBondContact O-CB 3.18Å; D138-Y141 PolarHBondContact O-N 2.6Å; D138-Y141 VanDerWaalsContact O-N 3.14Å
139	E	98.5	Very high	98.6	Very high	43 Å²	43	49.5 Å²	49.5	20%	0.201	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-31.8	-178.1	-174.5	179.7	147.6	0	0	112.9	V110 H112 G113 R142 Y175	V110-E139 HydrophobicContact CG2-CB 4.02Å; V110-E139 HydrophobicContact CG2-CG 3.99Å; H112-E139 WeakPolarHBondContact CA-OE1 3.39Å; H112-E139 IonicContact CE1-OE1 2.78Å; H112-E139 IonicContact CG-OE1 3.41Å; H112-E139 IonicContact ND1-OE1 3.59Å; H112-E139 PolarHBondContact ND1-OE1 3.25Å; H112-E139 IonicContact ND1-OE2 3.91Å; H112-E139 PolarHBondContact ND1-OE2 3.23Å; G113-E139 PolarHBondContact N-OE2 2.78Å; E139-R142 PolarHBondContact O-NH1 2.97Å; E139-R142 PolarHBondContact O-NH2 3.02Å; E139-Y175 WeakPolarHBondContact CB-OH 3.24Å; E139-Y175 WeakPolarHBondContact OE2-CE2 3.19Å; E139-Y175 PolarHBondContact OE2-OH 2.81Å
140	D	98.3	Very high	98.6	Very high	130 Å²	130	46.4 Å²	46.4	70%	0.695	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-2.9	-179.2	65.4	-8.4	0	0	0	113.7	D138 R142	D138-D140 WeakPolarHBondContact CB-OD1 3.44Å; D138-D140 PolarHBondContact O-N 3.41Å; D140-R142 PolarHBondContact O-N 3.04Å
141	Y	98.8	Very high	98.6	Very high	92 Å²	92	46.3 Å²	46.3	36%	0.361	26%	0.264	S	S	.	.			trans	-70	128.3	178.1	-174.8	-105.9	0	0	0	111.9	I108 V137 D138 G143 N144	I108-Y141 VanDerWaalsContact O-O 3.13Å; V137-Y141 HydrophobicContact CG1-CD1 3.8Å; V137-Y141 HydrophobicContact CG1-CG 4.34Å; D138-Y141 WeakPolarHBondContact O-CB 3.18Å; D138-Y141 PolarHBondContact O-N 2.6Å; D138-Y141 VanDerWaalsContact O-N 3.14Å; Y141-G143 VanDerWaalsContact CE1-O 3.28Å; Y141-G143 WeakPolarHBondContact CE1-O 3.2Å; Y141-G143 WeakPolarHBondContact OH-CA 3.31Å; Y141-N144 PolarHBondContact OH-N 2.79Å; Y141-N144 PolarHBondContact OH-O 3.46Å
142	R	98.7	Very high	98.6	Very high	123 Å²	123	47.4 Å²	47.4	46%	0.464	27%	0.266	S	S	.	.			trans	-125.2	12	177.7	-62.3	-65.3	177	-85.3	-7.5	113.7	Q107 I108 E139 D140	Q107-R142 WeakPolarHBondContact CB-O 3.24Å; Q107-R142 PolarHBondContact OE1-O 3.4Å; I108-R142 PolarHBondContact O-NH1 3.15Å; E139-R142 PolarHBondContact O-NH1 2.97Å; E139-R142 PolarHBondContact O-NH2 3.02Å; D140-R142 PolarHBondContact O-N 3.04Å
143	G	98.7	Very high	98.6	Very high	26 Å²	26	47 Å²	47	27%	0.268	27%	0.265	S	S	.	.	S	Bend	trans	-82.2	-171.2	175.1	0	0	0	0	0	113.2	Q107 Y141 V145	Q107-G143 WeakPolarHBondContact CA-O 3.22Å; Q107-G143 VanDerWaalsContact CB-O 3.28Å; Q107-G143 WeakPolarHBondContact CB-O 3.46Å; Y141-G143 VanDerWaalsContact CE1-O 3.28Å; Y141-G143 WeakPolarHBondContact CE1-O 3.2Å; Y141-G143 WeakPolarHBondContact OH-CA 3.31Å; G143-V145 PolarHBondContact O-N 3.29Å
144	N	98.8	Very high	98.6	Very high	42 Å²	42	56.1 Å²	56.1	23%	0.225	30%	0.302	C	S	.	.			trans	-72.6	119.3	175.6	-170.1	-30.5	0	0	0	110.3	L67 D105 Y141 G146	L67-N144 HydrophobicContact CD1-CB 3.62Å; D105-N144 PolarHBondContact N-OD1 3.11Å; D105-N144 PolarHBondContact OD1-ND2 2.9Å; Y141-N144 PolarHBondContact OH-N 2.79Å; Y141-N144 PolarHBondContact OH-O 3.46Å; N144-G146 PolarHBondContact O-N 2.83Å; N144-G146 VanDerWaalsContact O-N 3.07Å
145	V	98.9	Very high	98.6	Very high	2 Å²	2	59.1 Å²	59.1	1%	0.012	30%	0.3	C	S	.	.			trans	-65.2	110.7	176.5	178	0	0	0	0	109.2	L86 T104 I106 I108 V137 G143	L86-V145 HydrophobicContact CD1-CG1 4.31Å; T104-V145 WeakPolarHBondContact CB-O 3.25Å; T104-V145 VanDerWaalsContact CG2-O 3.31Å; T104-V145 WeakPolarHBondContact CG2-O 3.26Å; T104-V145 PolarHBondContact N-O 2.84Å; T104-V145 PolarHBondContact OG1-O 2.98Å; I106-V145 HydrophobicContact CG1-CB 4.38Å; I106-V145 PolarHBondContact O-N 3.43Å; I108-V145 HydrophobicContact CB-CG2 4.47Å; I108-V145 HydrophobicContact CD1-CG2 4.11Å; I108-V145 HydrophobicContact CG1-CG2 3.85Å; I108-V145 HydrophobicContact CG2-CG2 4.03Å; V137-V145 HydrophobicContact CG1-CG2 4.46Å; V137-V145 HydrophobicContact CG2-CG1 4.29Å; G143-V145 PolarHBondContact O-N 3.29Å
146	G	98.6	Very high	98.7	Very high	28 Å²	28	62.3 Å²	62.3	29%	0.289	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	142.2	174.5	0	0	0	0	0	111.9	N144	N144-G146 PolarHBondContact O-N 2.83Å; N144-G146 VanDerWaalsContact O-N 3.07Å
147	V	98.9	Very high	98.6	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	112.8	172.7	179.3	0	0	0	0	108.3	L86 I101 V102 T104 V118 V132 L149 V165 A166	L86-V147 HydrophobicContact CB-CG2 4.48Å; L86-V147 HydrophobicContact CD1-CG2 3.99Å; I101-V147 CarbonylContact C-O 3.56Å; I101-V147 WeakPolarHBondContact CA-O 3.48Å; V102-V147 HydrophobicContact CB-CB 4.29Å; V102-V147 PolarHBondContact N-O 2.98Å; V102-V147 PolarHBondContact O-N 3.15Å; T104-V147 HydrophobicContact CG2-CG2 3.91Å; V118-V147 HydrophobicContact CG1-CB 4.43Å; V118-V147 HydrophobicContact CG1-CG1 4.08Å; V118-V147 HydrophobicContact CG1-CG2 3.98Å; V132-V147 HydrophobicContact CG2-CG1 4.37Å; V147-L149 HydrophobicContact CG1-CD2 3.56Å; V147-L149 HydrophobicContact CG1-CG 3.95Å; V147-L149 PolarHBondContact O-N 3.19Å; V147-V165 HydrophobicContact CB-CG2 4.39Å; V147-V165 HydrophobicContact CG1-CG2 4.3Å; V147-V165 HydrophobicContact CG2-CG2 4.22Å; V147-A166 HydrophobicContact CB-CB 4.5Å; V147-A166 HydrophobicContact CG1-CB 3.56Å; V147-A166 HydrophobicContact CG2-CB 4.09Å
148	V	98.9	Very high	98.6	Very high	31 Å²	31	62.3 Å²	62.3	19%	0.188	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	100.6	175.3	-173.1	0	0	0	0	108.3	A100 I101 V132 G133 A134 F150	A100-V148 WeakPolarHBondContact O-CA 3.15Å; I101-V148 HydrophobicContact CG1-CG2 4.35Å; V132-V148 CarbonylContact C-O 3.55Å; V132-V148 WeakPolarHBondContact CA-O 3.38Å; G133-V148 PolarHBondContact N-O 2.91Å; A134-V148 HydrophobicContact CB-CG2 4.09Å; V148-F150 HydrophobicContact CG1-CZ 4.34Å
149	L	98.9	Very high	98.7	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	135	175.4	-65.1	-175.3	0	0	0	110.5	I94 K99 A100 V102 I130 D131 V132 V147 F157 V159 V165	I94-L149 HydrophobicContact CD1-CB 3.72Å; I94-L149 HydrophobicContact CD1-CD1 3.85Å; I94-L149 HydrophobicContact CD1-CG 4.42Å; K99-L149 WeakPolarHBondContact CA-O 3.47Å; K99-L149 WeakPolarHBondContact CB-O 3.37Å; A100-L149 PolarHBondContact N-O 3.3Å; A100-L149 PolarHBondContact O-N 2.78Å; V102-L149 HydrophobicContact CG2-CD1 3.75Å; V102-L149 HydrophobicContact CG2-CG 4.12Å; I130-L149 HydrophobicContact CG2-CB 4.44Å; I130-L149 HydrophobicContact CG2-CD1 4.48Å; I130-L149 HydrophobicContact CG2-CD2 3.97Å; D131-L149 WeakPolarHBondContact O-CA 3.45Å; V132-L149 HydrophobicContact CG2-CD2 3.93Å; V147-L149 HydrophobicContact CG1-CD2 3.56Å; V147-L149 HydrophobicContact CG1-CG 3.95Å; V147-L149 PolarHBondContact O-N 3.19Å; L149-F157 HydrophobicContact CD1-CE1 4.37Å; L149-V159 HydrophobicContact CD1-CG2 4.05Å; L149-V165 HydrophobicContact CD1-CB 4.13Å; L149-V165 HydrophobicContact CD1-CG1 4.31Å
150	F	98.9	Very high	98.7	Very high	65 Å²	65	60.4 Å²	60.4	29%	0.285	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	131.4	165.6	-66.4	-63.3	0	0	0	109.5	K99 I130 D131 V148 F152	K99-F150 HydrophobicContact CB-CD1 3.62Å; K99-F150 HydrophobicContact CB-CE1 3.83Å; K99-F150 HydrophobicContact CD-CD1 4.44Å; K99-F150 HydrophobicContact CD-CE1 3.8Å; K99-F150 HydrophobicContact CG-CE1 4.44Å; I130-F150 WeakPolarHBondContact CA-O 3.16Å; D131-F150 HydrophobicContact CB-CB 4.49Å; D131-F150 PolarHBondContact N-O 3.48Å; D131-F150 PolarHBondContact O-N 2.9Å; V148-F150 HydrophobicContact CG1-CZ 4.34Å; F150-F152 HydrophobicContact CB-CD2 4.49Å; F150-F152 HydrophobicContact CB-CE1 4.08Å; F150-F152 HydrophobicContact CB-CE2 3.96Å; F150-F152 HydrophobicContact CB-CZ 3.72Å; F150-F152 HydrophobicContact CD2-CZ 4.29Å; F150-F152 HydrophobicContact CG-CZ 4.08Å
151	N	98.8	Very high	98.7	Very high	2 Å²	2	59.2 Å²	59.2	1%	0.011	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	101.4	170	-179	7.8	0	0	0	109.6	I94 G95 L97 D98 I130 G153 E155 F157	I94-N151 HydrophobicContact CB-CB 4.34Å; I94-N151 HydrophobicContact CG2-CB 3.71Å; I94-N151 PolarHBondContact O-ND2 3.34Å; G95-N151 WeakPolarHBondContact O-CB 3.21Å; G95-N151 PolarHBondContact O-ND2 2.76Å; G95-N151 VanDerWaalsContact O-ND2 3.12Å; L97-N151 WeakPolarHBondContact CA-O 3.41Å; L97-N151 PolarHBondContact N-O 2.8Å; D98-N151 PolarHBondContact O-N 3.02Å; I130-N151 HydrophobicContact CD1-CB 3.72Å; N151-G153 VanDerWaalsContact C-N 3.28Å; N151-G153 WeakPolarHBondContact OD1-CA 3.38Å; N151-G153 PolarHBondContact OD1-N 3.12Å; N151-E155 PolarHBondContact ND2-O 3.12Å; N151-F157 PolarHBondContact ND2-N 2.76Å
152	F	98.8	Very high	98.7	Very high	87 Å²	87	56.4 Å²	56.4	38%	0.382	29%	0.285	S	S	.	.			trans	-86.8	-2.1	173.7	-59.7	-55	0	0	0	112.8	F129 D131 F150	F129-F152 HydrophobicContact CD1-CB 3.74Å; F129-F152 HydrophobicContact CD1-CD2 4.37Å; F129-F152 HydrophobicContact CD2-CB 3.92Å; F129-F152 VanDerWaalsContact CD2-O 3.31Å; F129-F152 WeakPolarHBondContact CD2-O 3.32Å; F129-F152 HydrophobicContact CE1-CB 3.86Å; F129-F152 HydrophobicContact CE1-CD2 4.33Å; F129-F152 HydrophobicContact CE2-CB 4.03Å; F129-F152 HydrophobicContact CG-CB 3.78Å; F129-F152 HydrophobicContact CZ-CB 4.01Å; F129-F152 PolarHBondContact O-N 2.84Å; D131-F152 HydrophobicContact CB-CD2 4.04Å; D131-F152 HydrophobicContact CB-CE2 3.55Å; F150-F152 HydrophobicContact CB-CD2 4.49Å; F150-F152 HydrophobicContact CB-CE1 4.08Å; F150-F152 HydrophobicContact CB-CE2 3.96Å; F150-F152 HydrophobicContact CB-CZ 3.72Å; F150-F152 HydrophobicContact CD2-CZ 4.29Å; F150-F152 HydrophobicContact CG-CZ 4.08Å
153	G	98.1	Very high	98.7	Very high	11 Å²	11	53.8 Å²	53.8	11%	0.113	28%	0.28	C	S	.	.	S	Bend	trans	-70.7	173.1	177.5	0	0	0	0	0	113.2	P96 N151	P96-G153 WeakPolarHBondContact CA-O 3.5Å; P96-G153 WeakPolarHBondContact CB-O 3.28Å; N151-G153 VanDerWaalsContact C-N 3.28Å; N151-G153 WeakPolarHBondContact OD1-CA 3.38Å; N151-G153 PolarHBondContact OD1-N 3.12Å
154	K	98.1	Very high	98.7	Very high	200 Å²	200	57.6 Å²	57.6	87%	0.87	29%	0.286	S	S	*	.	S	Bend	trans	-96	-7	177.5	-62.9	-177.8	-179.1	179.1	0	113.2	P96	P96-K154 VanDerWaalsContact CG-O 3.25Å; P96-K154 WeakPolarHBondContact CG-O 3.33Å
155	E	98.3	Very high	98.7	Very high	160 Å²	160	55.7 Å²	55.7	75%	0.748	28%	0.276	S	S	*	.	S	Bend	trans	-115.1	151.7	-177.7	-63.6	179.6	-174.3	0	0	109.6	N151 F157	N151-E155 PolarHBondContact ND2-O 3.12Å; E155-F157 PolarHBondContact O-N 3.09Å
156	T	98.7	Very high	98.7	Very high	77 Å²	77	55.6 Å²	55.6	47%	0.472	28%	0.276	S	S	.	.			trans	-62.9	129.6	171.5	-60.9	0	0	0	0	109.6	I94	I94-T156 CarbonylContact O-C 3.6Å; I94-T156 WeakPolarHBondContact O-CA 3.46Å
157	F	98.8	Very high	98.7	Very high	25 Å²	25	56.5 Å²	56.5	11%	0.11	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	115.5	173.8	-176.7	-110.3	0	0	0	110	I94 L124 H128 I130 L149 N151 E155 V159	I94-F157 HydrophobicContact CD1-CD1 4.38Å; I94-F157 PolarHBondContact N-O 3.43Å; I94-F157 PolarHBondContact O-N 3.14Å; L124-F157 HydrophobicContact CD1-CZ 4.42Å; L124-F157 HydrophobicContact CD2-CE2 4.32Å; L124-F157 HydrophobicContact CD2-CZ 3.95Å; H128-F157 HydrophobicContact CB-CD2 3.86Å; H128-F157 HydrophobicContact CB-CE2 3.91Å; H128-F157 AromaticContact CD2-CE2 3.96Å; H128-F157 AromaticContact CG-CE2 3.82Å; I130-F157 HydrophobicContact CD1-CB 3.72Å; I130-F157 HydrophobicContact CD1-CD1 3.76Å; I130-F157 HydrophobicContact CD1-CD2 4.08Å; I130-F157 HydrophobicContact CD1-CE1 4.39Å; I130-F157 HydrophobicContact CD1-CG 3.58Å; I130-F157 HydrophobicContact CG1-CB 4.5Å; I130-F157 HydrophobicContact CG1-CD1 3.89Å; I130-F157 HydrophobicContact CG1-CD2 3.94Å; I130-F157 HydrophobicContact CG1-CE1 4.02Å; I130-F157 HydrophobicContact CG1-CE2 4.09Å; I130-F157 HydrophobicContact CG1-CG 3.85Å; I130-F157 HydrophobicContact CG1-CZ 4.14Å; L149-F157 HydrophobicContact CD1-CE1 4.37Å; N151-F157 PolarHBondContact ND2-N 2.76Å; E155-F157 PolarHBondContact O-N 3.09Å; F157-V159 HydrophobicContact CD1-CG2 3.78Å; F157-V159 HydrophobicContact CE1-CG2 3.49Å; F157-V159 VanDerWaalsContact CE1-CG2 3.49Å; F157-V159 HydrophobicContact CZ-CG2 4.49Å
158	E	98.8	Very high	98.7	Very high	78 Å²	78	56.6 Å²	56.6	36%	0.364	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	121.3	177.6	-69.2	-67.6	138.4	0	0	109.9	S93 K160	S93-E158 VanDerWaalsContact CB-OE1 3.23Å; S93-E158 WeakPolarHBondContact CB-OE1 3.26Å; S93-E158 VanDerWaalsContact OG-CD 3.24Å; S93-E158 PolarHBondContact OG-OE1 3.09Å; S93-E158 PolarHBondContact OG-OE2 2.85Å; E158-K160 IonicContact OE2-NZ 3.82Å; E158-K160 PolarHBondContact OE2-NZ 2.63Å
159	V	98.8	Very high	98.7	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	124.9	169.1	176.8	0	0	0	0	107.4	S88 D91 Y92 I94 V102 L149 F157 D163 V165	S88-V159 VanDerWaalsContact CB-CG1 3.46Å; D91-V159 CarbonylContact C-O 3.55Å; D91-V159 VanDerWaalsContact CA-O 3.26Å; D91-V159 WeakPolarHBondContact CA-O 3.27Å; Y92-V159 HydrophobicContact CD2-CB 4.43Å; Y92-V159 HydrophobicContact CD2-CG1 4.27Å; Y92-V159 PolarHBondContact N-O 2.87Å; Y92-V159 PolarHBondContact O-N 3.39Å; I94-V159 HydrophobicContact CD1-CG2 4.34Å; V102-V159 HydrophobicContact CG1-CG1 4.39Å; L149-V159 HydrophobicContact CD1-CG2 4.05Å; F157-V159 HydrophobicContact CD1-CG2 3.78Å; F157-V159 HydrophobicContact CE1-CG2 3.49Å; F157-V159 VanDerWaalsContact CE1-CG2 3.49Å; F157-V159 HydrophobicContact CZ-CG2 4.49Å; V159-D163 HydrophobicContact CG1-CB 4.45Å; V159-V165 HydrophobicContact CG1-CG1 3.57Å; V159-V165 HydrophobicContact CG2-CG1 4.18Å
160	K	98.8	Very high	98.7	Very high	90 Å²	90	57.9 Å²	57.9	39%	0.391	28%	0.282	S	S	.	.	P	Polyproline II helix	trans	-101.4	153	170.9	-56.7	-51.5	-177.9	-163.5	0	110.7	D91 E158 G162 D163	D91-K160 WeakPolarHBondContact OD1-CA 3.21Å; E158-K160 IonicContact OE2-NZ 3.82Å; E158-K160 PolarHBondContact OE2-NZ 2.63Å; K160-G162 PolarHBondContact O-N 2.88Å; K160-D163 PolarHBondContact N-OD2 2.91Å; K160-D163 VanDerWaalsContact O-CB 3.26Å; K160-D163 WeakPolarHBondContact O-CB 3.3Å; K160-D163 PolarHBondContact O-N 2.75Å
161	K	98.8	Very high	98.7	Very high	105 Å²	105	57.6 Å²	57.6	46%	0.457	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.4	129.9	170	173.4	177.9	172.5	-178.7	0	109.8	H70 A89 Y90 D91	H70-K161 HydrophobicContact CB-CD 4.48Å; H70-K161 PolarHBondContact ND1-NZ 3.18Å; A89-K161 WeakPolarHBondContact O-CD 3.46Å; A89-K161 WeakPolarHBondContact O-CG 3.47Å; Y90-K161 PolarHBondContact O-N 2.64Å; D91-K161 PolarHBondContact OD1-N 2.96Å
162	G	98.7	Very high	98.6	Very high	32 Å²	32	64.3 Å²	64.3	33%	0.33	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.4	-3	-177.1	0	0	0	0	0	114.7	Y87 S88 K160	Y87-G162 VanDerWaalsContact CD1-O 3.28Å; Y87-G162 WeakPolarHBondContact CD1-O 3.26Å; S88-G162 PolarHBondContact O-N 3.12Å; K160-G162 PolarHBondContact O-N 2.88Å
163	D	98.8	Very high	98.6	Very high	69 Å²	69	63.6 Å²	63.6	37%	0.369	31%	0.31	S	S	.	.			trans	-70.8	140.2	171.8	-75.3	-22.2	0	0	0	111.3	Y87 S88 V159 K160 V165	Y87-D163 CarbonylContact C-O 3.53Å; Y87-D163 VanDerWaalsContact CA-O 3.27Å; Y87-D163 WeakPolarHBondContact CA-O 3.36Å; S88-D163 PolarHBondContact N-O 3.06Å; V159-D163 HydrophobicContact CG1-CB 4.45Å; K160-D163 PolarHBondContact N-OD2 2.91Å; K160-D163 VanDerWaalsContact O-CB 3.26Å; K160-D163 WeakPolarHBondContact O-CB 3.3Å; K160-D163 PolarHBondContact O-N 2.75Å; D163-V165 HydrophobicContact CB-CG1 4.34Å; D163-V165 PolarHBondContact O-N 2.83Å
164	R	98.8	Very high	98.6	Very high	105 Å²	105	67.7 Å²	67.7	40%	0.396	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	105.3	173	-66.6	178.8	-70.6	165.7	-4.9	109.4	D85 L86 Y87 R121	D85-R164 HydrophobicContact CB-CB 4.35Å; D85-R164 HydrophobicContact CB-CG 4.01Å; D85-R164 WeakPolarHBondContact OD2-CD 3.47Å; D85-R164 IonicContact OD2-CZ 2.86Å; D85-R164 IonicContact OD2-NE 2.78Å; D85-R164 IonicContact OD2-NH1 3.86Å; D85-R164 PolarHBondContact OD2-NH1 2.94Å; L86-R164 CarbonylContact O-C 3.39Å; L86-R164 WeakPolarHBondContact O-CA 3.11Å; Y87-R164 HydrophobicContact CD1-CG 3.72Å; Y87-R164 HydrophobicContact CE1-CG 3.31Å; Y87-R164 HydrophobicContact CE2-CG 4.26Å; Y87-R164 HydrophobicContact CG-CG 4.36Å; R121-R164 WeakPolarHBondContact CD-O 3.46Å; R121-R164 PolarHBondContact NH1-O 2.8Å; R121-R164 VanDerWaalsContact NH2-CZ 3.35Å
165	V	98.8	Very high	98.5	Very high	3 Å²	3	64.2 Å²	64.2	2%	0.018	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	-27.4	-169.7	-68.8	0	0	0	0	114	L86 V102 L124 V147 L149 V159 D163	L86-V165 PolarHBondContact O-N 2.8Å; V102-V165 HydrophobicContact CG1-CG1 4.47Å; V102-V165 HydrophobicContact CG1-CG2 4.05Å; L124-V165 WeakPolarHBondContact CD1-O 3.44Å; V147-V165 HydrophobicContact CB-CG2 4.39Å; V147-V165 HydrophobicContact CG1-CG2 4.3Å; V147-V165 HydrophobicContact CG2-CG2 4.22Å; L149-V165 HydrophobicContact CD1-CB 4.13Å; L149-V165 HydrophobicContact CD1-CG1 4.31Å; V159-V165 HydrophobicContact CG1-CG1 3.57Å; V159-V165 HydrophobicContact CG2-CG1 4.18Å; D163-V165 HydrophobicContact CB-CG1 4.34Å; D163-V165 PolarHBondContact O-N 2.83Å
166	A	98.9	Very high	98.5	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	-176.1	178.4	0	0	0	0	0	110.1	L86 V118 V132 V147	L86-A166 PolarHBondContact N-O 3.25Å; V118-A166 HydrophobicContact CG1-CB 3.6Å; V132-A166 HydrophobicContact CG2-CB 4.08Å; V147-A166 HydrophobicContact CB-CB 4.5Å; V147-A166 HydrophobicContact CG1-CB 3.56Å; V147-A166 HydrophobicContact CG2-CB 4.09Å
167	Q	98.9	Very high	98.4	Very high	47 Å²	47	64.7 Å²	64.7	22%	0.22	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	142	170.4	65.7	-168.5	-61	0	0	110.7	Y84 A119 P120	Y84-Q167 CarbonylContact O-C 3.58Å; Y84-Q167 WeakPolarHBondContact O-CA 3.14Å; A119-Q167 HydrophobicContact CB-CG 3.85Å; A119-Q167 PolarHBondContact N-O 2.87Å; A119-Q167 PolarHBondContact O-N 3.03Å; P120-Q167 PolarHBondContact O-NE2 2.99Å
168	L	98.9	Very high	98.4	Very high	1 Å²	1	71.5 Å²	71.5	1%	0.005	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	118.6	176.3	-171.8	75.6	0	0	0	110	L62 G83 Y84 L86 I108 R117 V118	L62-L168 HydrophobicContact CD1-CD2 4.34Å; L62-L168 HydrophobicContact CD2-CD2 3.92Å; G83-L168 CarbonylContact C-O 3.56Å; G83-L168 WeakPolarHBondContact CA-O 3.41Å; Y84-L168 PolarHBondContact N-O 2.88Å; Y84-L168 PolarHBondContact O-N 2.65Å; L86-L168 HydrophobicContact CD1-CB 4.1Å; L86-L168 HydrophobicContact CD2-CB 4.07Å; L86-L168 HydrophobicContact CG-CB 4.07Å; I108-L168 HydrophobicContact CD1-CD1 4.24Å; I108-L168 HydrophobicContact CD1-CD2 3.65Å; R117-L168 CarbonylContact O-C 3.6Å; R117-L168 WeakPolarHBondContact O-CA 3.4Å; V118-L168 HydrophobicContact CG2-CD1 4.16Å
169	V	98.8	Very high	98.3	Very high	17 Å²	17	73.3 Å²	73.3	10%	0.103	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	127.6	174	-175.6	0	0	0	0	108.4	R117 A119 E171	R117-V169 PolarHBondContact N-O 3.19Å; R117-V169 PolarHBondContact O-N 2.86Å; A119-V169 HydrophobicContact CB-CG2 4.36Å; V169-E171 HydrophobicContact CB-CG 4.27Å; V169-E171 HydrophobicContact CG1-CG 3.74Å; V169-E171 PolarHBondContact O-N 3.39Å
170	C	98.5	Very high	98.3	Very high	42 Å²	42	82.4 Å²	82.4	28%	0.284	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	101.4	170	-64.7	0	0	0	0	108.3	C114	C114-C170 HydrophobicContact CB-CB 4.36Å
171	E	98.4	Very high	98.2	Very high	59 Å²	59	84.4 Å²	84.4	28%	0.276	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	125.8	-178.3	-69.9	-157.8	171.7	0	0	110.8	C114 Y115 R117 V169	C114-E171 CarbonylContact C-O 3.49Å; C114-E171 WeakPolarHBondContact CA-O 3.46Å; Y115-E171 HydrophobicContact CD1-CB 3.9Å; Y115-E171 HydrophobicContact CE1-CB 3.35Å; Y115-E171 HydrophobicContact CE1-CG 4.28Å; Y115-E171 PolarHBondContact N-O 2.83Å; Y115-E171 PolarHBondContact O-N 2.93Å; Y115-E171 PolarHBondContact OH-OE2 2.97Å; R117-E171 HydrophobicContact CB-CG 4.19Å; R117-E171 IonicContact CZ-OE1 3.11Å; R117-E171 VanDerWaalsContact NE-CD 3.27Å; R117-E171 IonicContact NE-OE1 2.64Å; R117-E171 PolarHBondContact NE-OE1 3.11Å; R117-E171 IonicContact NE-OE2 3.66Å; R117-E171 IonicContact NH2-OE1 2.75Å; R117-E171 PolarHBondContact NH2-OE1 2.75Å; V169-E171 HydrophobicContact CB-CG 4.27Å; V169-E171 HydrophobicContact CG1-CG 3.74Å; V169-E171 PolarHBondContact O-N 3.39Å
172	K	97.9	Very high	98.2	Very high	143 Å²	143	88.8 Å²	88.8	62%	0.622	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.3	135.2	178.6	-69.6	-174	172	-166.8	0	110.6	Y60 G113	Y60-K172 PolarHBondContact OH-NZ 2.8Å; G113-K172 WeakPolarHBondContact O-CA 3.36Å
173	I	98.1	Very high	98.1	Very high	71 Å²	71	93 Å²	93	36%	0.364	48%	0.476	S	S	.	.			trans	-135.9	166.1	177.9	56.8	169	0	0	0	110.3	G113 Y115 Y175	G113-I173 PolarHBondContact O-N 2.84Å; Y115-I173 HydrophobicContact CD1-CD1 4.38Å; Y115-I173 HydrophobicContact CD1-CG2 3.53Å; Y115-I173 HydrophobicContact CE1-CG2 3.78Å; I173-Y175 HydrophobicContact CD1-CD1 4.42Å; I173-Y175 HydrophobicContact CD1-CE1 3.73Å; I173-Y175 HydrophobicContact CD1-CE2 4.43Å
174	C	97.6	Very high	98	Very high	97 Å²	97	96.8 Å²	96.8	66%	0.655	50%	0.495	S	S	*	.			trans	-106	154.8	161.4	54.8	0	0	0	0	109.3	P176	C174-P176 WeakPolarHBondContact O-CD 3.37Å
175	Y	97.1	Very high	97.9	Very high	127 Å²	127	98.1 Å²	98.1	50%	0.498	51%	0.51	S	S	.	.			trans	-107.3	78.8	170.2	-63.7	-75	0	0	0	108.6	E139 I173	E139-Y175 WeakPolarHBondContact CB-OH 3.24Å; E139-Y175 WeakPolarHBondContact OE2-CE2 3.19Å; E139-Y175 PolarHBondContact OE2-OH 2.81Å; I173-Y175 HydrophobicContact CD1-CD1 4.42Å; I173-Y175 HydrophobicContact CD1-CE1 3.73Å; I173-Y175 HydrophobicContact CD1-CE2 4.43Å
176	P	97.5	Very high	97.8	Very high	90 Å²	90	107.3 Å²	107.3	58%	0.584	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-77.5	145.7	-178.5	32.8	-35.2	0	0	0	111.4	C174	C174-P176 WeakPolarHBondContact O-CD 3.37Å
177	D	97.8	Very high	97.8	Very high	157 Å²	157	111.3 Å²	111.3	84%	0.84	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-73.4	145.9	162.2	-66.5	-42.9	0	0	0	109.8
178	L	97.6	Very high	97.6	Very high	169 Å²	169	116.9 Å²	116.9	89%	0.885	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-89.2	130.8	177.5	-61.2	179.7	0	0	0	110.5
179	V	97.8	Very high	97.4	Very high	115 Å²	115	125.3 Å²	125.3	70%	0.697	65%	0.646	S	S	*	*			trans	-123.5	123.8	172.7	-177	0	0	0	0	108
180	E	98	Very high	97.2	Very high	192 Å²	192	126.9 Å²	126.9	90%	0.897	67%	0.666	S	S	*	*			trans	-86.2	132.8	176.5	-174.2	174.8	-175.2	0	0	109.8
181	E	97.8	Very high	97	Very high	131 Å²	131	130.3 Å²	130.3	61%	0.612	70%	0.697	S	S	*	*			trans	-126.6	150.5	-177.7	-67.1	-69.6	173.3	0	0	110
182	E	97.6	Very high	96.6	Very high	197 Å²	197	128.8 Å²	128.8	92%	0.921	70%	0.697	S	S	*	*	S	Bend	trans	-65.4	-39.3	177.3	-66.9	-174.2	173	0	0	112
183	T	96.9	Very high	96.3	Very high	121 Å²	121	123.2 Å²	123.2	74%	0.742	68%	0.68	S	S	*	*			trans	-151.9	154	177.2	58.5	0	0	0	0	111.1
184	L	97.4	Very high	95.9	Very high	148 Å²	148	130.6 Å²	130.6	78%	0.775	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-97.1	165.7	173.6	-60.4	177.5	0	0	0	111.9
185	D	96.6	Very high	95.3	Very high	133 Å²	133	128.7 Å²	128.7	71%	0.711	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-68.5	154	173.8	63.1	-49.2	0	0	0	112.8
186	E	97.1	Very high	94.7	Very high	196 Å²	196	125.9 Å²	125.9	92%	0.916	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-79.1	139.1	176.8	-66.8	-173.3	175.9	0	0	111.3
187	T	97.1	Very high	94.1	Very high	85 Å²	85	127.8 Å²	127.8	52%	0.521	72%	0.716	S	S	.	*			trans	-123.4	159.5	173.3	70.8	0	0	0	0	110.8	R189 G190	T187-R189 PolarHBondContact O-N 3.3Å; T187-R189 VanDerWaalsContact O-N 3.12Å; T187-G190 PolarHBondContact O-N 3.11Å; T187-G190 PolarHBondContact OG1-N 3.41Å
188	V	94.8	Very high	93.4	Very high	164 Å²	164	122.9 Å²	122.9	99%	0.994	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.7	-32.2	175.2	178.2	0	0	0	0	112.2
189	R	94.3	Very high	92.3	Very high	177 Å²	177	126.5 Å²	126.5	67%	0.668	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	-33.5	178	-175.1	171	-178.7	165.3	2.2	112.7	T187 A191 G192	T187-R189 PolarHBondContact O-N 3.3Å; T187-R189 VanDerWaalsContact O-N 3.12Å; R189-A191 PolarHBondContact O-N 3.27Å; R189-G192 PolarHBondContact NE-O 3.29Å; R189-G192 PolarHBondContact NH2-O 3.03Å; R189-G192 PolarHBondContact O-N 3.45Å
190	G	94.6	Very high	91	Very high	51 Å²	51	131.8 Å²	131.8	53%	0.526	73%	0.729	S	S	.	*	T	Hydrogen-bonded Turn	trans	49.4	-133.4	-177.3	0	0	0	0	0	112.7	T187 G192	T187-G190 PolarHBondContact O-N 3.11Å; T187-G190 PolarHBondContact OG1-N 3.41Å; G190-G192 PolarHBondContact O-N 2.87Å
191	A	94.4	Very high	90.7	Very high	114 Å²	114	128.8 Å²	128.8	94%	0.942	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	9.6	178.1	0	0	0	0	0	114.9	R189 G193	R189-A191 PolarHBondContact O-N 3.27Å; A191-G193 PolarHBondContact O-N 3.44Å
192	G	90.5	Very high	90.3	Very high	26 Å²	26	128.7 Å²	128.7	27%	0.268	73%	0.726	S	S	.	*			trans	-72.3	118.3	-177.6	0	0	0	0	0	114.2	R189 G190 S196	R189-G192 PolarHBondContact NE-O 3.29Å; R189-G192 PolarHBondContact NH2-O 3.03Å; R189-G192 PolarHBondContact O-N 3.45Å; G190-G192 PolarHBondContact O-N 2.87Å; G192-S196 VanDerWaalsContact C-OG 3.28Å
193	G	92.3	Very high	89.9	Confident	26 Å²	26	124.9 Å²	124.9	27%	0.268	72%	0.716	S	S	.	*			trans	-148.7	-175.6	175.9	0	0	0	0	0	113.2	A191 G195 S196	A191-G193 PolarHBondContact O-N 3.44Å; G193-G195 PolarHBondContact O-N 3.01Å; G193-S196 PolarHBondContact N-OG 3.22Å; G193-S196 WeakPolarHBondContact O-CB 3.34Å; G193-S196 PolarHBondContact O-N 3.12Å; G193-S196 VanDerWaalsContact O-N 3.11Å
194	F	89.3	Confident	89.5	Confident	227 Å²	227	125.1 Å²	125.1	100%	0.996	71%	0.714	S	S	*	*	S	Bend	trans	54.4	42.9	171.8	-53.4	-82.4	0	0	0	115.6
195	G	85.2	Confident	89	Confident	57 Å²	57	123.7 Å²	123.7	59%	0.588	71%	0.71	S	S	*	*	S	Bend	trans	87.3	20.6	-177.5	0	0	0	0	0	114.2	G193 T197 G198	G193-G195 PolarHBondContact O-N 3.01Å; G195-T197 PolarHBondContact O-N 3Å; G195-T197 VanDerWaalsContact O-N 3.12Å; G195-G198 PolarHBondContact O-N 3.12Å
196	S	85.1	Confident	88.5	Confident	67 Å²	67	123.1 Å²	123.1	47%	0.469	71%	0.71	S	S	.	*	T	Hydrogen-bonded Turn	trans	-58.5	-20.2	177.4	60.2	0	0	0	0	114.8	G192 G193 G198	G192-S196 VanDerWaalsContact C-OG 3.28Å; G193-S196 PolarHBondContact N-OG 3.22Å; G193-S196 WeakPolarHBondContact O-CB 3.34Å; G193-S196 PolarHBondContact O-N 3.12Å; G193-S196 VanDerWaalsContact O-N 3.11Å; S196-G198 VanDerWaalsContact C-N 3.28Å
197	T	83.8	Confident	87.8	Confident	130 Å²	130	117.9 Å²	117.9	80%	0.798	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	5.7	176.4	56.7	0	0	0	0	113.3	G195	G195-T197 PolarHBondContact O-N 3Å; G195-T197 VanDerWaalsContact O-N 3.12Å
198	G	82.4	Confident	87.1	Confident	55 Å²	55	120.4 Å²	120.4	57%	0.567	71%	0.709	S	S	*	*			trans	82.5	-171.6	-179.1	0	0	0	0	0	113.4	G195 S196	G195-G198 PolarHBondContact O-N 3.12Å; S196-G198 VanDerWaalsContact C-N 3.28Å
199	R	76.1	Confident	86.5	Confident	244 Å²	244	116.8 Å²	116.8	92%	0.921	69%	0.685	S	S	*	*			trans	-111.4	-13	-170.8	-142.3	175.9	-175.2	121.7	-1	113.8
200	N	70.1	Confident	85.8	Confident	227 Å²	227	111.3 Å²	111.3	100%	1.214	69%	0.687	S	S	*	*			trans	-138.7	0	-171.6	-59.4	-21.8	0	0	0	111.5

Retrieved 200 of 200 residues in 208.7 ms (Link to these results)

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