A0A077ZD19_TRITR Loading...

RNA-binding protein 8A

Core component of the splicing-dependent multiprotein exon junction complex (EJC) deposited at splice junctions on mRNAs.

AlphaFold DB , UniProt , Accession A0A077ZD19, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 153 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	58.2	Low	59.4	Low	225 Å²	225	147.3 Å²	147.3	100%	1.108	80%	0.804	S	S	*	*				0	75.7	0	-78.8	-172.2	-179.4	0	0	104.2	S3	M1-S3 PolarHBondContact O-N 3.27Å
2	D	55.8	Low	59.5	Low	148 Å²	148	144.1 Å²	144.1	79%	0.791	80%	0.8	S	S	*	*			trans	-90.6	87.3	-174.3	-54.5	-75.2	0	0	0	105.3	D4	D2-D4 VanDerWaalsContact C-N 3.28Å; D2-D4 PolarHBondContact O-N 3.3Å
3	S	61.9	Low	59.8	Low	110 Å²	110	140.6 Å²	140.6	77%	0.769	79%	0.792	S	S	*	*			trans	-85.2	84.9	167.5	-58	0	0	0	0	106.1	M1 M5	M1-S3 PolarHBondContact O-N 3.27Å; S3-M5 VanDerWaalsContact C-N 3.28Å; S3-M5 PolarHBondContact O-N 2.9Å
4	D	65.7	Low	59.7	Low	153 Å²	153	140.9 Å²	140.9	82%	0.818	78%	0.784	S	S	*	*			trans	-54.7	95.8	162.3	-67.8	-55.1	0	0	0	107.3	D2	D2-D4 VanDerWaalsContact C-N 3.28Å; D2-D4 PolarHBondContact O-N 3.3Å
5	M	68.4	Low	59.6	Low	181 Å²	181	138.3 Å²	138.3	89%	0.892	77%	0.767	S	S	*	*			trans	-94.3	117.2	176.7	-162.8	152	-162.2	0	0	107.6	S3 D7	S3-M5 VanDerWaalsContact C-N 3.28Å; S3-M5 PolarHBondContact O-N 2.9Å; M5-D7 PolarHBondContact O-N 3.39Å
6	D	61.1	Low	59.6	Low	145 Å²	145	134.4 Å²	134.4	78%	0.775	76%	0.759	S	S	*	*			trans	-41.1	123	-172	-58	-73.8	0	0	0	113.4	I8	D6-I8 PolarHBondContact O-N 2.8Å
7	D	64.6	Low	59.5	Low	157 Å²	157	130.3 Å²	130.3	84%	0.84	75%	0.746	S	S	*	*			trans	-56.5	107.6	161.7	-85.8	-49.4	0	0	0	108.1	M5 V9	M5-D7 PolarHBondContact O-N 3.39Å; D7-V9 PolarHBondContact O-N 2.98Å
8	I	56.2	Low	59.6	Low	149 Å²	149	128.1 Å²	128.1	76%	0.764	74%	0.735	S	S	*	*			trans	-63.6	95.5	167.7	-70.7	173.3	0	0	0	106.4	D6 I10	D6-I8 PolarHBondContact O-N 2.8Å; I8-I10 VanDerWaalsContact C-N 3.26Å; I8-I10 HydrophobicContact CG2-CG1 4.15Å; I8-I10 PolarHBondContact O-N 2.81Å
9	V	54.6	Low	59.6	Low	130 Å²	130	131.3 Å²	131.3	79%	0.788	73%	0.734	S	S	*	*			trans	-58.9	93	162.4	-78.1	0	0	0	0	107.4	D7 S11	D7-V9 PolarHBondContact O-N 2.98Å; V9-S11 PolarHBondContact O-N 2.86Å
10	I	55.9	Low	59.6	Low	139 Å²	139	130.5 Å²	130.5	71%	0.713	72%	0.724	S	S	*	*			trans	-63.2	96.6	165.8	-61.7	176.5	0	0	0	105.3	I8 S12	I8-I10 VanDerWaalsContact C-N 3.26Å; I8-I10 HydrophobicContact CG2-CG1 4.15Å; I8-I10 PolarHBondContact O-N 2.81Å; I10-S12 PolarHBondContact O-N 3.21Å
11	S	50.6	Low	59.3	Low	83 Å²	83	131 Å²	131	58%	0.58	73%	0.725	S	S	*	*			trans	-56	125.4	178.3	61.8	0	0	0	0	108.1	V9 S13	V9-S11 PolarHBondContact O-N 2.86Å; S11-S13 PolarHBondContact O-N 2.7Å
12	S	60.7	Low	59.3	Low	109 Å²	109	129.1 Å²	129.1	76%	0.762	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.6	18.9	-178.6	172.5	0	0	0	0	115.8	I10	I10-S12 PolarHBondContact O-N 3.21Å
13	S	63.6	Low	59.5	Low	99 Å²	99	128.9 Å²	128.9	69%	0.692	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	-10.9	-178	-159.4	0	0	0	0	114.1	S11	S11-S13 PolarHBondContact O-N 2.7Å
14	E	59	Low	59.2	Low	145 Å²	145	132.1 Å²	132.1	68%	0.678	71%	0.707	S	S	*	*	S	Bend	trans	-95.3	-10.6	-178.7	-65.9	-177.7	136.9	0	0	113.8	A16 A17	E14-A16 PolarHBondContact O-N 3.24Å; E14-A17 PolarHBondContact O-N 3.25Å
15	D	58	Low	58.7	Low	101 Å²	101	128.9 Å²	128.9	54%	0.54	70%	0.702	S	S	.	*	H	α-helix	trans	-71.2	-16.2	-179.7	-112.6	-44.3	0	0	0	113.9
16	A	59.9	Low	58.2	Low	76 Å²	76	129.2 Å²	129.2	63%	0.628	70%	0.698	S	S	*	*	H	α-helix	trans	-74.7	-34.7	173.9	0	0	0	0	0	112.2	E14	E14-A16 PolarHBondContact O-N 3.24Å
17	A	57.5	Low	57.9	Low	65 Å²	65	129.6 Å²	129.6	54%	0.537	70%	0.7	S	S	.	*	H	α-helix	trans	-72.9	-36.9	-174.2	0	0	0	0	0	112.5	E14 R19	E14-A17 PolarHBondContact O-N 3.25Å; A17-R19 VanDerWaalsContact C-N 3.35Å; A17-R19 PolarHBondContact O-N 3.46Å
18	V	60.9	Low	57.3	Low	90 Å²	90	131.5 Å²	131.5	55%	0.545	70%	0.701	S	S	.	*	H	α-helix	trans	-71.9	-24.9	178.9	-87.2	0	0	0	0	113.6
19	R	59	Low	57	Low	190 Å²	190	133.6 Å²	133.6	72%	0.717	71%	0.705	S	S	*	*	H	α-helix	trans	-76.8	-30.5	177.7	-72.7	-175.8	-178.3	-167.9	1.4	113.3	A17	A17-R19 VanDerWaalsContact C-N 3.35Å; A17-R19 PolarHBondContact O-N 3.46Å
20	E	60.5	Low	56.6	Low	115 Å²	115	130.1 Å²	130.1	54%	0.537	70%	0.695	S	S	.	*	H	α-helix	trans	-76.5	-33.5	-179.8	-158.6	59	-163.8	0	0	111.8	K22 K23	E20-K22 VanDerWaalsContact C-N 3.26Å; E20-K22 PolarHBondContact O-N 2.82Å; E20-K23 PolarHBondContact O-N 3.48Å; E20-K23 VanDerWaalsContact O-N 3.14Å; E20-K23 IonicContact OE1-NZ 3.94Å; E20-K23 IonicContact OE2-NZ 2.82Å; E20-K23 PolarHBondContact OE2-NZ 3.23Å
21	L	53.6	Low	56.6	Low	141 Å²	141	135.6 Å²	135.6	74%	0.738	71%	0.707	S	S	*	*	H	α-helix	trans	-64.3	-23.2	176.9	-86.2	158.5	0	0	0	114.3	K23	L21-K23 VanDerWaalsContact C-N 3.33Å; L21-K23 PolarHBondContact O-N 3.14Å
22	K	57.5	Low	56.3	Low	186 Å²	186	135.3 Å²	135.3	81%	0.809	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.4	-16.3	175.6	-95.7	-173.9	176.2	-170.3	0	114.3	E20	E20-K22 VanDerWaalsContact C-N 3.26Å; E20-K22 PolarHBondContact O-N 2.82Å
23	K	59.3	Low	55.8	Low	142 Å²	142	135 Å²	135	62%	0.617	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-23.3	-175.6	-66.8	-179	-169.6	154.6	0	113.9	E20 L21	E20-K23 PolarHBondContact O-N 3.48Å; E20-K23 VanDerWaalsContact O-N 3.14Å; E20-K23 IonicContact OE1-NZ 3.94Å; E20-K23 IonicContact OE2-NZ 2.82Å; E20-K23 PolarHBondContact OE2-NZ 3.23Å; L21-K23 VanDerWaalsContact C-N 3.33Å; L21-K23 PolarHBondContact O-N 3.14Å
24	M	55.8	Low	55.4	Low	179 Å²	179	135.3 Å²	135.3	88%	0.882	71%	0.709	S	S	*	*	G	3₁₀ helix	trans	-86.7	-3.5	-177.1	-87.7	173.5	120	0	0	115.3	K26	M24-K26 VanDerWaalsContact C-N 3.31Å; M24-K26 PolarHBondContact O-N 3.38Å
25	A	56.6	Low	55.1	Low	85 Å²	85	138.6 Å²	138.6	70%	0.702	72%	0.715	S	S	*	*	G	3₁₀ helix	trans	-81.7	-0.8	-177.8	0	0	0	0	0	114.8
26	K	56.9	Low	55	Low	188 Å²	188	141.7 Å²	141.7	82%	0.817	73%	0.732	S	S	*	*	G	3₁₀ helix	trans	-90.5	-9.9	-167.5	-136	174.9	-175.9	176.5	0	116.5	M24	M24-K26 VanDerWaalsContact C-N 3.31Å; M24-K26 PolarHBondContact O-N 3.38Å
27	D	54.7	Low	54.5	Low	153 Å²	153	147.3 Å²	147.3	82%	0.818	74%	0.744	S	S	*	*			trans	-116.2	21.6	-174.5	-68.1	-42.4	0	0	0	115.2	K29	D27-K29 PolarHBondContact O-N 2.66Å
28	F	52.3	Low	53.9	Low	196 Å²	196	147.1 Å²	147.1	86%	0.86	75%	0.749	S	S	*	*			trans	-77.1	60.6	162.3	-156.1	-96.3	0	0	0	110.4	G30	F28-G30 PolarHBondContact O-N 2.78Å
29	K	50.2	Low	53.3	Low	194 Å²	194	147.6 Å²	147.6	84%	0.843	76%	0.762	S	S	*	*			trans	-65.6	99.2	165	-176	110.4	163.2	-174.8	0	106.4	D27 R31	D27-K29 PolarHBondContact O-N 2.66Å; K29-R31 PolarHBondContact O-N 3.01Å
30	G	46.8	Very low	52.1	Low	57 Å²	57	146.4 Å²	146.4	59%	0.588	76%	0.763	S	S	*	*			trans	-43.7	126.2	178.7	0	0	0	0	0	111.5	F28 G32	F28-G30 PolarHBondContact O-N 2.78Å; G30-G32 PolarHBondContact O-N 2.83Å
31	R	55.4	Low	51.4	Low	254 Å²	254	147.8 Å²	147.8	96%	0.958	77%	0.769	S	S	*	*			trans	-69	102.2	166.6	-77.9	175.3	114.2	120.3	-3.9	106.8	K29 S33	K29-R31 PolarHBondContact O-N 3.01Å; R31-S33 PolarHBondContact O-N 2.88Å
32	G	44.7	Very low	51	Low	77 Å²	77	149.7 Å²	149.7	79%	0.794	77%	0.774	S	S	*	*			trans	-54.4	125.8	172.1	0	0	0	0	0	110.7	G30	G30-G32 PolarHBondContact O-N 2.83Å
33	S	48.8	Very low	50.2	Low	103 Å²	103	146.9 Å²	146.9	72%	0.72	77%	0.768	S	S	*	*			trans	-70.2	128.1	151.7	-175.5	0	0	0	0	107.7	R31	R31-S33 PolarHBondContact O-N 2.88Å
34	D	56.6	Low	49.5	Very low	104 Å²	104	143.6 Å²	143.6	56%	0.556	78%	0.775	S	S	*	*				170.5	125.3	115.4	-97.4	-19.6	0	0	0	113.7
35	R	52.9	Low	49.1	Very low	215 Å²	215	142.4 Å²	142.4	81%	0.811	77%	0.772	S	S	*	*			trans	66.5	101.5	136.1	-62.7	178.7	-82.8	177.1	-6	118.2
36	N	55.7	Low	48.4	Very low	166 Å²	166	141.3 Å²	141.3	89%	0.888	77%	0.769	S	S	*	*				-134.1	120.8	128	-168.3	29.9	0	0	0	110
37	H	48.4	Very low	47.9	Very low	193 Å²	193	137 Å²	137	89%	0.894	77%	0.768	S	S	*	*			trans	-100.2	92.2	-175.5	-152.4	-66.6	0	0	0	106.7
38	G	45.6	Very low	47.9	Very low	62 Å²	62	135.7 Å²	135.7	64%	0.639	77%	0.765	S	S	*	*			trans	-101.8	122.9	176.2	0	0	0	0	0	110.9	F40	G38-F40 PolarHBondContact O-N 2.73Å
39	A	48.5	Very low	48	Very low	99 Å²	99	135.2 Å²	135.2	82%	0.818	77%	0.766	S	S	*	*			trans	-46.4	125.3	170.3	0	0	0	0	0	111.4
40	F	32.8	Very low	48.1	Very low	165 Å²	165	135 Å²	135	72%	0.724	77%	0.765	S	S	*	*				63.7	129.8	80.3	-152	-120.4	0	0	0	114.8	G38	G38-F40 PolarHBondContact O-N 2.73Å
41	E	46.2	Very low	48.4	Very low	145 Å²	145	140.2 Å²	140.2	68%	0.678	77%	0.774	S	S	*	*			trans	89	98.6	168.9	-48.5	-172.6	162.8	0	0	114.8
42	E	44.6	Very low	48.5	Very low	180 Å²	180	135.6 Å²	135.6	84%	0.841	77%	0.767	S	S	*	*				65.9	131.5	86.7	-75.8	-168.6	162.6	0	0	111
43	D	41.9	Very low	49.1	Very low	127 Å²	127	135.9 Å²	135.9	68%	0.679	75%	0.753	S	S	*	*			cis	-153	129.3	23	170.7	30.5	0	0	0	106.1	N45	D43-N45 PolarHBondContact OD1-ND2 3.08Å
44	G	43.5	Very low	49.6	Very low	74 Å²	74	142 Å²	142	76%	0.763	76%	0.76	S	S	*	*			trans	-146	58.9	-178.4	0	0	0	0	0	108.3	G46	G44-G46 PolarHBondContact O-N 2.85Å
45	N	48.5	Very low	49.6	Very low	154 Å²	154	145.1 Å²	145.1	82%	0.824	77%	0.772	S	S	*	*			trans	-61.9	70.6	169.3	-81.7	-32.3	0	0	0	110.9	D43	D43-N45 PolarHBondContact OD1-ND2 3.08Å
46	G	40.7	Very low	49.7	Very low	61 Å²	61	142.3 Å²	142.3	63%	0.629	77%	0.768	S	S	*	*			trans	-122.4	54.1	167.8	0	0	0	0	0	108.3	G44 V48	G44-G46 PolarHBondContact O-N 2.85Å; G46-V48 PolarHBondContact O-N 2.71Å
47	A	46.8	Very low	49.7	Very low	98 Å²	98	142.4 Å²	142.4	81%	0.81	76%	0.763	S	S	*	*			trans	-67.8	83.2	168.7	0	0	0	0	0	108	Q49	A47-Q49 VanDerWaalsContact C-N 3.3Å; A47-Q49 PolarHBondContact O-N 3.11Å
48	V	54.9	Low	50.3	Low	125 Å²	125	134.6 Å²	134.6	76%	0.758	73%	0.732	S	S	*	*			trans	-46.9	104.3	154.2	153.4	0	0	0	0	105.6	G46 K50	G46-V48 PolarHBondContact O-N 2.71Å; V48-K50 PolarHBondContact O-N 3.42Å
49	Q	54.1	Low	51.4	Low	186 Å²	186	135.1 Å²	135.1	87%	0.869	73%	0.725	S	S	*	*			trans	-65.5	93.8	168.4	-156.9	143.8	25.8	0	0	104.5	A47 Q51	A47-Q49 VanDerWaalsContact C-N 3.3Å; A47-Q49 PolarHBondContact O-N 3.11Å; Q49-Q51 PolarHBondContact O-N 3.32Å
50	K	53.5	Low	53.1	Low	189 Å²	189	136.1 Å²	136.1	82%	0.822	71%	0.711	S	S	*	*			trans	-65.6	90.5	179.9	-150	179.3	-167.7	-175.8	0	105.5	V48 I52	V48-K50 PolarHBondContact O-N 3.42Å; K50-I52 VanDerWaalsContact C-N 3.35Å; K50-I52 PolarHBondContact O-N 3.26Å
51	Q	52.5	Low	55.9	Low	167 Å²	167	130.8 Å²	130.8	78%	0.78	69%	0.692	S	S	*	*			trans	-49.3	103.2	174	-177.3	176.6	-32.7	0	0	105.9	Q49 T53	Q49-Q51 PolarHBondContact O-N 3.32Å; Q51-T53 PolarHBondContact O-N 3.17Å
52	I	56.7	Low	58.3	Low	157 Å²	157	125.7 Å²	125.7	81%	0.805	67%	0.672	S	S	*	*			trans	-58	102.8	169.6	-59.4	170.8	0	0	0	103.1	K50 R54	K50-I52 VanDerWaalsContact C-N 3.35Å; K50-I52 PolarHBondContact O-N 3.26Å; I52-R54 PolarHBondContact O-N 3.06Å; I52-R54 VanDerWaalsContact O-N 3.13Å
53	T	57.6	Low	60.7	Low	84 Å²	84	119 Å²	119	52%	0.515	64%	0.644	S	S	.	*			trans	-57.7	123.9	-179.2	39	0	0	0	0	105.8	Q51 E55 E56	Q51-T53 PolarHBondContact O-N 3.17Å; T53-E55 PolarHBondContact O-N 3.22Å; T53-E56 PolarHBondContact O-N 2.8Å
54	R	60	Low	63.2	Low	230 Å²	230	116 Å²	116	87%	0.868	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.3	-11.2	-174.5	-174.3	177.1	171.7	-176.6	-2.3	114	I52	I52-R54 PolarHBondContact O-N 3.06Å; I52-R54 VanDerWaalsContact O-N 3.13Å
55	E	56.6	Low	65.7	Low	170 Å²	170	113.5 Å²	113.5	79%	0.794	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	-5.3	-175.3	-67.6	-174	152.9	0	0	115.3	T53	T53-E55 PolarHBondContact O-N 3.22Å
56	E	55.7	Low	67.9	Low	156 Å²	156	113.6 Å²	113.6	73%	0.729	61%	0.608	S	S	*	*			trans	-102	31	175.2	-145.6	174.2	177.9	0	0	113	T53 A58	T53-E56 PolarHBondContact O-N 2.8Å; E56-A58 PolarHBondContact O-N 3.48Å
57	Q	55.9	Low	70.5	Confident	169 Å²	169	115.6 Å²	115.6	79%	0.79	60%	0.604	S	S	*	*			trans	-67.7	73.6	148.4	-68.7	-175.6	5.2	0	0	107.2	C59	Q57-C59 PolarHBondContact O-N 2.94Å
58	A	60	Low	72.9	Confident	29 Å²	29	111.4 Å²	111.4	24%	0.24	57%	0.571	C	S	.	*			trans	-56.3	121.7	165.2	0	0	0	0	0	106.2	E56 F60	E56-A58 PolarHBondContact O-N 3.48Å; A58-F60 HydrophobicContact CB-CD2 4.26Å; A58-F60 HydrophobicContact CB-CE2 3.82Å; A58-F60 HydrophobicContact CB-CZ 4.21Å; A58-F60 WeakPolarHBondContact O-CD2 3.38Å; A58-F60 PolarHBondContact O-N 3.18Å
59	C	67.8	Low	74.9	Confident	73 Å²	73	107.9 Å²	107.9	49%	0.493	54%	0.544	S	S	.	.			trans	-69.8	108	171.9	-38.6	0	0	0	0	106.2	Q57 E150	Q57-C59 PolarHBondContact O-N 2.94Å; C59-E150 WeakPolarHBondContact CA-OE1 3.31Å; C59-E150 HydrophobicContact CB-CG 4.25Å; C59-E150 WeakPolarHBondContact CB-OE1 3.27Å; C59-E150 WeakPolarHBondContact CB-OE2 3.43Å; C59-E150 PolarHBondContact N-OE1 2.89Å; C59-E150 WeakPolarHBondContact O-CB 3.31Å; C59-E150 WeakPolarHBondContact O-CG 3.17Å; C59-E150 PolarHBondContact O-N 3.43Å; C59-E150 VanDerWaalsContact SG-CD 3.55Å; C59-E150 PolarHBondContact SG-OE1 2.77Å
60	F	85.6	Confident	77.1	Confident	120 Å²	120	100.4 Å²	100.4	53%	0.526	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	133.1	171.8	-74.9	-86.1	0	0	0	107.9	A58 M147 K148 P149	A58-F60 HydrophobicContact CB-CD2 4.26Å; A58-F60 HydrophobicContact CB-CE2 3.82Å; A58-F60 HydrophobicContact CB-CZ 4.21Å; A58-F60 WeakPolarHBondContact O-CD2 3.38Å; A58-F60 PolarHBondContact O-N 3.18Å; F60-M147 HydrophobicContact CB-CB 4.04Å; F60-M147 HydrophobicContact CB-SD 4.35Å; F60-M147 HydrophobicContact CD1-CB 4.4Å; F60-K148 CarbonylContact C-O 3.59Å; F60-K148 WeakPolarHBondContact CA-O 3.42Å; F60-P149 HydrophobicContact CD1-CB 4.44Å; F60-P149 HydrophobicContact CE1-CB 4.13Å
61	V	91.3	Very high	79.2	Confident	53 Å²	53	91.4 Å²	91.4	32%	0.321	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	139.5	175.3	-58.3	0	0	0	0	109.8	M147 K148	V61-M147 CarbonylContact O-C 3.54Å; V61-M147 VanDerWaalsContact O-CA 3.26Å; V61-M147 WeakPolarHBondContact O-CA 3.25Å; V61-K148 HydrophobicContact CG2-CD 4.07Å; V61-K148 HydrophobicContact CG2-CG 3.44Å; V61-K148 VanDerWaalsContact CG2-CG 3.44Å; V61-K148 PolarHBondContact N-O 3.25Å; V61-K148 PolarHBondContact O-N 2.87Å
62	P	95.8	Very high	81.4	Confident	38 Å²	38	85.9 Å²	85.9	25%	0.247	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.7	141.5	173.3	-26.5	36.8	0	0	0	111.8	W69 F120 W144	P62-W69 HydrophobicContact CB-CZ3 3.87Å; P62-F120 HydrophobicContact CB-CE2 4.01Å; P62-F120 HydrophobicContact CG-CE2 4.2Å; P62-W144 HydrophobicContact CB-CD2 3.62Å; P62-W144 HydrophobicContact CB-CE3 4Å; P62-W144 HydrophobicContact CB-CG 3.87Å; P62-W144 HydrophobicContact CB-CZ2 4.24Å; P62-W144 HydrophobicContact CB-CZ3 4.45Å; P62-W144 HydrophobicContact CG-CD2 3.78Å; P62-W144 VanDerWaalsContact CG-CE2 3.48Å; P62-W144 HydrophobicContact CG-CG 3.81Å; P62-W144 HydrophobicContact CG-CZ2 4.09Å; P62-W144 VanDerWaalsContact CG-NE1 3.33Å
63	C	94.6	Very high	83.4	Confident	39 Å²	39	78.4 Å²	78.4	26%	0.264	41%	0.406	S	S	.	.			trans	-120.3	137.7	177.7	-170.8	0	0	0	0	109.9	F146	C63-F146 HydrophobicContact CB-CB 4.12Å; C63-F146 PolarHBondContact N-O 3.37Å
64	P	96	Very high	85.3	Confident	65 Å²	65	79.7 Å²	79.7	42%	0.422	40%	0.401	S	S	.	.			trans	-64.9	157.7	174.6	28.6	-36.4	0	0	0	111.7	G68 W69	P64-G68 CarbonylContact C-O 3.59Å; P64-G68 WeakPolarHBondContact CA-O 3.48Å; P64-G68 WeakPolarHBondContact CB-O 3.44Å; P64-W69 HydrophobicContact CB-CD2 4.29Å; P64-W69 HydrophobicContact CB-CE3 4.48Å; P64-W69 HydrophobicContact CB-CH2 4.26Å; P64-W69 HydrophobicContact CB-CZ2 4Å; P64-W69 HydrophobicContact CB-CZ3 4.46Å; P64-W69 HydrophobicContact CG-CH2 4.46Å; P64-W69 HydrophobicContact CG-CZ2 4.46Å
65	S	95.1	Very high	87.1	Confident	21 Å²	21	72.5 Å²	72.5	15%	0.147	38%	0.38	C	S	.	.	B	Isolated β-bridge	trans	-79.5	-173.9	164.3	67.5	0	0	0	0	110.4	D67 G68 L70 E116	S65-D67 PolarHBondContact O-N 3.27Å; S65-D67 PolarHBondContact OG-N 2.87Å; S65-G68 PolarHBondContact N-O 3.2Å; S65-G68 WeakPolarHBondContact OG-CA 3.44Å; S65-G68 PolarHBondContact OG-N 2.87Å; S65-G68 VanDerWaalsContact OG-N 3.08Å; S65-G68 PolarHBondContact OG-O 3.33Å; S65-G68 VanDerWaalsContact OG-O 3.11Å; S65-L70 VanDerWaalsContact CB-CD1 3.48Å; S65-E116 PolarHBondContact OG-OE1 2.91Å
66	V	95.6	Very high	88.9	Confident	156 Å²	156	64.9 Å²	64.9	95%	0.945	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-36.7	173.6	173.6	0	0	0	0	111.4
67	D	94.4	Very high	90.8	Very high	102 Å²	102	58.5 Å²	58.5	55%	0.545	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-146.2	49.7	-172	-167.4	13	0	0	0	112.1	S65 K96	S65-D67 PolarHBondContact O-N 3.27Å; S65-D67 PolarHBondContact OG-N 2.87Å; D67-K96 WeakPolarHBondContact O-CD 3.12Å; D67-K96 WeakPolarHBondContact O-CE 3.2Å; D67-K96 PolarHBondContact O-NZ 3.32Å; D67-K96 IonicContact OD1-NZ 2.88Å; D67-K96 PolarHBondContact OD1-NZ 2.84Å; D67-K96 IonicContact OD2-NZ 3.87Å; D67-K96 PolarHBondContact OD2-NZ 2.89Å
68	G	96.5	Very high	92.5	Very high	11 Å²	11	56.9 Å²	56.9	11%	0.113	31%	0.31	C	S	.	.	B	Isolated β-bridge	trans	147	-146.9	177	0	0	0	0	0	113.9	P64 S65 Y117	P64-G68 CarbonylContact C-O 3.59Å; P64-G68 WeakPolarHBondContact CA-O 3.48Å; P64-G68 WeakPolarHBondContact CB-O 3.44Å; S65-G68 PolarHBondContact N-O 3.2Å; S65-G68 WeakPolarHBondContact OG-CA 3.44Å; S65-G68 PolarHBondContact OG-N 2.87Å; S65-G68 VanDerWaalsContact OG-N 3.08Å; S65-G68 PolarHBondContact OG-O 3.33Å; S65-G68 VanDerWaalsContact OG-O 3.11Å; G68-Y117 CarbonylContact C-O 3.51Å; G68-Y117 VanDerWaalsContact CA-O 3.27Å; G68-Y117 WeakPolarHBondContact CA-O 3.27Å
69	W	98.5	Very high	94	Very high	51 Å²	51	62.7 Å²	62.7	19%	0.193	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	119.5	-177.3	-67.8	84.5	0	0	0	110.1	P62 P64 Y117 K119 F120 A123 W144	P62-W69 HydrophobicContact CB-CZ3 3.87Å; P64-W69 HydrophobicContact CB-CD2 4.29Å; P64-W69 HydrophobicContact CB-CE3 4.48Å; P64-W69 HydrophobicContact CB-CH2 4.26Å; P64-W69 HydrophobicContact CB-CZ2 4Å; P64-W69 HydrophobicContact CB-CZ3 4.46Å; P64-W69 HydrophobicContact CG-CH2 4.46Å; P64-W69 HydrophobicContact CG-CZ2 4.46Å; W69-Y117 PolarHBondContact N-O 3.2Å; W69-Y117 PolarHBondContact O-N 3.04Å; W69-K119 VanDerWaalsContact CD1-C 3.49Å; W69-F120 HydrophobicContact CD2-CB 4.01Å; W69-F120 AromaticContact CD2-CD2 3.85Å; W69-F120 HydrophobicContact CD2-CD2 3.85Å; W69-F120 HydrophobicContact CD2-CG 4.45Å; W69-F120 AromaticContact CE2-CD2 3.93Å; W69-F120 AromaticContact CE3-CD2 3.63Å; W69-F120 HydrophobicContact CE3-CD2 3.63Å; W69-F120 HydrophobicContact CE3-CE2 4.35Å; W69-F120 HydrophobicContact CG-CB 4.36Å; W69-F120 HydrophobicContact CH2-CB 4.43Å; W69-F120 AromaticContact CH2-CD2 3.53Å; W69-F120 HydrophobicContact CH2-CD2 3.53Å; W69-F120 HydrophobicContact CH2-CE2 4.21Å; W69-F120 HydrophobicContact CH2-CG 4.31Å; W69-F120 HydrophobicContact CZ2-CB 3.8Å; W69-F120 AromaticContact CZ2-CD2 3.79Å; W69-F120 HydrophobicContact CZ2-CD2 3.79Å; W69-F120 HydrophobicContact CZ2-CG 4.16Å; W69-F120 AromaticContact CZ3-CD2 3.47Å; W69-F120 HydrophobicContact CZ3-CD2 3.47Å; W69-F120 VanDerWaalsContact CZ3-CD2 3.47Å; W69-F120 AromaticContact CZ3-CE2 3.97Å; W69-F120 HydrophobicContact CZ3-CE2 3.97Å; W69-A123 HydrophobicContact CB-CB 3.78Å; W69-W144 HydrophobicContact CB-CZ3 4.22Å; W69-W144 HydrophobicContact CD2-CZ3 4.36Å; W69-W144 HydrophobicContact CE3-CE3 4.25Å; W69-W144 HydrophobicContact CE3-CH2 4.33Å; W69-W144 AromaticContact CE3-CZ3 3.7Å; W69-W144 HydrophobicContact CE3-CZ3 3.7Å; W69-W144 HydrophobicContact CZ3-CZ3 4.47Å
70	L	98.5	Very high	95.2	Very high	28 Å²	28	59.3 Å²	59.3	15%	0.147	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	127.7	-177.1	-67.9	165.6	0	0	0	110.8	S65 I114 I115 E116 C145 F146	S65-L70 VanDerWaalsContact CB-CD1 3.48Å; L70-I114 HydrophobicContact CB-CG2 4.29Å; L70-I114 HydrophobicContact CD2-CG2 3.56Å; L70-I114 HydrophobicContact CG-CG2 4.38Å; L70-I115 WeakPolarHBondContact CA-O 3.35Å; L70-E116 HydrophobicContact CD2-CB 3.47Å; L70-E116 VanDerWaalsContact CD2-CB 3.47Å; L70-E116 HydrophobicContact CD2-CG 3.71Å; L70-E116 HydrophobicContact CG-CG 4.33Å; L70-C145 HydrophobicContact CB-CB 3.57Å; L70-C145 VanDerWaalsContact O-CB 3.29Å; L70-C145 WeakPolarHBondContact O-CB 3.35Å; L70-C145 PolarHBondContact O-N 3.49Å; L70-F146 HydrophobicContact CD1-CD2 4.07Å; L70-F146 HydrophobicContact CD1-CE2 3.41Å; L70-F146 VanDerWaalsContact CD1-CE2 3.41Å; L70-F146 HydrophobicContact CD1-CZ 4.1Å
71	I	98.6	Very high	95.7	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	146.2	168.5	69.2	165.5	0	0	0	109.4	V73 F89 I114 I115 Y117 A123 A126 I127 V142 G143 W144	I71-V73 HydrophobicContact CD1-CG2 4.4Å; I71-F89 HydrophobicContact CD1-CD1 4.1Å; I71-F89 HydrophobicContact CD1-CE1 3.81Å; I71-I114 WeakPolarHBondContact O-CA 3Å; I71-I115 HydrophobicContact CD1-CB 4.18Å; I71-I115 HydrophobicContact CD1-CD1 4.46Å; I71-I115 HydrophobicContact CG1-CB 3.75Å; I71-I115 HydrophobicContact CG1-CG2 4.49Å; I71-I115 PolarHBondContact N-O 3.33Å; I71-I115 PolarHBondContact O-N 3.17Å; I71-Y117 HydrophobicContact CD1-CD2 4.47Å; I71-Y117 HydrophobicContact CD1-CE2 3.75Å; I71-Y117 HydrophobicContact CG1-CE2 4.2Å; I71-A123 HydrophobicContact CG2-CB 3.67Å; I71-A126 HydrophobicContact CD1-CB 4.09Å; I71-I127 HydrophobicContact CB-CD1 4.42Å; I71-I127 HydrophobicContact CB-CG1 4.29Å; I71-I127 HydrophobicContact CG2-CD1 3.66Å; I71-I127 HydrophobicContact CG2-CG1 3.82Å; I71-V142 HydrophobicContact CB-CG1 4.44Å; I71-V142 HydrophobicContact CD1-CG1 3.86Å; I71-G143 CarbonylContact C-O 3.58Å; I71-G143 VanDerWaalsContact CA-O 3.31Å; I71-G143 WeakPolarHBondContact CA-O 3.4Å; I71-W144 HydrophobicContact CG2-CE3 4.49Å
72	F	98.3	Very high	95.9	Very high	51 Å²	51	59.3 Å²	59.3	22%	0.224	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	129.3	175.9	-173.5	-123	0	0	0	109.5	R74 T112 A113 I114 V142 G143 C145	F72-R74 HydrophobicContact CD1-CG 3.68Å; F72-R74 HydrophobicContact CE1-CG 3.17Å; F72-R74 HydrophobicContact CZ-CG 3.8Å; F72-T112 HydrophobicContact CZ-CG2 4.06Å; F72-A113 WeakPolarHBondContact CD2-O 3.32Å; F72-I114 HydrophobicContact CD2-CD1 4.5Å; F72-I114 HydrophobicContact CD2-CG1 3.69Å; F72-I114 HydrophobicContact CE2-CG1 4.23Å; F72-V142 WeakPolarHBondContact O-CA 3.4Å; F72-G143 PolarHBondContact N-O 3.33Å; F72-G143 PolarHBondContact O-N 2.85Å; F72-C145 HydrophobicContact CB-CB 4.49Å
73	V	98.2	Very high	96	Very high	0 Å²	0	62.2 Å²	62.2	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	125.3	-179.1	-173.3	0	0	0	0	108.3	I71 L76 F89 T112 A113 I115 E141 V142	I71-V73 HydrophobicContact CD1-CG2 4.4Å; V73-L76 HydrophobicContact CB-CD1 4.44Å; V73-L76 HydrophobicContact CG1-CD1 4.02Å; V73-L76 HydrophobicContact CG1-CD2 3.79Å; V73-L76 HydrophobicContact CG1-CG 3.92Å; V73-F89 HydrophobicContact CG1-CZ 4.29Å; V73-F89 HydrophobicContact CG2-CE1 4.33Å; V73-F89 HydrophobicContact CG2-CE2 4.23Å; V73-F89 HydrophobicContact CG2-CZ 3.69Å; V73-T112 CarbonylContact O-C 3.56Å; V73-T112 VanDerWaalsContact O-CA 3.26Å; V73-T112 WeakPolarHBondContact O-CA 3.44Å; V73-A113 PolarHBondContact N-O 2.62Å; V73-A113 PolarHBondContact O-N 3.26Å; V73-I115 HydrophobicContact CG2-CD1 4.07Å; V73-E141 CarbonylContact C-O 3.58Å; V73-E141 WeakPolarHBondContact CA-O 3.46Å; V73-V142 HydrophobicContact CG1-CG2 4.25Å; V73-V142 HydrophobicContact CG2-CG1 4.23Å; V73-V142 HydrophobicContact CG2-CG2 4.39Å
74	R	98	Very high	96.1	Very high	111 Å²	111	63.3 Å²	63.3	42%	0.419	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	165.6	175.5	-62.8	-171	-70.7	-90.6	2.2	111.9	F72 T112 E141	F72-R74 HydrophobicContact CD1-CG 3.68Å; F72-R74 HydrophobicContact CE1-CG 3.17Å; F72-R74 HydrophobicContact CZ-CG 3.8Å; R74-T112 HydrophobicContact CB-CG2 4.43Å; R74-T112 HydrophobicContact CG-CG2 4.1Å; R74-E141 HydrophobicContact CB-CB 4.24Å; R74-E141 IonicContact CZ-OE2 3.23Å; R74-E141 VanDerWaalsContact CZ-OE2 3.23Å; R74-E141 PolarHBondContact N-O 2.81Å; R74-E141 IonicContact NE-OE2 2.87Å; R74-E141 PolarHBondContact NE-OE2 3.13Å; R74-E141 IonicContact NH2-OE2 2.72Å; R74-E141 PolarHBondContact NH2-OE2 2.86Å; R74-E141 PolarHBondContact O-N 3.17Å; R74-E141 VanDerWaalsContact O-N 3.15Å
75	N	97.2	Very high	96.1	Very high	80 Å²	80	60.2 Å²	60.2	43%	0.428	31%	0.305	S	S	.	.			trans	63.6	40	177.6	-160.3	35.8	0	0	0	112.3	G111 S138 K139	N75-G111 PolarHBondContact N-O 2.96Å; N75-G111 VanDerWaalsContact N-O 3.07Å; N75-S138 WeakPolarHBondContact O-CB 3.33Å; N75-K139 WeakPolarHBondContact CB-O 3.35Å; N75-K139 PolarHBondContact ND2-N 3.48Å; N75-K139 PolarHBondContact ND2-O 3.14Å
76	L	96.3	Very high	96.3	Very high	9 Å²	9	63.9 Å²	63.9	5%	0.047	32%	0.319	C	S	.	.			trans	-77.3	146.8	169.7	-63.9	166.2	0	0	0	109.7	V73 I80 L85 L100 G111 A113 W135 L140	V73-L76 HydrophobicContact CB-CD1 4.44Å; V73-L76 HydrophobicContact CG1-CD1 4.02Å; V73-L76 HydrophobicContact CG1-CD2 3.79Å; V73-L76 HydrophobicContact CG1-CG 3.92Å; L76-I80 HydrophobicContact CD2-CG2 4.49Å; L76-L85 HydrophobicContact CD1-CD1 4.27Å; L76-L85 HydrophobicContact CD1-CD2 3.95Å; L76-L85 HydrophobicContact CD2-CD2 3.89Å; L76-L100 HydrophobicContact CD1-CD1 4.27Å; L76-G111 PolarHBondContact N-O 3.47Å; L76-G111 VanDerWaalsContact O-CA 3.31Å; L76-G111 WeakPolarHBondContact O-CA 3.17Å; L76-A113 HydrophobicContact CD1-CB 3.73Å; L76-W135 HydrophobicContact CD2-CE3 3.98Å; L76-W135 HydrophobicContact CD2-CZ3 3.82Å; L76-L140 HydrophobicContact CD2-CD2 3.7Å; L76-L140 HydrophobicContact CG-CD2 4.5Å
77	S	93.9	Very high	96.4	Very high	23 Å²	23	60.7 Å²	60.7	16%	0.161	30%	0.297	C	S	.	.			trans	-65.2	149.9	170.5	179.3	0	0	0	0	110.6	E79 I80	S77-E79 PolarHBondContact O-N 3.16Å; S77-E79 PolarHBondContact OG-N 3.28Å; S77-I80 WeakPolarHBondContact O-CB 3.48Å; S77-I80 PolarHBondContact O-N 2.69Å; S77-I80 VanDerWaalsContact O-N 3.13Å
78	E	91.7	Very high	96.4	Very high	135 Å²	135	59.7 Å²	59.7	63%	0.631	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-16.2	174.3	-62.2	-176.7	-178.8	0	0	112.6	I80 P109	E78-I80 VanDerWaalsContact C-N 3.35Å; E78-P109 VanDerWaalsContact O-CD 3.25Å; E78-P109 WeakPolarHBondContact O-CD 3.47Å; E78-P109 VanDerWaalsContact O-CG 3.3Å; E78-P109 WeakPolarHBondContact O-CG 3.48Å
79	E	91.6	Very high	96.5	Very high	151 Å²	151	59.1 Å²	59.1	71%	0.706	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-12.5	176.4	-60.6	179	161	0	0	113.2	S77	S77-E79 PolarHBondContact O-N 3.16Å; S77-E79 PolarHBondContact OG-N 3.28Å
80	I	94.3	Very high	96.5	Very high	2 Å²	2	60.9 Å²	60.9	1%	0.01	29%	0.292	C	S	.	.			trans	-70.8	131.7	-177.6	-72	-67.4	0	0	0	110.7	L76 S77 E78 D84 L85 L100 P109 W135 I136	L76-I80 HydrophobicContact CD2-CG2 4.49Å; S77-I80 WeakPolarHBondContact O-CB 3.48Å; S77-I80 PolarHBondContact O-N 2.69Å; S77-I80 VanDerWaalsContact O-N 3.13Å; E78-I80 VanDerWaalsContact C-N 3.35Å; I80-D84 HydrophobicContact CD1-CB 4.15Å; I80-D84 HydrophobicContact CG2-CB 4.44Å; I80-L85 HydrophobicContact CG2-CD1 4.31Å; I80-L85 HydrophobicContact CG2-CD2 4.19Å; I80-L85 HydrophobicContact CG2-CG 3.8Å; I80-L100 WeakPolarHBondContact O-CD2 3.21Å; I80-P109 WeakPolarHBondContact O-CG 3.38Å; I80-W135 HydrophobicContact CD1-CD2 4.14Å; I80-W135 HydrophobicContact CD1-CE3 4.08Å; I80-W135 HydrophobicContact CD1-CH2 3.58Å; I80-W135 HydrophobicContact CD1-CZ2 3.57Å; I80-W135 HydrophobicContact CD1-CZ3 3.83Å; I80-W135 HydrophobicContact CG1-CZ3 4.43Å; I80-W135 HydrophobicContact CG2-CH2 4.47Å; I80-I136 HydrophobicContact CD1-CD1 3.33Å; I80-I136 HydrophobicContact CD1-CG1 4.24Å; I80-I136 HydrophobicContact CG1-CD1 4.11Å
81	T	95.3	Very high	96.4	Very high	68 Å²	68	65.8 Å²	65.8	42%	0.417	32%	0.318	S	S	.	.			trans	-101.2	166	171.9	72.5	0	0	0	0	112.1	Q83 D84 L85	T81-Q83 PolarHBondContact O-N 3.2Å; T81-Q83 PolarHBondContact OG1-N 3.39Å; T81-D84 WeakPolarHBondContact CB-OD2 3.42Å; T81-D84 PolarHBondContact N-OD2 2.88Å; T81-D84 PolarHBondContact O-N 3.32Å; T81-D84 VanDerWaalsContact OG1-CG 3.29Å; T81-D84 PolarHBondContact OG1-N 3.31Å; T81-D84 PolarHBondContact OG1-OD2 2.95Å; T81-L85 PolarHBondContact O-N 2.84Å
82	E	96.2	Very high	96.4	Very high	104 Å²	104	68.1 Å²	68.1	49%	0.486	33%	0.327	S	S	.	.	H	α-helix	trans	-60.6	-32.2	173	-166.3	-179.3	132.9	0	0	112	L85 K86 I98	E82-L85 WeakPolarHBondContact O-CB 3.3Å; E82-L85 PolarHBondContact O-N 3.35Å; E82-K86 PolarHBondContact O-N 2.99Å; E82-I98 HydrophobicContact CG-CB 3.93Å; E82-I98 HydrophobicContact CG-CG2 3.68Å
83	Q	97	Very high	96.3	Very high	99 Å²	99	66.6 Å²	66.6	46%	0.463	33%	0.326	S	S	.	.	H	α-helix	trans	-67.4	-42.3	176.8	-174.7	57.7	45	0	0	111.4	T81 L85 K86 D87	T81-Q83 PolarHBondContact O-N 3.2Å; T81-Q83 PolarHBondContact OG1-N 3.39Å; Q83-L85 VanDerWaalsContact C-N 3.29Å; Q83-L85 PolarHBondContact O-N 2.88Å; Q83-K86 WeakPolarHBondContact O-CB 3.39Å; Q83-K86 PolarHBondContact O-N 3.14Å; Q83-K86 VanDerWaalsContact O-N 3.14Å; Q83-D87 VanDerWaalsContact NE2-CG 3.32Å; Q83-D87 PolarHBondContact NE2-OD1 3.4Å; Q83-D87 PolarHBondContact NE2-OD2 3.49Å; Q83-D87 VanDerWaalsContact O-CG 3.31Å; Q83-D87 PolarHBondContact O-N 3.49Å
84	D	96.5	Very high	96.3	Very high	62 Å²	62	74.4 Å²	74.4	33%	0.332	36%	0.356	S	S	.	.	H	α-helix	trans	-61.8	-39.7	175.7	-58.3	-58.6	0	0	0	111.6	I80 T81 D87 R88 W135	I80-D84 HydrophobicContact CD1-CB 4.15Å; I80-D84 HydrophobicContact CG2-CB 4.44Å; T81-D84 WeakPolarHBondContact CB-OD2 3.42Å; T81-D84 PolarHBondContact N-OD2 2.88Å; T81-D84 PolarHBondContact O-N 3.32Å; T81-D84 VanDerWaalsContact OG1-CG 3.29Å; T81-D84 PolarHBondContact OG1-N 3.31Å; T81-D84 PolarHBondContact OG1-OD2 2.95Å; D84-D87 PolarHBondContact O-N 3.42Å; D84-R88 WeakPolarHBondContact O-CB 3.38Å; D84-R88 PolarHBondContact O-N 2.89Å; D84-W135 HydrophobicContact CB-CH2 4.13Å; D84-W135 HydrophobicContact CB-CZ2 4.12Å
85	L	97.4	Very high	96.3	Very high	0 Å²	0	70.7 Å²	70.7	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-61.8	-46.5	173.7	-73.6	172	0	0	0	111	L76 I80 T81 E82 Q83 D87 R88 F89 I98 L100 A113 W135	L76-L85 HydrophobicContact CD1-CD1 4.27Å; L76-L85 HydrophobicContact CD1-CD2 3.95Å; L76-L85 HydrophobicContact CD2-CD2 3.89Å; I80-L85 HydrophobicContact CG2-CD1 4.31Å; I80-L85 HydrophobicContact CG2-CD2 4.19Å; I80-L85 HydrophobicContact CG2-CG 3.8Å; T81-L85 PolarHBondContact O-N 2.84Å; E82-L85 WeakPolarHBondContact O-CB 3.3Å; E82-L85 PolarHBondContact O-N 3.35Å; Q83-L85 VanDerWaalsContact C-N 3.29Å; Q83-L85 PolarHBondContact O-N 2.88Å; L85-D87 PolarHBondContact O-N 3.33Å; L85-R88 PolarHBondContact O-N 2.83Å; L85-F89 HydrophobicContact CD2-CD2 4.19Å; L85-F89 HydrophobicContact CD2-CE2 3.9Å; L85-F89 WeakPolarHBondContact O-CB 3.33Å; L85-F89 WeakPolarHBondContact O-CD2 3.33Å; L85-F89 PolarHBondContact O-N 2.89Å; L85-I98 HydrophobicContact CB-CG2 4.29Å; L85-I98 HydrophobicContact CD1-CG2 4.07Å; L85-L100 HydrophobicContact CD1-CB 4.24Å; L85-L100 HydrophobicContact CD1-CD1 3.97Å; L85-A113 HydrophobicContact CD1-CB 3.58Å; L85-W135 HydrophobicContact CD2-CH2 4.23Å; L85-W135 HydrophobicContact CD2-CZ3 3.86Å
86	K	97.9	Very high	96.3	Very high	99 Å²	99	70.4 Å²	70.4	43%	0.43	34%	0.338	S	S	.	.	H	α-helix	trans	-58.3	-50.4	177.5	-170.9	175.8	179.3	178.4	0	111	E82 Q83 R88 F89 I90 I98	E82-K86 PolarHBondContact O-N 2.99Å; Q83-K86 WeakPolarHBondContact O-CB 3.39Å; Q83-K86 PolarHBondContact O-N 3.14Å; Q83-K86 VanDerWaalsContact O-N 3.14Å; K86-R88 VanDerWaalsContact C-N 3.26Å; K86-R88 PolarHBondContact O-N 3.46Å; K86-F89 PolarHBondContact O-N 2.98Å; K86-I90 WeakPolarHBondContact O-CB 3.31Å; K86-I90 WeakPolarHBondContact O-CG2 3.4Å; K86-I90 PolarHBondContact O-N 3.44Å; K86-I98 HydrophobicContact CB-CD1 3.64Å; K86-I98 HydrophobicContact CG-CD1 4.13Å
87	D	97.3	Very high	96.4	Very high	89 Å²	89	74.5 Å²	74.5	48%	0.476	36%	0.36	S	S	.	.	H	α-helix	trans	-63.4	-33.5	-178	-67.3	-22.1	0	0	0	112.1	Q83 D84 L85	Q83-D87 VanDerWaalsContact NE2-CG 3.32Å; Q83-D87 PolarHBondContact NE2-OD1 3.4Å; Q83-D87 PolarHBondContact NE2-OD2 3.49Å; Q83-D87 VanDerWaalsContact O-CG 3.31Å; Q83-D87 PolarHBondContact O-N 3.49Å; D84-D87 PolarHBondContact O-N 3.42Å; L85-D87 PolarHBondContact O-N 3.33Å
88	R	96.1	Very high	96.6	Very high	80 Å²	80	74 Å²	74	30%	0.302	36%	0.356	S	S	.	.	H	α-helix	trans	-77.9	-37	177.8	-177.4	57	-179.4	-144.3	-2.6	113.8	D84 L85 K86 Y92 W135	D84-R88 WeakPolarHBondContact O-CB 3.38Å; D84-R88 PolarHBondContact O-N 2.89Å; L85-R88 PolarHBondContact O-N 2.83Å; K86-R88 VanDerWaalsContact C-N 3.26Å; K86-R88 PolarHBondContact O-N 3.46Å; R88-Y92 WeakPolarHBondContact O-CE2 3.4Å; R88-W135 HydrophobicContact CB-CH2 3.82Å; R88-W135 HydrophobicContact CB-CZ2 3.97Å; R88-W135 HydrophobicContact CB-CZ3 4.48Å; R88-W135 HydrophobicContact CG-CH2 4.18Å; R88-W135 HydrophobicContact CG-CZ2 4.28Å; R88-W135 HydrophobicContact CG-CZ3 4.44Å
89	F	98	Very high	96.9	Very high	0 Å²	0	71.5 Å²	71.5	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-95.9	-17.3	-171.6	-80.6	-84.5	0	0	0	113.3	I71 V73 L85 K86 D91 Y92 I95 I115 Y117 A126 V130 V142	I71-F89 HydrophobicContact CD1-CD1 4.1Å; I71-F89 HydrophobicContact CD1-CE1 3.81Å; V73-F89 HydrophobicContact CG1-CZ 4.29Å; V73-F89 HydrophobicContact CG2-CE1 4.33Å; V73-F89 HydrophobicContact CG2-CE2 4.23Å; V73-F89 HydrophobicContact CG2-CZ 3.69Å; L85-F89 HydrophobicContact CD2-CD2 4.19Å; L85-F89 HydrophobicContact CD2-CE2 3.9Å; L85-F89 WeakPolarHBondContact O-CB 3.33Å; L85-F89 WeakPolarHBondContact O-CD2 3.33Å; L85-F89 PolarHBondContact O-N 2.89Å; K86-F89 PolarHBondContact O-N 2.98Å; F89-D91 PolarHBondContact O-N 2.8Å; F89-D91 VanDerWaalsContact O-N 3.16Å; F89-Y92 HydrophobicContact CD1-CD2 4.05Å; F89-Y92 HydrophobicContact CD1-CE2 4.22Å; F89-Y92 WeakPolarHBondContact O-CD2 3.43Å; F89-Y92 PolarHBondContact O-N 2.94Å; F89-Y92 VanDerWaalsContact O-N 3.14Å; F89-I95 HydrophobicContact CB-CD1 3.81Å; F89-I115 HydrophobicContact CB-CD1 3.96Å; F89-I115 HydrophobicContact CD1-CD1 3.84Å; F89-I115 HydrophobicContact CD2-CD1 3.35Å; F89-I115 HydrophobicContact CE1-CD1 4.11Å; F89-I115 HydrophobicContact CE2-CD1 3.67Å; F89-I115 HydrophobicContact CG-CD1 3.44Å; F89-I115 VanDerWaalsContact CG-CD1 3.44Å; F89-I115 HydrophobicContact CZ-CD1 4.02Å; F89-Y117 WeakPolarHBondContact CB-OH 3.5Å; F89-Y117 PolarHBondContact O-OH 2.99Å; F89-A126 HydrophobicContact CD1-CB 4.18Å; F89-A126 HydrophobicContact CE1-CB 4.43Å; F89-V130 HydrophobicContact CD1-CG2 4.44Å; F89-V130 HydrophobicContact CE1-CB 4.18Å; F89-V130 HydrophobicContact CE1-CG1 4.19Å; F89-V130 HydrophobicContact CE1-CG2 3.9Å; F89-V130 HydrophobicContact CZ-CB 4.35Å; F89-V130 HydrophobicContact CZ-CG1 3.86Å; F89-V130 HydrophobicContact CZ-CG2 4.32Å; F89-V142 HydrophobicContact CZ-CG2 4.44Å
90	I	97.7	Very high	97.2	Very high	87 Å²	87	65.2 Å²	65.2	45%	0.446	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-61.6	-25.9	-179.9	-165.5	164.8	0	0	0	113	K86 Y92 G93 I95	K86-I90 WeakPolarHBondContact O-CB 3.31Å; K86-I90 WeakPolarHBondContact O-CG2 3.4Å; K86-I90 PolarHBondContact O-N 3.44Å; I90-Y92 PolarHBondContact O-N 2.94Å; I90-G93 PolarHBondContact O-N 2.88Å; I90-I95 HydrophobicContact CB-CD1 4.36Å
91	D	97.1	Very high	97.3	Very high	132 Å²	132	67.4 Å²	67.4	71%	0.706	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-61.8	-22.2	177.9	-71.4	-16.3	0	0	0	113.5	F89	F89-D91 PolarHBondContact O-N 2.8Å; F89-D91 VanDerWaalsContact O-N 3.16Å
92	Y	97.9	Very high	97.4	Very high	48 Å²	48	68.2 Å²	68.2	19%	0.188	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-93.3	-15	-176.9	-52.6	-64	0	0	0	113.5	R88 F89 I90 E122 A126 A129 V130	R88-Y92 WeakPolarHBondContact O-CE2 3.4Å; F89-Y92 HydrophobicContact CD1-CD2 4.05Å; F89-Y92 HydrophobicContact CD1-CE2 4.22Å; F89-Y92 WeakPolarHBondContact O-CD2 3.43Å; F89-Y92 PolarHBondContact O-N 2.94Å; F89-Y92 VanDerWaalsContact O-N 3.14Å; I90-Y92 PolarHBondContact O-N 2.94Å; Y92-E122 WeakPolarHBondContact O-CA 3.47Å; Y92-E122 WeakPolarHBondContact O-CB 3.18Å; Y92-A126 HydrophobicContact CD2-CB 3.73Å; Y92-A126 HydrophobicContact CG-CB 3.79Å; Y92-A129 HydrophobicContact CD1-CB 4.1Å; Y92-A129 HydrophobicContact CE1-CB 3.34Å; Y92-V130 HydrophobicContact CD2-CG2 4.38Å; Y92-V130 HydrophobicContact CE2-CG2 3.39Å; Y92-V130 WeakPolarHBondContact OH-CG2 3.29Å
93	G	97.4	Very high	97.3	Very high	19 Å²	19	66.2 Å²	66.2	20%	0.196	32%	0.321	C	S	.	.	S	Bend	trans	155.9	-173.1	178.9	0	0	0	0	0	114.3	I90 I95	I90-G93 PolarHBondContact O-N 2.88Å; G93-I95 PolarHBondContact O-N 2.88Å
94	R	97.4	Very high	97.2	Very high	165 Å²	165	72.9 Å²	72.9	62%	0.623	34%	0.343	S	S	*	.			trans	-76.5	110.5	-178.1	-170.1	-179.6	-175.4	-136.5	2.6	111	E118 E122	R94-E118 WeakPolarHBondContact CD-OE2 3.26Å; R94-E118 IonicContact CZ-OE2 2.66Å; R94-E118 IonicContact NH1-OE2 2.78Å; R94-E118 PolarHBondContact NH1-OE2 2.91Å; R94-E118 PolarHBondContact O-N 3.01Å; R94-E122 PolarHBondContact N-OE1 2.92Å; R94-E122 VanDerWaalsContact N-OE1 3.17Å
95	I	97.8	Very high	97.1	Very high	33 Å²	33	78.6 Å²	78.6	17%	0.169	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	122.7	173.7	-57.6	172.1	0	0	0	109.6	F89 I90 G93 N97 I98 I115 Y117	F89-I95 HydrophobicContact CB-CD1 3.81Å; I90-I95 HydrophobicContact CB-CD1 4.36Å; G93-I95 PolarHBondContact O-N 2.88Å; I95-N97 WeakPolarHBondContact CG2-O 3.35Å; I95-I98 HydrophobicContact CD1-CD1 4.09Å; I95-I98 HydrophobicContact CG2-CD1 3.97Å; I95-I98 HydrophobicContact CG2-CG1 3.47Å; I95-I98 VanDerWaalsContact CG2-CG1 3.47Å; I95-I115 HydrophobicContact CD1-CG2 4.45Å; I95-I115 HydrophobicContact CG1-CG2 4.24Å; I95-I115 HydrophobicContact CG2-CG2 3.88Å; I95-Y117 HydrophobicContact CG1-CD1 4.41Å; I95-Y117 HydrophobicContact CG1-CE1 3.81Å
96	K	97.7	Very high	96.9	Very high	73 Å²	73	82.2 Å²	82.2	32%	0.317	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	-40.9	175.3	-65.1	-171.9	63.6	166.4	0	112.1	D67 E116 E118	D67-K96 WeakPolarHBondContact O-CD 3.12Å; D67-K96 WeakPolarHBondContact O-CE 3.2Å; D67-K96 PolarHBondContact O-NZ 3.32Å; D67-K96 IonicContact OD1-NZ 2.88Å; D67-K96 PolarHBondContact OD1-NZ 2.84Å; D67-K96 IonicContact OD2-NZ 3.87Å; D67-K96 PolarHBondContact OD2-NZ 2.89Å; K96-E116 HydrophobicContact CB-CB 4.27Å; K96-E116 HydrophobicContact CB-CG 4.21Å; K96-E116 PolarHBondContact N-O 2.98Å; K96-E118 HydrophobicContact CD-CB 4Å; K96-E118 HydrophobicContact CD-CG 4.33Å; K96-E118 HydrophobicContact CG-CB 4.23Å
97	N	97.8	Very high	96.7	Very high	95 Å²	95	79.9 Å²	79.9	51%	0.508	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	148.8	-177.5	-157.5	-0.8	0	0	0	110.9	I95 E116	I95-N97 WeakPolarHBondContact CG2-O 3.35Å; N97-E116 HydrophobicContact CB-CB 4.04Å; N97-E116 PolarHBondContact O-N 2.84Å
98	I	98.1	Very high	96.4	Very high	12 Å²	12	82.7 Å²	82.7	6%	0.062	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	131.1	171.6	-55.5	179.5	0	0	0	106.8	E82 L85 K86 I95 I115	E82-I98 HydrophobicContact CG-CB 3.93Å; E82-I98 HydrophobicContact CG-CG2 3.68Å; L85-I98 HydrophobicContact CB-CG2 4.29Å; L85-I98 HydrophobicContact CD1-CG2 4.07Å; K86-I98 HydrophobicContact CB-CD1 3.64Å; K86-I98 HydrophobicContact CG-CD1 4.13Å; I95-I98 HydrophobicContact CD1-CD1 4.09Å; I95-I98 HydrophobicContact CG2-CD1 3.97Å; I95-I98 HydrophobicContact CG2-CG1 3.47Å; I95-I98 VanDerWaalsContact CG2-CG1 3.47Å; I98-I115 HydrophobicContact CG1-CG1 4.5Å; I98-I115 HydrophobicContact CG1-CG2 4.48Å; I98-I115 HydrophobicContact CG2-CG1 4.29Å
99	N	97.7	Very high	96.3	Very high	84 Å²	84	79.9 Å²	79.9	45%	0.449	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	100.7	172.2	-172.2	-37.7	0	0	0	108.3	A113 I114	N99-A113 CarbonylContact O-C 3.53Å; N99-A113 WeakPolarHBondContact O-CA 3.48Å; N99-A113 WeakPolarHBondContact O-CB 3.2Å; N99-I114 PolarHBondContact N-O 3Å; N99-I114 PolarHBondContact O-N 2.86Å
100	L	97.8	Very high	96.2	Very high	18 Å²	18	85.7 Å²	85.7	9%	0.094	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	116.8	169.1	178.3	60.1	0	0	0	108.5	L76 I80 L85 I102 P109 A113	L76-L100 HydrophobicContact CD1-CD1 4.27Å; I80-L100 WeakPolarHBondContact O-CD2 3.21Å; L85-L100 HydrophobicContact CD1-CB 4.24Å; L85-L100 HydrophobicContact CD1-CD1 3.97Å; L100-I102 PolarHBondContact O-N 3.26Å; L100-P109 HydrophobicContact CD1-CB 4.28Å; L100-P109 HydrophobicContact CD2-CB 4.31Å; L100-P109 HydrophobicContact CD2-CG 4.18Å; L100-P109 HydrophobicContact CG-CB 4.41Å; L100-A113 HydrophobicContact CD1-CB 4.14Å
101	H	97.7	Very high	96.1	Very high	48 Å²	48	82 Å²	82	22%	0.222	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	125	179.1	-58.6	115.2	0	0	0	109.9	M110 T112	H101-M110 HydrophobicContact CB-CB 4.29Å; H101-M110 HydrophobicContact CB-CE 4.25Å; H101-M110 PolarHBondContact O-N 3.43Å; H101-T112 WeakPolarHBondContact CB-O 3.12Å; H101-T112 PolarHBondContact N-O 2.91Å; H101-T112 PolarHBondContact ND1-O 3.22Å; H101-T112 PolarHBondContact ND1-OG1 3.22Å
102	I	95.9	Very high	96.1	Very high	86 Å²	86	77 Å²	77	44%	0.441	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	136.4	179.5	-62.9	170.9	0	0	0	109	L100 R104 G107	L100-I102 PolarHBondContact O-N 3.26Å; I102-R104 PolarHBondContact O-N 3.25Å; I102-G107 WeakPolarHBondContact CG2-O 3.33Å
103	N	94.6	Very high	96.2	Very high	61 Å²	61	74.7 Å²	74.7	33%	0.326	37%	0.37	S	S	.	.			trans	-68.1	114.1	169.4	-177.6	-28.9	0	0	0	109.4	M105 T106 G107 Y108	N103-M105 PolarHBondContact O-N 3.31Å; N103-M105 PolarHBondContact OD1-N 3Å; N103-T106 WeakPolarHBondContact CB-OG1 3.35Å; N103-T106 PolarHBondContact O-N 2.92Å; N103-T106 PolarHBondContact OD1-N 2.92Å; N103-G107 WeakPolarHBondContact O-CA 3.33Å; N103-G107 PolarHBondContact O-N 3.43Å; N103-Y108 PolarHBondContact N-O 2.87Å
104	R	94.6	Very high	96.2	Very high	240 Å²	240	75.8 Å²	75.8	91%	0.906	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-19.3	-174.4	-57.6	-69.8	-82.1	-164.1	-5.7	114	I102	I102-R104 PolarHBondContact O-N 3.25Å
105	M	95.1	Very high	96.3	Very high	181 Å²	181	67.9 Å²	67.9	89%	0.892	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-40.4	178.1	-66.5	-178.9	65.9	0	0	112.3	N103	N103-M105 PolarHBondContact O-N 3.31Å; N103-M105 PolarHBondContact OD1-N 3Å
106	T	93.8	Very high	96.3	Very high	77 Å²	77	67.7 Å²	67.7	47%	0.472	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-22.3	-174.9	66.2	0	0	0	0	113.3	N103 Y108	N103-T106 WeakPolarHBondContact CB-OG1 3.35Å; N103-T106 PolarHBondContact O-N 2.92Å; N103-T106 PolarHBondContact OD1-N 2.92Å; T106-Y108 PolarHBondContact O-N 3.49Å; T106-Y108 PolarHBondContact OG1-N 3.33Å
107	G	92.1	Very high	96.3	Very high	50 Å²	50	64.2 Å²	64.2	52%	0.515	32%	0.324	S	S	.	.			trans	79.3	-0.6	-173.6	0	0	0	0	0	114.3	I102 N103	I102-G107 WeakPolarHBondContact CG2-O 3.33Å; N103-G107 WeakPolarHBondContact O-CA 3.33Å; N103-G107 PolarHBondContact O-N 3.43Å
108	Y	92.5	Very high	96.3	Very high	148 Å²	148	63.5 Å²	63.5	58%	0.58	32%	0.318	S	S	*	.	S	Bend	trans	-90	148.9	-179.2	-63.1	-65.8	0	0	0	112.6	N103 T106	N103-Y108 PolarHBondContact N-O 2.87Å; T106-Y108 PolarHBondContact O-N 3.49Å; T106-Y108 PolarHBondContact OG1-N 3.33Å
109	P	94.2	Very high	96.3	Very high	21 Å²	21	68.4 Å²	68.4	14%	0.136	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-54.9	138.6	171.9	-25.3	35.2	0	0	0	112.4	E78 I80 L100 G111	E78-P109 VanDerWaalsContact O-CD 3.25Å; E78-P109 WeakPolarHBondContact O-CD 3.47Å; E78-P109 VanDerWaalsContact O-CG 3.3Å; E78-P109 WeakPolarHBondContact O-CG 3.48Å; I80-P109 WeakPolarHBondContact O-CG 3.38Å; L100-P109 HydrophobicContact CD1-CB 4.28Å; L100-P109 HydrophobicContact CD2-CB 4.31Å; L100-P109 HydrophobicContact CD2-CG 4.18Å; L100-P109 HydrophobicContact CG-CB 4.41Å; P109-G111 PolarHBondContact O-N 2.92Å
110	M	95.1	Very high	96.3	Very high	122 Å²	122	68.8 Å²	68.8	60%	0.601	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.6	8.1	179.8	-158.1	161.7	76.1	0	0	112.6	H101 T112	H101-M110 HydrophobicContact CB-CB 4.29Å; H101-M110 HydrophobicContact CB-CE 4.25Å; H101-M110 PolarHBondContact O-N 3.43Å; M110-T112 VanDerWaalsContact C-N 3.32Å; M110-T112 PolarHBondContact O-N 3.29Å
111	G	95.8	Very high	96.3	Very high	10 Å²	10	74.5 Å²	74.5	10%	0.103	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	75.3	13.5	-179.6	0	0	0	0	0	115.2	N75 L76 P109	N75-G111 PolarHBondContact N-O 2.96Å; N75-G111 VanDerWaalsContact N-O 3.07Å; L76-G111 PolarHBondContact N-O 3.47Å; L76-G111 VanDerWaalsContact O-CA 3.31Å; L76-G111 WeakPolarHBondContact O-CA 3.17Å; P109-G111 PolarHBondContact O-N 2.92Å
112	T	97.9	Very high	96.4	Very high	26 Å²	26	73.6 Å²	73.6	16%	0.16	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	147.9	177.9	63.1	0	0	0	0	111.7	F72 V73 R74 H101 M110	F72-T112 HydrophobicContact CZ-CG2 4.06Å; V73-T112 CarbonylContact O-C 3.56Å; V73-T112 VanDerWaalsContact O-CA 3.26Å; V73-T112 WeakPolarHBondContact O-CA 3.44Å; R74-T112 HydrophobicContact CB-CG2 4.43Å; R74-T112 HydrophobicContact CG-CG2 4.1Å; H101-T112 WeakPolarHBondContact CB-O 3.12Å; H101-T112 PolarHBondContact N-O 2.91Å; H101-T112 PolarHBondContact ND1-O 3.22Å; H101-T112 PolarHBondContact ND1-OG1 3.22Å; M110-T112 VanDerWaalsContact C-N 3.32Å; M110-T112 PolarHBondContact O-N 3.29Å
113	A	98.3	Very high	96.5	Very high	0 Å²	0	69.5 Å²	69.5	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	156.1	176.4	0	0	0	0	0	111.7	F72 V73 L76 L85 N99 L100	F72-A113 WeakPolarHBondContact CD2-O 3.32Å; V73-A113 PolarHBondContact N-O 2.62Å; V73-A113 PolarHBondContact O-N 3.26Å; L76-A113 HydrophobicContact CD1-CB 3.73Å; L85-A113 HydrophobicContact CD1-CB 3.58Å; N99-A113 CarbonylContact O-C 3.53Å; N99-A113 WeakPolarHBondContact O-CA 3.48Å; N99-A113 WeakPolarHBondContact O-CB 3.2Å; L100-A113 HydrophobicContact CD1-CB 4.14Å
114	I	98.4	Very high	96.7	Very high	41 Å²	41	68.2 Å²	68.2	21%	0.21	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	134.3	169.5	-66.3	164.1	0	0	0	108	L70 I71 F72 N99	L70-I114 HydrophobicContact CB-CG2 4.29Å; L70-I114 HydrophobicContact CD2-CG2 3.56Å; L70-I114 HydrophobicContact CG-CG2 4.38Å; I71-I114 WeakPolarHBondContact O-CA 3Å; F72-I114 HydrophobicContact CD2-CD1 4.5Å; F72-I114 HydrophobicContact CD2-CG1 3.69Å; F72-I114 HydrophobicContact CE2-CG1 4.23Å; N99-I114 PolarHBondContact N-O 3Å; N99-I114 PolarHBondContact O-N 2.86Å
115	I	98.5	Very high	96.8	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	131.4	177.5	-57.9	174.1	0	0	0	108.4	L70 I71 V73 F89 I95 I98 Y117	L70-I115 WeakPolarHBondContact CA-O 3.35Å; I71-I115 HydrophobicContact CD1-CB 4.18Å; I71-I115 HydrophobicContact CD1-CD1 4.46Å; I71-I115 HydrophobicContact CG1-CB 3.75Å; I71-I115 HydrophobicContact CG1-CG2 4.49Å; I71-I115 PolarHBondContact N-O 3.33Å; I71-I115 PolarHBondContact O-N 3.17Å; V73-I115 HydrophobicContact CG2-CD1 4.07Å; F89-I115 HydrophobicContact CB-CD1 3.96Å; F89-I115 HydrophobicContact CD1-CD1 3.84Å; F89-I115 HydrophobicContact CD2-CD1 3.35Å; F89-I115 HydrophobicContact CE1-CD1 4.11Å; F89-I115 HydrophobicContact CE2-CD1 3.67Å; F89-I115 HydrophobicContact CG-CD1 3.44Å; F89-I115 VanDerWaalsContact CG-CD1 3.44Å; F89-I115 HydrophobicContact CZ-CD1 4.02Å; I95-I115 HydrophobicContact CD1-CG2 4.45Å; I95-I115 HydrophobicContact CG1-CG2 4.24Å; I95-I115 HydrophobicContact CG2-CG2 3.88Å; I98-I115 HydrophobicContact CG1-CG1 4.5Å; I98-I115 HydrophobicContact CG1-CG2 4.48Å; I98-I115 HydrophobicContact CG2-CG1 4.29Å; I115-Y117 HydrophobicContact CG2-CD2 4.24Å; I115-Y117 HydrophobicContact CG2-CE2 3.79Å
116	E	98.5	Very high	97	Very high	29 Å²	29	51.2 Å²	51.2	14%	0.136	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	122.1	176.8	-166.8	163.8	-146.1	0	0	110.9	S65 L70 K96 N97	S65-E116 PolarHBondContact OG-OE1 2.91Å; L70-E116 HydrophobicContact CD2-CB 3.47Å; L70-E116 VanDerWaalsContact CD2-CB 3.47Å; L70-E116 HydrophobicContact CD2-CG 3.71Å; L70-E116 HydrophobicContact CG-CG 4.33Å; K96-E116 HydrophobicContact CB-CB 4.27Å; K96-E116 HydrophobicContact CB-CG 4.21Å; K96-E116 PolarHBondContact N-O 2.98Å; N97-E116 HydrophobicContact CB-CB 4.04Å; N97-E116 PolarHBondContact O-N 2.84Å
117	Y	98.7	Very high	97.2	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	154.9	169.5	-73.2	-81.9	0	0	0	111.3	G68 W69 I71 F89 I95 I115 E122 A123 A126	G68-Y117 CarbonylContact C-O 3.51Å; G68-Y117 VanDerWaalsContact CA-O 3.27Å; G68-Y117 WeakPolarHBondContact CA-O 3.27Å; W69-Y117 PolarHBondContact N-O 3.2Å; W69-Y117 PolarHBondContact O-N 3.04Å; I71-Y117 HydrophobicContact CD1-CD2 4.47Å; I71-Y117 HydrophobicContact CD1-CE2 3.75Å; I71-Y117 HydrophobicContact CG1-CE2 4.2Å; F89-Y117 WeakPolarHBondContact CB-OH 3.5Å; F89-Y117 PolarHBondContact O-OH 2.99Å; I95-Y117 HydrophobicContact CG1-CD1 4.41Å; I95-Y117 HydrophobicContact CG1-CE1 3.81Å; I115-Y117 HydrophobicContact CG2-CD2 4.24Å; I115-Y117 HydrophobicContact CG2-CE2 3.79Å; Y117-E122 HydrophobicContact CD1-CB 3.63Å; Y117-E122 HydrophobicContact CE1-CB 4.28Å; Y117-E122 HydrophobicContact CG-CB 3.97Å; Y117-A123 HydrophobicContact CD2-CB 3.89Å; Y117-A123 HydrophobicContact CG-CB 4.32Å; Y117-A126 HydrophobicContact CE2-CB 3.88Å
118	E	97.3	Very high	97.5	Very high	79 Å²	79	50.7 Å²	50.7	37%	0.369	25%	0.252	S	S	.	.	S	Bend	trans	-70.9	-41	174.9	-167.3	177.7	139.9	0	0	111.4	R94 K96	R94-E118 WeakPolarHBondContact CD-OE2 3.26Å; R94-E118 IonicContact CZ-OE2 2.66Å; R94-E118 IonicContact NH1-OE2 2.78Å; R94-E118 PolarHBondContact NH1-OE2 2.91Å; R94-E118 PolarHBondContact O-N 3.01Å; K96-E118 HydrophobicContact CD-CB 4Å; K96-E118 HydrophobicContact CD-CG 4.33Å; K96-E118 HydrophobicContact CG-CB 4.23Å
119	K	98.1	Very high	97.7	Very high	116 Å²	116	44.9 Å²	44.9	50%	0.504	23%	0.234	S	C	.	.	S	Bend	trans	-117.1	146.5	-172.5	-60	170.8	-175.5	166.6	0	112.6	W69 K121 E122 A123	W69-K119 VanDerWaalsContact CD1-C 3.49Å; K119-K121 VanDerWaalsContact C-N 3.25Å; K119-K121 PolarHBondContact O-N 2.8Å; K119-E122 HydrophobicContact CB-CG 4.02Å; K119-E122 WeakPolarHBondContact CB-OE2 3.43Å; K119-E122 PolarHBondContact N-OE2 3.2Å; K119-E122 PolarHBondContact O-N 2.81Å; K119-A123 PolarHBondContact O-N 2.84Å
120	F	97.8	Very high	97.9	Very high	91 Å²	91	43.9 Å²	43.9	40%	0.399	23%	0.228	S	C	.	.	H	α-helix	trans	-52.9	-44.6	175.1	175.5	-101.8	0	0	0	112.3	P62 W69 E122 A123 S124 W144	P62-F120 HydrophobicContact CB-CE2 4.01Å; P62-F120 HydrophobicContact CG-CE2 4.2Å; W69-F120 HydrophobicContact CD2-CB 4.01Å; W69-F120 AromaticContact CD2-CD2 3.85Å; W69-F120 HydrophobicContact CD2-CD2 3.85Å; W69-F120 HydrophobicContact CD2-CG 4.45Å; W69-F120 AromaticContact CE2-CD2 3.93Å; W69-F120 AromaticContact CE3-CD2 3.63Å; W69-F120 HydrophobicContact CE3-CD2 3.63Å; W69-F120 HydrophobicContact CE3-CE2 4.35Å; W69-F120 HydrophobicContact CG-CB 4.36Å; W69-F120 HydrophobicContact CH2-CB 4.43Å; W69-F120 AromaticContact CH2-CD2 3.53Å; W69-F120 HydrophobicContact CH2-CD2 3.53Å; W69-F120 HydrophobicContact CH2-CE2 4.21Å; W69-F120 HydrophobicContact CH2-CG 4.31Å; W69-F120 HydrophobicContact CZ2-CB 3.8Å; W69-F120 AromaticContact CZ2-CD2 3.79Å; W69-F120 HydrophobicContact CZ2-CD2 3.79Å; W69-F120 HydrophobicContact CZ2-CG 4.16Å; W69-F120 AromaticContact CZ3-CD2 3.47Å; W69-F120 HydrophobicContact CZ3-CD2 3.47Å; W69-F120 VanDerWaalsContact CZ3-CD2 3.47Å; W69-F120 AromaticContact CZ3-CE2 3.97Å; W69-F120 HydrophobicContact CZ3-CE2 3.97Å; F120-E122 VanDerWaalsContact C-N 3.34Å; F120-E122 PolarHBondContact O-N 3.47Å; F120-A123 PolarHBondContact O-N 3.31Å; F120-S124 WeakPolarHBondContact O-CB 3.36Å; F120-S124 PolarHBondContact O-N 3.46Å; F120-W144 AromaticContact CD2-CH2 3.52Å; F120-W144 HydrophobicContact CD2-CH2 3.52Å; F120-W144 HydrophobicContact CD2-CZ2 4.1Å; F120-W144 HydrophobicContact CD2-CZ3 4.18Å; F120-W144 AromaticContact CE2-CH2 3.35Å; F120-W144 HydrophobicContact CE2-CH2 3.35Å; F120-W144 AromaticContact CE2-CZ2 3.43Å; F120-W144 HydrophobicContact CE2-CZ2 3.43Å; F120-W144 VanDerWaalsContact CE2-CZ2 3.43Å; F120-W144 HydrophobicContact CE2-CZ3 4.21Å; F120-W144 HydrophobicContact CG-CH2 4.43Å; F120-W144 HydrophobicContact CZ-CH2 4.13Å; F120-W144 AromaticContact CZ-CZ2 3.89Å; F120-W144 HydrophobicContact CZ-CZ2 3.89Å
121	K	98.1	Very high	98	Very high	139 Å²	139	42.1 Å²	42.1	60%	0.604	22%	0.221	S	C	*	.	H	α-helix	trans	-61.5	-42.1	-177.6	-173	179.8	-179	-62.3	0	111.8	K119 S124 D125	K119-K121 VanDerWaalsContact C-N 3.25Å; K119-K121 PolarHBondContact O-N 2.8Å; K121-S124 PolarHBondContact O-N 3.42Å; K121-D125 IonicContact NZ-OD1 3.98Å; K121-D125 IonicContact NZ-OD2 2.69Å; K121-D125 PolarHBondContact NZ-OD2 3.43Å; K121-D125 VanDerWaalsContact O-CB 3.3Å; K121-D125 WeakPolarHBondContact O-CB 3.39Å; K121-D125 PolarHBondContact O-N 2.82Å
122	E	98.4	Very high	98.1	Very high	29 Å²	29	43.2 Å²	43.2	14%	0.136	23%	0.232	C	C	.	.	H	α-helix	trans	-63.8	-46.6	179.7	-60.2	170.1	145	0	0	110.9	Y92 R94 Y117 K119 F120 D125 A126	Y92-E122 WeakPolarHBondContact O-CA 3.47Å; Y92-E122 WeakPolarHBondContact O-CB 3.18Å; R94-E122 PolarHBondContact N-OE1 2.92Å; R94-E122 VanDerWaalsContact N-OE1 3.17Å; Y117-E122 HydrophobicContact CD1-CB 3.63Å; Y117-E122 HydrophobicContact CE1-CB 4.28Å; Y117-E122 HydrophobicContact CG-CB 3.97Å; K119-E122 HydrophobicContact CB-CG 4.02Å; K119-E122 WeakPolarHBondContact CB-OE2 3.43Å; K119-E122 PolarHBondContact N-OE2 3.2Å; K119-E122 PolarHBondContact O-N 2.81Å; F120-E122 VanDerWaalsContact C-N 3.34Å; F120-E122 PolarHBondContact O-N 3.47Å; E122-D125 PolarHBondContact O-N 3.37Å; E122-A126 WeakPolarHBondContact O-CB 3.42Å; E122-A126 PolarHBondContact O-N 2.96Å
123	A	98.4	Very high	98	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-62.5	-43.4	175.1	0	0	0	0	0	112.6	W69 I71 Y117 K119 F120 A126 I127 W144	W69-A123 HydrophobicContact CB-CB 3.78Å; I71-A123 HydrophobicContact CG2-CB 3.67Å; Y117-A123 HydrophobicContact CD2-CB 3.89Å; Y117-A123 HydrophobicContact CG-CB 4.32Å; K119-A123 PolarHBondContact O-N 2.84Å; F120-A123 PolarHBondContact O-N 3.31Å; A123-A126 PolarHBondContact O-N 2.72Å; A123-I127 WeakPolarHBondContact O-CG1 3.3Å; A123-I127 PolarHBondContact O-N 3.02Å; A123-W144 HydrophobicContact CB-CH2 3.7Å; A123-W144 HydrophobicContact CB-CZ3 3.5Å
124	S	98.3	Very high	97.9	Very high	33 Å²	33	51.3 Å²	51.3	23%	0.231	27%	0.274	C	S	.	.	H	α-helix	trans	-64.8	-44.8	178.4	-172.5	0	0	0	0	111.8	F120 K121 A126 I127 S128	F120-S124 WeakPolarHBondContact O-CB 3.36Å; F120-S124 PolarHBondContact O-N 3.46Å; K121-S124 PolarHBondContact O-N 3.42Å; S124-A126 VanDerWaalsContact C-N 3.32Å; S124-A126 PolarHBondContact O-N 2.98Å; S124-I127 PolarHBondContact O-N 3.36Å; S124-S128 PolarHBondContact O-N 3.07Å; S124-S128 PolarHBondContact O-OG 3.24Å
125	D	98.4	Very high	97.7	Very high	64 Å²	64	51.6 Å²	51.6	34%	0.342	27%	0.272	S	S	.	.	H	α-helix	trans	-62.2	-42.7	178.3	-71.1	-15	0	0	0	110.1	K121 E122 S128 A129	K121-D125 IonicContact NZ-OD1 3.98Å; K121-D125 IonicContact NZ-OD2 2.69Å; K121-D125 PolarHBondContact NZ-OD2 3.43Å; K121-D125 VanDerWaalsContact O-CB 3.3Å; K121-D125 WeakPolarHBondContact O-CB 3.39Å; K121-D125 PolarHBondContact O-N 2.82Å; E122-D125 PolarHBondContact O-N 3.37Å; D125-S128 PolarHBondContact O-N 3.15Å; D125-A129 WeakPolarHBondContact O-CB 3.37Å; D125-A129 PolarHBondContact O-N 2.87Å
126	A	98.4	Very high	97.4	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-60.6	-46.1	174.4	0	0	0	0	0	112.6	I71 F89 Y92 Y117 E122 A123 S124 A129 V130	I71-A126 HydrophobicContact CD1-CB 4.09Å; F89-A126 HydrophobicContact CD1-CB 4.18Å; F89-A126 HydrophobicContact CE1-CB 4.43Å; Y92-A126 HydrophobicContact CD2-CB 3.73Å; Y92-A126 HydrophobicContact CG-CB 3.79Å; Y117-A126 HydrophobicContact CE2-CB 3.88Å; E122-A126 WeakPolarHBondContact O-CB 3.42Å; E122-A126 PolarHBondContact O-N 2.96Å; A123-A126 PolarHBondContact O-N 2.72Å; S124-A126 VanDerWaalsContact C-N 3.32Å; S124-A126 PolarHBondContact O-N 2.98Å; A126-A129 PolarHBondContact O-N 2.82Å; A126-V130 WeakPolarHBondContact O-CB 3.26Å; A126-V130 WeakPolarHBondContact O-CG2 3.1Å; A126-V130 PolarHBondContact O-N 3.13Å
127	I	98.4	Very high	97	Very high	19 Å²	19	61 Å²	61	10%	0.097	32%	0.323	C	S	.	.	H	α-helix	trans	-59.4	-53.5	176.3	-71.2	161	0	0	0	110.1	I71 A123 S124 A129 V130 N131 V142 W144	I71-I127 HydrophobicContact CB-CD1 4.42Å; I71-I127 HydrophobicContact CB-CG1 4.29Å; I71-I127 HydrophobicContact CG2-CD1 3.66Å; I71-I127 HydrophobicContact CG2-CG1 3.82Å; A123-I127 WeakPolarHBondContact O-CG1 3.3Å; A123-I127 PolarHBondContact O-N 3.02Å; S124-I127 PolarHBondContact O-N 3.36Å; I127-A129 VanDerWaalsContact C-N 3.27Å; I127-A129 PolarHBondContact O-N 2.72Å; I127-V130 PolarHBondContact O-N 3.21Å; I127-N131 WeakPolarHBondContact O-CB 3.42Å; I127-N131 PolarHBondContact O-N 2.94Å; I127-V142 HydrophobicContact CB-CG1 4.46Å; I127-V142 HydrophobicContact CG1-CG1 3.88Å; I127-W144 HydrophobicContact CD1-CD2 3.41Å; I127-W144 VanDerWaalsContact CD1-CD2 3.41Å; I127-W144 HydrophobicContact CD1-CE3 3.82Å; I127-W144 HydrophobicContact CD1-CG 3.83Å; I127-W144 HydrophobicContact CD1-CH2 4.13Å; I127-W144 HydrophobicContact CD1-CZ2 3.75Å; I127-W144 HydrophobicContact CD1-CZ3 4.16Å
128	S	97.9	Very high	96.8	Very high	97 Å²	97	62.3 Å²	62.3	68%	0.678	33%	0.332	S	S	*	.	H	α-helix	trans	-63.1	-34.4	-177.8	-65.7	0	0	0	0	112.8	S124 D125	S124-S128 PolarHBondContact O-N 3.07Å; S124-S128 PolarHBondContact O-OG 3.24Å; D125-S128 PolarHBondContact O-N 3.15Å
129	A	97.6	Very high	96.7	Very high	26 Å²	26	64.8 Å²	64.8	22%	0.215	34%	0.342	C	S	.	.	H	α-helix	trans	-81.7	-34.1	-178	0	0	0	0	0	113.4	Y92 D125 A126 I127 K133	Y92-A129 HydrophobicContact CD1-CB 4.1Å; Y92-A129 HydrophobicContact CE1-CB 3.34Å; D125-A129 WeakPolarHBondContact O-CB 3.37Å; D125-A129 PolarHBondContact O-N 2.87Å; A126-A129 PolarHBondContact O-N 2.82Å; I127-A129 VanDerWaalsContact C-N 3.27Å; I127-A129 PolarHBondContact O-N 2.72Å; A129-K133 WeakPolarHBondContact O-CD 3.38Å; A129-K133 WeakPolarHBondContact O-CE 3.43Å; A129-K133 PolarHBondContact O-NZ 2.8Å
130	V	97.6	Very high	96.7	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-103.4	-29.6	-170.9	-175.9	0	0	0	0	112.6	F89 Y92 A126 I127 G132 K133 L140 V142	F89-V130 HydrophobicContact CD1-CG2 4.44Å; F89-V130 HydrophobicContact CE1-CB 4.18Å; F89-V130 HydrophobicContact CE1-CG1 4.19Å; F89-V130 HydrophobicContact CE1-CG2 3.9Å; F89-V130 HydrophobicContact CZ-CB 4.35Å; F89-V130 HydrophobicContact CZ-CG1 3.86Å; F89-V130 HydrophobicContact CZ-CG2 4.32Å; Y92-V130 HydrophobicContact CD2-CG2 4.38Å; Y92-V130 HydrophobicContact CE2-CG2 3.39Å; Y92-V130 WeakPolarHBondContact OH-CG2 3.29Å; A126-V130 WeakPolarHBondContact O-CB 3.26Å; A126-V130 WeakPolarHBondContact O-CG2 3.1Å; A126-V130 PolarHBondContact O-N 3.13Å; I127-V130 PolarHBondContact O-N 3.21Å; V130-G132 PolarHBondContact O-N 2.84Å; V130-K133 WeakPolarHBondContact O-CB 3.48Å; V130-K133 PolarHBondContact O-N 3.37Å; V130-L140 HydrophobicContact CG1-CB 4.39Å; V130-L140 HydrophobicContact CG1-CD1 3.52Å; V130-V142 HydrophobicContact CB-CG2 3.98Å; V130-V142 HydrophobicContact CG1-CG2 3.74Å
131	N	97.8	Very high	96.7	Very high	86 Å²	86	59.3 Å²	59.3	46%	0.46	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	126.7	-178	-173.1	37.5	0	0	0	111.6	I127 K133 V142	I127-N131 WeakPolarHBondContact O-CB 3.42Å; I127-N131 PolarHBondContact O-N 2.94Å; N131-K133 VanDerWaalsContact C-N 3.29Å; N131-K133 PolarHBondContact O-N 3.22Å; N131-V142 HydrophobicContact CB-CB 4.08Å; N131-V142 VanDerWaalsContact CG-O 3.27Å; N131-V142 PolarHBondContact OD1-N 2.73Å; N131-V142 PolarHBondContact OD1-O 2.81Å
132	G	96.5	Very high	96.7	Very high	33 Å²	33	53 Å²	53	34%	0.34	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.4	0.3	-179.4	0	0	0	0	0	115.4	V130 K139 L140	V130-G132 PolarHBondContact O-N 2.84Å; G132-K139 VanDerWaalsContact O-CE 3.27Å; G132-K139 WeakPolarHBondContact O-CE 3.05Å; G132-L140 WeakPolarHBondContact CA-O 3.39Å; G132-L140 PolarHBondContact N-O 2.76Å
133	K	96.8	Very high	96.7	Very high	96 Å²	96	52.9 Å²	52.9	42%	0.417	30%	0.299	S	S	.	.			trans	-79.8	146	173.1	-71	-169.1	174.2	158.4	0	111.4	A129 V130 N131 L140	A129-K133 WeakPolarHBondContact O-CD 3.38Å; A129-K133 WeakPolarHBondContact O-CE 3.43Å; A129-K133 PolarHBondContact O-NZ 2.8Å; V130-K133 WeakPolarHBondContact O-CB 3.48Å; V130-K133 PolarHBondContact O-N 3.37Å; N131-K133 VanDerWaalsContact C-N 3.29Å; N131-K133 PolarHBondContact O-N 3.22Å; K133-L140 PolarHBondContact O-N 2.84Å
134	T	95.8	Very high	96.7	Very high	99 Å²	99	55.1 Å²	55.1	61%	0.607	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.3	133.4	173	-52.4	0	0	0	0	110.6	S138	T134-S138 CarbonylContact C-O 3.51Å; T134-S138 VanDerWaalsContact CA-O 3.31Å; T134-S138 WeakPolarHBondContact CA-O 2.84Å
135	W	94.2	Very high	96.6	Very high	47 Å²	47	55.4 Å²	55.4	18%	0.178	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	126.4	174.6	-171.6	28	0	0	0	109.5	L76 I80 D84 L85 R88 N137 S138 L140	L76-W135 HydrophobicContact CD2-CE3 3.98Å; L76-W135 HydrophobicContact CD2-CZ3 3.82Å; I80-W135 HydrophobicContact CD1-CD2 4.14Å; I80-W135 HydrophobicContact CD1-CE3 4.08Å; I80-W135 HydrophobicContact CD1-CH2 3.58Å; I80-W135 HydrophobicContact CD1-CZ2 3.57Å; I80-W135 HydrophobicContact CD1-CZ3 3.83Å; I80-W135 HydrophobicContact CG1-CZ3 4.43Å; I80-W135 HydrophobicContact CG2-CH2 4.47Å; D84-W135 HydrophobicContact CB-CH2 4.13Å; D84-W135 HydrophobicContact CB-CZ2 4.12Å; L85-W135 HydrophobicContact CD2-CH2 4.23Å; L85-W135 HydrophobicContact CD2-CZ3 3.86Å; R88-W135 HydrophobicContact CB-CH2 3.82Å; R88-W135 HydrophobicContact CB-CZ2 3.97Å; R88-W135 HydrophobicContact CB-CZ3 4.48Å; R88-W135 HydrophobicContact CG-CH2 4.18Å; R88-W135 HydrophobicContact CG-CZ2 4.28Å; R88-W135 HydrophobicContact CG-CZ3 4.44Å; W135-N137 VanDerWaalsContact C-N 3.33Å; W135-N137 PolarHBondContact O-N 2.99Å; W135-S138 PolarHBondContact N-O 3.36Å; W135-S138 PolarHBondContact O-N 3.33Å; W135-S138 VanDerWaalsContact O-O 3.09Å; W135-L140 HydrophobicContact CB-CD1 3.79Å; W135-L140 HydrophobicContact CB-CD2 4.29Å; W135-L140 HydrophobicContact CB-CG 4.01Å; W135-L140 HydrophobicContact CD2-CD1 4.32Å; W135-L140 HydrophobicContact CE3-CD1 3.69Å; W135-L140 HydrophobicContact CE3-CD2 4.2Å; W135-L140 HydrophobicContact CG-CD1 4.43Å
136	I	91.8	Very high	96.5	Very high	66 Å²	66	57.2 Å²	57.2	34%	0.338	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	47	54.4	-175.6	-43.3	-171.7	0	0	0	111.7	I80 S138	I80-I136 HydrophobicContact CD1-CD1 3.33Å; I80-I136 HydrophobicContact CD1-CG1 4.24Å; I80-I136 HydrophobicContact CG1-CD1 4.11Å; I136-S138 PolarHBondContact O-N 2.96Å
137	N	91.4	Very high	96.3	Very high	162 Å²	162	62.1 Å²	62.1	87%	0.866	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	62	5.8	-179.1	-51.5	-49.5	0	0	0	116.1	W135	W135-N137 VanDerWaalsContact C-N 3.33Å; W135-N137 PolarHBondContact O-N 2.99Å
138	S	93.2	Very high	96	Very high	27 Å²	27	66.6 Å²	66.6	19%	0.189	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	136	177.1	-62.2	0	0	0	0	111.4	N75 T134 W135 I136 L140	N75-S138 WeakPolarHBondContact O-CB 3.33Å; T134-S138 CarbonylContact C-O 3.51Å; T134-S138 VanDerWaalsContact CA-O 3.31Å; T134-S138 WeakPolarHBondContact CA-O 2.84Å; W135-S138 PolarHBondContact N-O 3.36Å; W135-S138 PolarHBondContact O-N 3.33Å; W135-S138 VanDerWaalsContact O-O 3.09Å; I136-S138 PolarHBondContact O-N 2.96Å; S138-L140 PolarHBondContact O-N 2.78Å
139	K	96.7	Very high	95.5	Very high	131 Å²	131	65.8 Å²	65.8	57%	0.57	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.3	110.9	176.8	-173.9	179.3	-178.9	-178.5	0	110	N75 G132	N75-K139 WeakPolarHBondContact CB-O 3.35Å; N75-K139 PolarHBondContact ND2-N 3.48Å; N75-K139 PolarHBondContact ND2-O 3.14Å; G132-K139 VanDerWaalsContact O-CE 3.27Å; G132-K139 WeakPolarHBondContact O-CE 3.05Å
140	L	97.7	Very high	94.8	Very high	2 Å²	2	68.1 Å²	68.1	1%	0.01	36%	0.355	C	S	.	.			trans	-70.5	140.2	-175.9	-56.2	-179.3	0	0	0	111.5	L76 V130 G132 K133 W135 S138 V142	L76-L140 HydrophobicContact CD2-CD2 3.7Å; L76-L140 HydrophobicContact CG-CD2 4.5Å; V130-L140 HydrophobicContact CG1-CB 4.39Å; V130-L140 HydrophobicContact CG1-CD1 3.52Å; G132-L140 WeakPolarHBondContact CA-O 3.39Å; G132-L140 PolarHBondContact N-O 2.76Å; K133-L140 PolarHBondContact O-N 2.84Å; W135-L140 HydrophobicContact CB-CD1 3.79Å; W135-L140 HydrophobicContact CB-CD2 4.29Å; W135-L140 HydrophobicContact CB-CG 4.01Å; W135-L140 HydrophobicContact CD2-CD1 4.32Å; W135-L140 HydrophobicContact CE3-CD1 3.69Å; W135-L140 HydrophobicContact CE3-CD2 4.2Å; W135-L140 HydrophobicContact CG-CD1 4.43Å; S138-L140 PolarHBondContact O-N 2.78Å; L140-V142 HydrophobicContact CB-CG2 4.45Å
141	E	98.2	Very high	93.8	Very high	90 Å²	90	77.8 Å²	77.8	42%	0.421	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	122.5	166.6	-59.7	-179.4	175.6	0	0	108.5	V73 R74	V73-E141 CarbonylContact C-O 3.58Å; V73-E141 WeakPolarHBondContact CA-O 3.46Å; R74-E141 HydrophobicContact CB-CB 4.24Å; R74-E141 IonicContact CZ-OE2 3.23Å; R74-E141 VanDerWaalsContact CZ-OE2 3.23Å; R74-E141 PolarHBondContact N-O 2.81Å; R74-E141 IonicContact NE-OE2 2.87Å; R74-E141 PolarHBondContact NE-OE2 3.13Å; R74-E141 IonicContact NH2-OE2 2.72Å; R74-E141 PolarHBondContact NH2-OE2 2.86Å; R74-E141 PolarHBondContact O-N 3.17Å; R74-E141 VanDerWaalsContact O-N 3.15Å
142	V	98.2	Very high	92.4	Very high	7 Å²	7	81.8 Å²	81.8	4%	0.042	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	132	-178.9	-168.2	0	0	0	0	109.1	I71 F72 V73 F89 I127 V130 N131 L140	I71-V142 HydrophobicContact CB-CG1 4.44Å; I71-V142 HydrophobicContact CD1-CG1 3.86Å; F72-V142 WeakPolarHBondContact O-CA 3.4Å; V73-V142 HydrophobicContact CG1-CG2 4.25Å; V73-V142 HydrophobicContact CG2-CG1 4.23Å; V73-V142 HydrophobicContact CG2-CG2 4.39Å; F89-V142 HydrophobicContact CZ-CG2 4.44Å; I127-V142 HydrophobicContact CB-CG1 4.46Å; I127-V142 HydrophobicContact CG1-CG1 3.88Å; V130-V142 HydrophobicContact CB-CG2 3.98Å; V130-V142 HydrophobicContact CG1-CG2 3.74Å; N131-V142 HydrophobicContact CB-CB 4.08Å; N131-V142 VanDerWaalsContact CG-O 3.27Å; N131-V142 PolarHBondContact OD1-N 2.73Å; N131-V142 PolarHBondContact OD1-O 2.81Å; L140-V142 HydrophobicContact CB-CG2 4.45Å
143	G	97.9	Very high	90.9	Very high	26 Å²	26	89 Å²	89	27%	0.268	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	177.9	179.6	0	0	0	0	0	112.9	I71 F72	I71-G143 CarbonylContact C-O 3.58Å; I71-G143 VanDerWaalsContact CA-O 3.31Å; I71-G143 WeakPolarHBondContact CA-O 3.4Å; F72-G143 PolarHBondContact N-O 3.33Å; F72-G143 PolarHBondContact O-N 2.85Å
144	W	98.1	Very high	90.6	Very high	46 Å²	46	88.7 Å²	88.7	17%	0.174	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	135.4	176.6	-62.9	104.9	0	0	0	111.1	P62 W69 I71 F120 A123 I127 M147	P62-W144 HydrophobicContact CB-CD2 3.62Å; P62-W144 HydrophobicContact CB-CE3 4Å; P62-W144 HydrophobicContact CB-CG 3.87Å; P62-W144 HydrophobicContact CB-CZ2 4.24Å; P62-W144 HydrophobicContact CB-CZ3 4.45Å; P62-W144 HydrophobicContact CG-CD2 3.78Å; P62-W144 VanDerWaalsContact CG-CE2 3.48Å; P62-W144 HydrophobicContact CG-CG 3.81Å; P62-W144 HydrophobicContact CG-CZ2 4.09Å; P62-W144 VanDerWaalsContact CG-NE1 3.33Å; W69-W144 HydrophobicContact CB-CZ3 4.22Å; W69-W144 HydrophobicContact CD2-CZ3 4.36Å; W69-W144 HydrophobicContact CE3-CE3 4.25Å; W69-W144 HydrophobicContact CE3-CH2 4.33Å; W69-W144 AromaticContact CE3-CZ3 3.7Å; W69-W144 HydrophobicContact CE3-CZ3 3.7Å; W69-W144 HydrophobicContact CZ3-CZ3 4.47Å; I71-W144 HydrophobicContact CG2-CE3 4.49Å; F120-W144 AromaticContact CD2-CH2 3.52Å; F120-W144 HydrophobicContact CD2-CH2 3.52Å; F120-W144 HydrophobicContact CD2-CZ2 4.1Å; F120-W144 HydrophobicContact CD2-CZ3 4.18Å; F120-W144 AromaticContact CE2-CH2 3.35Å; F120-W144 HydrophobicContact CE2-CH2 3.35Å; F120-W144 AromaticContact CE2-CZ2 3.43Å; F120-W144 HydrophobicContact CE2-CZ2 3.43Å; F120-W144 VanDerWaalsContact CE2-CZ2 3.43Å; F120-W144 HydrophobicContact CE2-CZ3 4.21Å; F120-W144 HydrophobicContact CG-CH2 4.43Å; F120-W144 HydrophobicContact CZ-CH2 4.13Å; F120-W144 AromaticContact CZ-CZ2 3.89Å; F120-W144 HydrophobicContact CZ-CZ2 3.89Å; A123-W144 HydrophobicContact CB-CH2 3.7Å; A123-W144 HydrophobicContact CB-CZ3 3.5Å; I127-W144 HydrophobicContact CD1-CD2 3.41Å; I127-W144 VanDerWaalsContact CD1-CD2 3.41Å; I127-W144 HydrophobicContact CD1-CE3 3.82Å; I127-W144 HydrophobicContact CD1-CG 3.83Å; I127-W144 HydrophobicContact CD1-CH2 4.13Å; I127-W144 HydrophobicContact CD1-CZ2 3.75Å; I127-W144 HydrophobicContact CD1-CZ3 4.16Å; W144-M147 HydrophobicContact CB-CG 3.7Å; W144-M147 HydrophobicContact CB-SD 4.06Å
145	C	96.8	Very high	90.3	Very high	40 Å²	40	88.1 Å²	88.1	27%	0.27	45%	0.45	S	S	.	.	S	Bend	trans	-74.6	-39.1	176.9	-169.5	0	0	0	0	111.8	L70 F72	L70-C145 HydrophobicContact CB-CB 3.57Å; L70-C145 VanDerWaalsContact O-CB 3.29Å; L70-C145 WeakPolarHBondContact O-CB 3.35Å; L70-C145 PolarHBondContact O-N 3.49Å; F72-C145 HydrophobicContact CB-CB 4.49Å
146	F	95.4	Very high	90.1	Very high	101 Å²	101	90.4 Å²	90.4	44%	0.443	47%	0.465	S	S	.	.			trans	-120.9	125	179.1	-57.5	-46.8	0	0	0	110.6	C63 L70	C63-F146 HydrophobicContact CB-CB 4.12Å; C63-F146 PolarHBondContact N-O 3.37Å; L70-F146 HydrophobicContact CD1-CD2 4.07Å; L70-F146 HydrophobicContact CD1-CE2 3.41Å; L70-F146 VanDerWaalsContact CD1-CE2 3.41Å; L70-F146 HydrophobicContact CD1-CZ 4.1Å
147	M	94.6	Very high	90	Very high	103 Å²	103	91.8 Å²	91.8	51%	0.507	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	145.5	174.1	-59.2	179.4	-75.5	0	0	108.9	F60 V61 W144	F60-M147 HydrophobicContact CB-CB 4.04Å; F60-M147 HydrophobicContact CB-SD 4.35Å; F60-M147 HydrophobicContact CD1-CB 4.4Å; V61-M147 CarbonylContact O-C 3.54Å; V61-M147 VanDerWaalsContact O-CA 3.26Å; V61-M147 WeakPolarHBondContact O-CA 3.25Å; W144-M147 HydrophobicContact CB-CG 3.7Å; W144-M147 HydrophobicContact CB-SD 4.06Å
148	K	91	Very high	89.9	Confident	113 Å²	113	87.4 Å²	87.4	49%	0.491	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	145.6	176.7	63.6	-175.2	178.9	-176	0	109.7	F60 V61	F60-K148 CarbonylContact C-O 3.59Å; F60-K148 WeakPolarHBondContact CA-O 3.42Å; V61-K148 HydrophobicContact CG2-CD 4.07Å; V61-K148 HydrophobicContact CG2-CG 3.44Å; V61-K148 VanDerWaalsContact CG2-CG 3.44Å; V61-K148 PolarHBondContact N-O 3.25Å; V61-K148 PolarHBondContact O-N 2.87Å
149	P	89.4	Confident	89.7	Confident	81 Å²	81	91.5 Å²	91.5	53%	0.526	47%	0.466	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.8	139.9	171.6	27.9	-33.8	0	0	0	109.4	F60	F60-P149 HydrophobicContact CD1-CB 4.44Å; F60-P149 HydrophobicContact CE1-CB 4.13Å
150	E	81.8	Confident	89.2	Confident	74 Å²	74	88.6 Å²	88.6	35%	0.346	46%	0.458	S	S	.	.			trans	-62.8	137.8	169.1	65.6	-169.2	169.6	0	0	110.7	C59 K152	C59-E150 WeakPolarHBondContact CA-OE1 3.31Å; C59-E150 HydrophobicContact CB-CG 4.25Å; C59-E150 WeakPolarHBondContact CB-OE1 3.27Å; C59-E150 WeakPolarHBondContact CB-OE2 3.43Å; C59-E150 PolarHBondContact N-OE1 2.89Å; C59-E150 WeakPolarHBondContact O-CB 3.31Å; C59-E150 WeakPolarHBondContact O-CG 3.17Å; C59-E150 PolarHBondContact O-N 3.43Å; C59-E150 VanDerWaalsContact SG-CD 3.55Å; C59-E150 PolarHBondContact SG-OE1 2.77Å; E150-K152 PolarHBondContact O-N 3.22Å
151	K	76.7	Confident	88.5	Confident	203 Å²	203	95.3 Å²	95.3	88%	0.883	49%	0.493	S	S	*	.			trans	-78.2	113.1	170.6	-67	-178	-179.6	177.8	0	107.1	S153	K151-S153 PolarHBondContact O-N 2.72Å
152	K	67.8	Low	87.7	Confident	170 Å²	170	95.8 Å²	95.8	74%	0.739	50%	0.499	S	S	*	.			trans	-66.4	113.1	162.4	-65.3	-173	-178.3	179.9	0	106.5	E150	E150-K152 PolarHBondContact O-N 3.22Å
153	S	65.2	Low	86.8	Confident	185 Å²	185	103.8 Å²	103.8	100%	1.294	54%	0.54	S	S	*	.			trans	-75.4	0	176.7	-163.4	0	0	0	0	111.7	K151	K151-S153 PolarHBondContact O-N 2.72Å

Retrieved 153 of 153 residues in 69.9 ms (Link to these results)

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