A0A096NRC4_PAPAN Loading...

Proteasome subunit beta

Component of the 20S core proteasome complex involved in the proteolytic degradation of most intracellular proteins. This complex plays numerous essential roles within the cell by associating with different regulatory particles. Associated with two 19S regulatory particles, forms the 26S proteasome and thus participates in the ATP-dependent degradation of ubiquitinated proteins. The 26S proteasome plays a key role in the maintenance of protein homeostasis by removing misfolded or damaged proteins that could impair cellular functions, and by removing proteins whose functions are no longer required. Associated with the PA200 or PA28, the 20S proteasome mediates ubiquitin-independent protein degradation. This type of proteolysis is required in several pathways including spermatogenesis (20S-PA200 complex) or generation of a subset of MHC class I-presented antigenic peptides (20S-PA28 complex). Within the 20S core complex, PSMB5 displays a chymotrypsin-like activity. Component of the proteasome, a multicatalytic proteinase complex which is characterized by its ability to cleave peptides with Arg, Phe, Tyr, Leu, and Glu adjacent to the leaving group at neutral or slightly basic pH. The proteasome has an ATP-dependent proteolytic activity.

AlphaFold DB (G7MX33), UniProt , Accession A0A096NRC4, Species PAPAN (Papio anubis, Olive baboon), Gene n/a, Length 263 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.4	Very low	38.2	Very low	251 Å²	251	155.9 Å²	155.9	100%	1.236	86%	0.862	S	S	*	*				0	122	0	-64.4	-166.3	-164.4	0	0	106.5
2	A	34	Very low	38.3	Very low	89 Å²	89	153.4 Å²	153.4	74%	0.736	86%	0.859	S	S	*	*			cis	-150.1	159.6	3.8	0	0	0	0	0	103.9
3	L	32.8	Very low	38.1	Very low	153 Å²	153	151.8 Å²	151.8	80%	0.801	85%	0.854	S	S	*	*			cis	-140.5	121.7	30.9	-79.4	85.5	0	0	0	108.9
4	A	38.1	Very low	37.9	Very low	110 Å²	110	151.5 Å²	151.5	91%	0.909	85%	0.85	S	S	*	*			trans	-98.1	97.2	158.6	0	0	0	0	0	106.4
5	S	46.9	Very low	37.5	Very low	91 Å²	91	153.9 Å²	153.9	64%	0.636	85%	0.851	S	S	*	*			trans	-156.5	27.5	176.6	71.1	0	0	0	0	115.8
6	V	38.7	Very low	37.1	Very low	139 Å²	139	159.6 Å²	159.6	84%	0.842	86%	0.856	S	S	*	*	S	Bend	trans	-133.4	19.7	175.8	-161	0	0	0	0	113.3
7	L	40.9	Very low	36.7	Very low	172 Å²	172	154.3 Å²	154.3	90%	0.901	85%	0.848	S	S	*	*			trans	-123.5	78.8	177	-88.6	162	0	0	0	111.1
8	E	41.3	Very low	36.2	Very low	189 Å²	189	157.4 Å²	157.4	88%	0.883	85%	0.852	S	S	*	*			trans	-137.2	91.8	155.3	-76.3	-169.4	177.5	0	0	109.5
9	R	37	Very low	35.7	Very low	236 Å²	236	160.8 Å²	160.8	89%	0.891	86%	0.858	S	S	*	*			trans	-134.8	119	149.8	-80.7	-169.9	169.8	-180	-3.3	108
10	P	36.2	Very low	35.3	Very low	125 Å²	125	156.3 Å²	156.3	81%	0.812	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-71.4	135.6	177.2	28.4	-31	0	0	0	109.9
11	L	35.2	Very low	35	Very low	160 Å²	160	157.7 Å²	157.7	84%	0.838	86%	0.857	S	S	*	*	P	Polyproline II helix	trans	-69.5	128.1	172.7	-71.1	165	0	0	0	109.5	V13	L11-V13 PolarHBondContact O-N 2.85Å
12	P	38.5	Very low	34.4	Very low	126 Å²	126	149.5 Å²	149.5	82%	0.818	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-73.5	118.6	177.6	26.7	-29.4	0	0	0	110.6
13	V	35.7	Very low	34	Very low	132 Å²	132	149 Å²	149	80%	0.8	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-78.3	128.6	172.3	175.1	0	0	0	0	109.4	L11 Q15	L11-V13 PolarHBondContact O-N 2.85Å; V13-Q15 PolarHBondContact O-N 3.48Å
14	N	35.5	Very low	33.8	Very low	148 Å²	148	154 Å²	154	79%	0.791	85%	0.849	S	S	*	*			trans	-40.3	116.6	173.8	-164.6	3.5	0	0	0	113.7
15	Q	32.2	Very low	33.7	Very low	187 Å²	187	153.1 Å²	153.1	87%	0.874	84%	0.841	S	S	*	*			trans	-113.6	133.1	165.6	-77.4	-165	-2.1	0	0	111.1	V13	V13-Q15 PolarHBondContact O-N 3.48Å
16	R	31.4	Very low	32.7	Very low	246 Å²	246	156.9 Å²	156.9	93%	0.928	85%	0.854	S	S	*	*			trans	-78.9	140.7	-173	-72.9	175.6	171.7	174	-3	112.3
17	G	30.6	Very low	32.7	Very low	69 Å²	69	158 Å²	158	71%	0.711	86%	0.855	S	S	*	*			trans	115	102.2	141.8	0	0	0	0	0	115.5
18	F	27.5	Very low	32.3	Very low	211 Å²	211	157.7 Å²	157.7	93%	0.925	85%	0.853	S	S	*	*			trans	-146.8	104.7	157.8	-127	-93.5	0	0	0	110.5
19	F	26.6	Very low	31.9	Very low	222 Å²	222	156.3 Å²	156.3	97%	0.974	85%	0.852	S	S	*	*			trans	-120.1	127.2	163.5	-117	-85.2	0	0	0	105.5
20	G	27.3	Very low	32	Very low	70 Å²	70	153.4 Å²	153.4	72%	0.722	85%	0.852	S	S	*	*			trans	168.6	120.6	173.5	0	0	0	0	0	114.8
21	L	29.6	Very low	31.8	Very low	186 Å²	186	150 Å²	150	97%	0.974	84%	0.839	S	S	*	*			trans	-76	155.7	-173.5	-71.7	117.6	0	0	0	115.1
22	G	25.9	Very low	31.8	Very low	78 Å²	78	149 Å²	149	80%	0.804	84%	0.843	S	S	*	*				115.9	107.4	127.9	0	0	0	0	0	119.2
23	G	25.8	Very low	31.6	Very low	80 Å²	80	146.6 Å²	146.6	83%	0.825	84%	0.841	S	S	*	*				87.2	119.6	119.5	0	0	0	0	0	121.4
24	R	28.5	Very low	31.4	Very low	258 Å²	258	145.2 Å²	145.2	97%	0.974	84%	0.837	S	S	*	*			trans	85.3	131.5	153.3	-87.8	-179.8	166.7	162.2	-3.8	119.5
25	A	35.5	Very low	31.6	Very low	90 Å²	90	144.6 Å²	144.6	74%	0.744	84%	0.841	S	S	*	*			trans	-82.3	141.9	-173.3	0	0	0	0	0	112.3
26	D	26.7	Very low	32.2	Very low	171 Å²	171	139.8 Å²	139.8	91%	0.914	83%	0.828	S	S	*	*			trans	-125.8	124.1	149.9	-80.6	-39.7	0	0	0	108.7
27	L	39	Very low	32.3	Very low	162 Å²	162	136.2 Å²	136.2	85%	0.848	83%	0.828	S	S	*	*			trans	-90.1	102.4	-176.8	-171.2	116	0	0	0	106.5
28	L	33.2	Very low	32.5	Very low	165 Å²	165	136.2 Å²	136.2	86%	0.864	83%	0.828	S	S	*	*			trans	159.7	86.1	159	-87.2	155.2	0	0	0	109.4
29	D	31.8	Very low	33.2	Very low	160 Å²	160	134.1 Å²	134.1	86%	0.856	83%	0.825	S	S	*	*			trans	-159.7	107	142.2	-143.4	-8.1	0	0	0	110.4	G31	D29-G31 PolarHBondContact O-N 3.5Å
30	I	39.4	Very low	33.5	Very low	175 Å²	175	128.9 Å²	128.9	90%	0.897	82%	0.816	S	S	*	*			trans	-93.2	87.8	177.4	-54.2	173	0	0	0	105.7
31	G	32.9	Very low	34.1	Very low	53 Å²	53	133.7 Å²	133.7	55%	0.546	82%	0.824	S	S	.	*			trans	-114.4	150.8	176.6	0	0	0	0	0	112.2	D29 G33	D29-G31 PolarHBondContact O-N 3.5Å; G31-G33 PolarHBondContact O-N 3.37Å
32	P	34.7	Very low	34.5	Very low	140 Å²	140	128.5 Å²	128.5	91%	0.909	81%	0.808	S	S	*	*			trans	-75	110.5	-175.6	29.3	-31.3	0	0	0	111.8
33	G	33.9	Very low	35	Very low	75 Å²	75	129.1 Å²	129.1	77%	0.773	81%	0.805	S	S	*	*			trans	49.4	100.7	146.1	0	0	0	0	0	119.4	G31	G31-G33 PolarHBondContact O-N 3.37Å
34	S	31.6	Very low	35.8	Very low	103 Å²	103	131.3 Å²	131.3	72%	0.72	81%	0.805	S	S	*	*			trans	-98.8	137.8	151	60.8	0	0	0	0	109.9	S36	S34-S36 PolarHBondContact O-N 2.94Å
35	P	39.8	Very low	36	Very low	135 Å²	135	122.2 Å²	122.2	88%	0.877	79%	0.792	S	S	*	*	S	Bend	trans	-92.8	78.2	179.2	35.2	-29.7	0	0	0	110
36	S	45.1	Very low	36.3	Very low	86 Å²	86	130.7 Å²	130.7	60%	0.601	81%	0.805	S	S	*	*			trans	-164.9	87.9	159.9	58.8	0	0	0	0	109.3	S34	S34-S36 PolarHBondContact O-N 2.94Å
37	D	33.6	Very low	37	Very low	172 Å²	172	125.8 Å²	125.8	92%	0.92	80%	0.795	S	S	*	*			trans	178.4	136.8	140.9	-91.4	-22.1	0	0	0	111.4
38	G	33.5	Very low	37.4	Very low	69 Å²	69	124.4 Å²	124.4	71%	0.711	79%	0.793	S	S	*	*			trans	93.1	104.6	145.3	0	0	0	0	0	118.3	S40	G38-S40 PolarHBondContact O-N 2.63Å
39	L	42.4	Very low	37.7	Very low	167 Å²	167	121.7 Å²	121.7	87%	0.874	79%	0.785	S	S	*	*			trans	28.4	86.7	130.8	-134.1	86.7	0	0	0	116.4	L41	L39-L41 PolarHBondContact O-N 3.08Å
40	S	32.6	Very low	38.6	Very low	111 Å²	111	123.3 Å²	123.3	78%	0.776	79%	0.788	S	S	*	*			trans	-79.4	100.1	170.8	-175.4	0	0	0	0	110.8	G38	G38-S40 PolarHBondContact O-N 2.63Å
41	L	40.9	Very low	39.3	Very low	171 Å²	171	122.4 Å²	122.4	90%	0.895	78%	0.78	S	S	*	*			trans	-85.8	83.5	156.3	-104	150.7	0	0	0	107.4	L39	L39-L41 PolarHBondContact O-N 3.08Å
42	A	37.1	Very low	39.7	Very low	77 Å²	77	126.3 Å²	126.3	64%	0.636	80%	0.795	S	S	*	*			trans	-141	129.9	172.4	0	0	0	0	0	111.1
43	A	37.8	Very low	40.4	Very low	91 Å²	91	122.2 Å²	122.2	75%	0.752	78%	0.779	S	S	*	*			trans	-57.9	153.2	173.6	0	0	0	0	0	111.4	G45	A43-G45 PolarHBondContact O-N 3.29Å; A43-G45 VanDerWaalsContact O-N 3.1Å
44	P	41.1	Very low	41.2	Very low	127 Å²	127	125.5 Å²	125.5	83%	0.825	78%	0.777	S	S	*	*			trans	-68.3	113.8	-168.1	28.6	-35.3	0	0	0	111.3
45	G	33.7	Very low	42	Very low	67 Å²	67	128.9 Å²	128.9	69%	0.691	78%	0.781	S	S	*	*			trans	-69.9	138	160.9	0	0	0	0	0	109.7	A43 G47	A43-G45 PolarHBondContact O-N 3.29Å; A43-G45 VanDerWaalsContact O-N 3.1Å; G45-G47 PolarHBondContact O-N 2.92Å
46	W	40.7	Very low	42.6	Very low	267 Å²	267	125.4 Å²	125.4	100%	1.011	75%	0.754	S	S	*	*	S	Bend	trans	-53.8	132.7	174.2	-76.7	43.6	0	0	0	111.1
47	G	43.3	Very low	43	Very low	69 Å²	69	125.6 Å²	125.6	71%	0.711	75%	0.748	S	S	*	*			trans	88.6	79.7	171.4	0	0	0	0	0	113.4	G45 P49	G45-G47 PolarHBondContact O-N 2.92Å; G47-P49 WeakPolarHBondContact O-CD 3.43Å
48	V	45.5	Very low	44.3	Very low	132 Å²	132	120.9 Å²	120.9	80%	0.8	72%	0.72	S	S	*	*			trans	-64	124.6	154.8	-165.1	0	0	0	0	105.7	E50	V48-E50 PolarHBondContact O-N 3.32Å
49	P	40.1	Very low	46	Very low	109 Å²	109	117.9 Å²	117.9	71%	0.708	69%	0.689	S	S	*	*			trans	-58	123.9	169	-15.4	28.4	0	0	0	107	G47 E51	G47-P49 WeakPolarHBondContact O-CD 3.43Å; P49-E51 PolarHBondContact O-N 2.88Å
50	E	51.8	Low	48.2	Very low	194 Å²	194	110.6 Å²	110.6	91%	0.907	65%	0.652	S	S	*	*			trans	-60.2	107.3	173.3	-150.2	168.8	-159.7	0	0	106.3	V48	V48-E50 PolarHBondContact O-N 3.32Å
51	E	53.7	Low	51.2	Low	156 Å²	156	105.3 Å²	105.3	73%	0.729	62%	0.615	S	S	*	*			trans	-54.7	147.4	175.5	-67.2	-129.9	162.9	0	0	108.3	P49 G53	P49-E51 PolarHBondContact O-N 2.88Å; E51-G53 PolarHBondContact O-N 2.89Å
52	P	41.7	Very low	53.9	Low	135 Å²	135	97.1 Å²	97.1	88%	0.877	57%	0.572	S	S	*	*			trans	-65.3	79.8	179.9	27.1	-33.3	0	0	0	110.1
53	G	47.6	Very low	56.9	Low	54 Å²	54	93.5 Å²	93.5	56%	0.557	54%	0.542	S	S	*	.			trans	-75.5	139.4	170.1	0	0	0	0	0	108	E51 E55	E51-G53 PolarHBondContact O-N 2.89Å; G53-E55 PolarHBondContact O-N 3.03Å
54	I	51.5	Low	59.7	Low	143 Å²	143	89.1 Å²	89.1	73%	0.733	51%	0.506	S	S	*	.			trans	-62.4	109.4	163.5	-62.2	171.2	0	0	0	105.5	M56	I54-M56 HydrophobicContact CB-CG 4.49Å; I54-M56 HydrophobicContact CG2-CG 3.93Å; I54-M56 PolarHBondContact O-N 3.16Å
55	E	47.8	Very low	62.5	Low	174 Å²	174	83.1 Å²	83.1	81%	0.813	47%	0.467	S	S	*	.			trans	-65.5	89.9	172.3	-168.2	-177.2	178.8	0	0	107.7	G53 L57	G53-E55 PolarHBondContact O-N 3.03Å; E55-L57 PolarHBondContact O-N 3.14Å
56	M	53.2	Low	65.5	Low	62 Å²	62	83 Å²	83	31%	0.305	45%	0.447	S	S	.	.			trans	-76.8	109.6	177.1	-67.7	-160	-161	0	0	107.5	I54 H58	I54-M56 HydrophobicContact CB-CG 4.49Å; I54-M56 HydrophobicContact CG2-CG 3.93Å; I54-M56 PolarHBondContact O-N 3.16Å; M56-H58 WeakPolarHBondContact CB-NE2 3.48Å; M56-H58 PolarHBondContact O-CE1 3.1Å; M56-H58 PolarHBondContact O-N 2.58Å; M56-H58 PolarHBondContact O-ND1 3.07Å; M56-H58 VanDerWaalsContact O-ND1 3.13Å; M56-H58 PolarHBondContact O-NE2 2.81Å
57	L	54.1	Low	68.2	Low	90 Å²	90	70.3 Å²	70.3	47%	0.471	40%	0.399	S	S	.	.			trans	-66.6	98.8	167.2	-66.9	169.8	0	0	0	107.9	E55 G59	E55-L57 PolarHBondContact O-N 3.14Å; L57-G59 VanDerWaalsContact C-N 3.26Å; L57-G59 PolarHBondContact O-N 3.17Å
58	H	60.9	Low	70.7	Confident	73 Å²	73	72.2 Å²	72.2	34%	0.338	39%	0.385	S	S	.	.			trans	-74.8	73.8	-175.3	-59.1	112.7	0	0	0	112.3	M56 T60 G106 S155 S189	M56-H58 WeakPolarHBondContact CB-NE2 3.48Å; M56-H58 PolarHBondContact O-CE1 3.1Å; M56-H58 PolarHBondContact O-N 2.58Å; M56-H58 PolarHBondContact O-ND1 3.07Å; M56-H58 VanDerWaalsContact O-ND1 3.13Å; M56-H58 PolarHBondContact O-NE2 2.81Å; H58-T60 PolarHBondContact O-N 2.91Å; H58-G106 WeakPolarHBondContact CD2-CA 3.46Å; H58-S155 PolarHBondContact NE2-OG 3.38Å; H58-S189 WeakPolarHBondContact O-CB 3.42Å; H58-S189 PolarHBondContact O-N 2.77Å; H58-S189 VanDerWaalsContact O-N 3.15Å; H58-S189 PolarHBondContact O-OG 2.92Å
59	G	68.3	Low	73.2	Confident	6 Å²	6	69.3 Å²	69.3	6%	0.062	36%	0.362	C	S	.	.			trans	-71.9	86.4	178.5	0	0	0	0	0	114	L57 K92 Y228	L57-G59 VanDerWaalsContact C-N 3.26Å; L57-G59 PolarHBondContact O-N 3.17Å; G59-K92 PolarHBondContact O-NZ 2.88Å; G59-Y228 CarbonylContact C-O 3.56Å
60	T	88.7	Confident	75.9	Confident	14 Å²	14	64.1 Å²	64.1	9%	0.086	33%	0.329	C	S	.	.			trans	-167.3	148.4	-175	-70.3	0	0	0	0	112.4	H58 T62 K92 A105 G188 S189 G190 S229	H58-T60 PolarHBondContact O-N 2.91Å; T60-T62 HydrophobicContact CG2-CG2 3.76Å; T60-K92 HydrophobicContact CG2-CD 3.52Å; T60-K92 PolarHBondContact OG1-NZ 3.48Å; T60-A105 HydrophobicContact CG2-CB 4.12Å; T60-G188 CarbonylContact O-C 3.42Å; T60-G188 WeakPolarHBondContact O-CA 3.22Å; T60-S189 PolarHBondContact N-OG 3.26Å; T60-S189 PolarHBondContact O-N 2.84Å; T60-S189 PolarHBondContact O-OG 3.26Å; T60-G190 PolarHBondContact O-N 3.1Å; T60-S229 VanDerWaalsContact C-OG 3.31Å
61	T	96.5	Very high	78.1	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.285	C	S	.	.			trans	-128.5	118	160.7	-55.8	0	0	0	0	110.2	A75 D76 G190 A194 I219 A222 S229	T61-A75 WeakPolarHBondContact O-CA 3.3Å; T61-D76 PolarHBondContact N-OD1 2.92Å; T61-D76 PolarHBondContact O-N 2.87Å; T61-D76 VanDerWaalsContact O-N 3.12Å; T61-D76 VanDerWaalsContact O-OD1 3.12Å; T61-G190 WeakPolarHBondContact OG1-CA 3.44Å; T61-G190 PolarHBondContact OG1-N 2.77Å; T61-A194 HydrophobicContact CG2-CB 3.99Å; T61-I219 HydrophobicContact CG2-CD1 3.73Å; T61-A222 HydrophobicContact CG2-CB 3.76Å; T61-S229 PolarHBondContact N-OG 2.9Å; T61-S229 PolarHBondContact OG1-OG 3.3Å
62	T	97.8	Very high	80.2	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	148.7	165.6	64	0	0	0	0	109.4	T60 A74 A75 K92 M159 S186 V187	T60-T62 HydrophobicContact CG2-CG2 3.76Å; T62-A74 WeakPolarHBondContact CA-O 3.25Å; T62-A75 HydrophobicContact CG2-CB 3.77Å; T62-K92 HydrophobicContact CG2-CB 4.41Å; T62-M159 VanDerWaalsContact OG1-CE 3.26Å; T62-M159 WeakPolarHBondContact OG1-CE 3.38Å; T62-S186 CarbonylContact O-C 3.54Å; T62-S186 WeakPolarHBondContact O-CA 3.29Å; T62-S186 PolarHBondContact O-OG 2.84Å; T62-V187 PolarHBondContact N-O 3.21Å; T62-V187 PolarHBondContact O-N 2.57Å; T62-V187 PolarHBondContact OG1-O 2.87Å
63	L	98.1	Very high	83	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	151	170.7	65.8	86.9	0	0	0	110.4	F65 A74 F185 A194 M198 A215 A218 I219	L63-F65 HydrophobicContact CD1-CD1 4.01Å; L63-F65 HydrophobicContact CD1-CE1 4.13Å; L63-A74 HydrophobicContact CD1-CB 3.95Å; L63-A74 HydrophobicContact CG-CB 4.12Å; L63-A74 PolarHBondContact N-O 3.2Å; L63-A74 PolarHBondContact O-N 3.32Å; L63-F185 CarbonylContact C-O 3.57Å; L63-F185 VanDerWaalsContact CA-O 3.26Å; L63-F185 WeakPolarHBondContact CA-O 3.26Å; L63-A194 HydrophobicContact CD2-CB 4.02Å; L63-M198 HydrophobicContact CD1-SD 4.36Å; L63-A215 HydrophobicContact CD1-CB 4.31Å; L63-A218 HydrophobicContact CD2-CB 3.57Å; L63-I219 HydrophobicContact CD2-CD1 3.57Å; L63-I219 HydrophobicContact CD2-CG1 3.8Å; L63-I219 HydrophobicContact CG-CD1 3.87Å; L63-I219 HydrophobicContact CG-CG1 4.23Å
64	A	98.5	Very high	85.4	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	140	171.3	0	0	0	0	0	110	I72 V73 M159 L170 F185	A64-I72 CarbonylContact C-O 3.17Å; A64-I72 WeakPolarHBondContact CA-O 3.36Å; A64-V73 HydrophobicContact CB-CG2 4.18Å; A64-M159 HydrophobicContact CB-CE 4.16Å; A64-M159 HydrophobicContact CB-SD 3.81Å; A64-L170 HydrophobicContact CB-CD1 3.74Å; A64-L170 HydrophobicContact CB-CD2 4.31Å; A64-F185 PolarHBondContact N-O 3.39Å; A64-F185 PolarHBondContact O-N 3.24Å
65	F	98.5	Very high	87.6	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	144	172.6	62.2	-95.6	0	0	0	111.9	L63 F67 V71 I72 A183 T184 M198 Y202 A211 L214 A215	L63-F65 HydrophobicContact CD1-CD1 4.01Å; L63-F65 HydrophobicContact CD1-CE1 4.13Å; F65-F67 HydrophobicContact CE2-CD1 4.45Å; F65-V71 WeakPolarHBondContact O-CA 3.28Å; F65-V71 WeakPolarHBondContact O-CG1 3.25Å; F65-I72 HydrophobicContact CD1-CB 4.44Å; F65-I72 HydrophobicContact CD2-CB 4.42Å; F65-I72 HydrophobicContact CE1-CB 3.98Å; F65-I72 HydrophobicContact CE1-CG2 4.12Å; F65-I72 HydrophobicContact CE2-CB 3.96Å; F65-I72 HydrophobicContact CE2-CG1 3.8Å; F65-I72 HydrophobicContact CZ-CB 3.72Å; F65-I72 HydrophobicContact CZ-CG1 3.81Å; F65-I72 HydrophobicContact CZ-CG2 4.08Å; F65-I72 PolarHBondContact N-O 3.47Å; F65-I72 PolarHBondContact O-N 2.84Å; F65-A183 CarbonylContact C-O 3.49Å; F65-A183 WeakPolarHBondContact CA-O 3.28Å; F65-T184 HydrophobicContact CB-CG2 3.72Å; F65-M198 HydrophobicContact CB-SD 4.25Å; F65-M198 HydrophobicContact CD1-CG 4.4Å; F65-M198 HydrophobicContact CD1-SD 3.83Å; F65-M198 HydrophobicContact CG-SD 4.44Å; F65-Y202 HydrophobicContact CB-CD2 4.33Å; F65-Y202 HydrophobicContact CB-CE2 4.06Å; F65-Y202 AromaticContact CD2-CD2 3.95Å; F65-Y202 HydrophobicContact CD2-CD2 3.95Å; F65-Y202 AromaticContact CD2-CE2 3.8Å; F65-Y202 HydrophobicContact CD2-CE2 3.8Å; F65-Y202 HydrophobicContact CG-CD2 4.23Å; F65-Y202 HydrophobicContact CG-CE2 4.22Å; F65-A211 HydrophobicContact CE2-CB 4.03Å; F65-A211 HydrophobicContact CZ-CB 4.14Å; F65-L214 HydrophobicContact CZ-CD2 4.32Å; F65-A215 HydrophobicContact CE1-CB 3.89Å; F65-A215 HydrophobicContact CZ-CB 4.28Å
66	K	97.6	Very high	90	Very high	65 Å²	65	23.3 Å²	23.3	28%	0.283	11%	0.109	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	142.6	174.5	79.8	-168.5	-179.3	-163.1	0	110.2	G70 V71 P168 G182 A183 Y202	K66-G70 WeakPolarHBondContact CA-O 3.18Å; K66-V71 HydrophobicContact CB-CG2 4.21Å; K66-P168 HydrophobicContact CB-CB 4.38Å; K66-G182 WeakPolarHBondContact CD-O 3.1Å; K66-G182 WeakPolarHBondContact CE-O 3.39Å; K66-G182 PolarHBondContact NZ-O 3.31Å; K66-A183 HydrophobicContact CD-CB 4.34Å; K66-A183 HydrophobicContact CG-CB 4.2Å; K66-A183 PolarHBondContact N-O 2.77Å; K66-Y202 WeakPolarHBondContact O-CE2 3.46Å; K66-Y202 PolarHBondContact O-OH 3.34Å
67	F	97.5	Very high	92.1	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	179.2	175.9	73.8	-64.2	0	0	0	108.9	F65 H69 G70 I72 L206 V208 A211 H237	F65-F67 HydrophobicContact CE2-CD1 4.45Å; F67-H69 HydrophobicContact CD2-CB 4.24Å; F67-H69 HydrophobicContact CE2-CB 3.57Å; F67-H69 AromaticContact CE2-CD2 3.66Å; F67-H69 HydrophobicContact CZ-CB 3.73Å; F67-H69 PolarHBondContact O-N 3.21Å; F67-H69 VanDerWaalsContact O-N 3.08Å; F67-G70 VanDerWaalsContact CD1-O 3.26Å; F67-G70 WeakPolarHBondContact CD1-O 3.14Å; F67-G70 PolarHBondContact N-O 3.15Å; F67-G70 PolarHBondContact O-N 3.32Å; F67-G70 VanDerWaalsContact O-N 3.08Å; F67-G70 VanDerWaalsContact O-O 3.06Å; F67-I72 HydrophobicContact CD1-CG1 4.12Å; F67-I72 HydrophobicContact CE1-CD1 3.68Å; F67-I72 HydrophobicContact CE1-CG1 3.6Å; F67-I72 HydrophobicContact CZ-CD1 4.05Å; F67-I72 HydrophobicContact CZ-CG1 4.25Å; F67-L206 HydrophobicContact CD2-CB 4.42Å; F67-V208 HydrophobicContact CE2-CG2 4.29Å; F67-V208 HydrophobicContact CZ-CG2 4.44Å; F67-A211 HydrophobicContact CD2-CB 4.31Å; F67-A211 HydrophobicContact CE2-CB 3.99Å; F67-A211 HydrophobicContact CZ-CB 4.12Å; F67-H237 AromaticContact CE1-NE2 3.96Å; F67-H237 AromaticContact CZ-NE2 3.85Å
68	R	96.3	Very high	94	Very high	109 Å²	109	18.5 Å²	18.5	41%	0.411	8%	0.081	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.1	-37.1	-175.3	-172.7	173.7	71	-140.5	5.5	113.9	Y204 D205	R68-Y204 HydrophobicContact CB-CE1 4.16Å; R68-Y204 PolarHBondContact N-O 2.82Å; R68-D205 IonicContact CZ-OD1 3.64Å; R68-D205 IonicContact NH1-OD1 3.88Å; R68-D205 PolarHBondContact NH1-OD1 3.37Å
69	H	96.8	Very high	95.6	Very high	71 Å²	71	16.3 Å²	16.3	33%	0.329	8%	0.076	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.5	17.7	-175.3	-49.9	-80.4	0	0	0	114	F67 L206 V208 H237	F67-H69 HydrophobicContact CD2-CB 4.24Å; F67-H69 HydrophobicContact CE2-CB 3.57Å; F67-H69 AromaticContact CE2-CD2 3.66Å; F67-H69 HydrophobicContact CZ-CB 3.73Å; F67-H69 PolarHBondContact O-N 3.21Å; F67-H69 VanDerWaalsContact O-N 3.08Å; H69-L206 PolarHBondContact CD2-O 2.95Å; H69-V208 HydrophobicContact CB-CG2 3.93Å; H69-H237 PolarHBondContact O-NE2 3.39Å
70	G	96.9	Very high	96.8	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	127.8	-143.4	173.7	0	0	0	0	0	114.8	K66 F67 V238	K66-G70 WeakPolarHBondContact CA-O 3.18Å; F67-G70 VanDerWaalsContact CD1-O 3.26Å; F67-G70 WeakPolarHBondContact CD1-O 3.14Å; F67-G70 PolarHBondContact N-O 3.15Å; F67-G70 PolarHBondContact O-N 3.32Å; F67-G70 VanDerWaalsContact O-N 3.08Å; F67-G70 VanDerWaalsContact O-O 3.06Å; G70-V238 VanDerWaalsContact CA-O 3.28Å; G70-V238 WeakPolarHBondContact CA-O 3.28Å
71	V	98.4	Very high	96.8	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	129.9	179.2	-171.1	0	0	0	0	109.5	F65 K66 V73 C161 P168 V238	F65-V71 WeakPolarHBondContact O-CA 3.28Å; F65-V71 WeakPolarHBondContact O-CG1 3.25Å; K66-V71 HydrophobicContact CB-CG2 4.21Å; V71-V73 HydrophobicContact CG1-CG2 4.23Å; V71-C161 HydrophobicContact CG1-CB 4.19Å; V71-P168 HydrophobicContact CG2-CB 3.81Å; V71-V238 HydrophobicContact CB-CB 4.06Å; V71-V238 HydrophobicContact CB-CG2 4.29Å; V71-V238 PolarHBondContact N-O 2.95Å; V71-V238 PolarHBondContact O-N 2.92Å
72	I	98.6	Very high	96.4	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	134	168.1	-58.6	-53.4	0	0	0	108.5	A64 F65 F67 A211 Y212 A215 L235 H237	A64-I72 CarbonylContact C-O 3.17Å; A64-I72 WeakPolarHBondContact CA-O 3.36Å; F65-I72 HydrophobicContact CD1-CB 4.44Å; F65-I72 HydrophobicContact CD2-CB 4.42Å; F65-I72 HydrophobicContact CE1-CB 3.98Å; F65-I72 HydrophobicContact CE1-CG2 4.12Å; F65-I72 HydrophobicContact CE2-CB 3.96Å; F65-I72 HydrophobicContact CE2-CG1 3.8Å; F65-I72 HydrophobicContact CZ-CB 3.72Å; F65-I72 HydrophobicContact CZ-CG1 3.81Å; F65-I72 HydrophobicContact CZ-CG2 4.08Å; F65-I72 PolarHBondContact N-O 3.47Å; F65-I72 PolarHBondContact O-N 2.84Å; F67-I72 HydrophobicContact CD1-CG1 4.12Å; F67-I72 HydrophobicContact CE1-CD1 3.68Å; F67-I72 HydrophobicContact CE1-CG1 3.6Å; F67-I72 HydrophobicContact CZ-CD1 4.05Å; F67-I72 HydrophobicContact CZ-CG1 4.25Å; I72-A211 HydrophobicContact CG1-CB 4.04Å; I72-Y212 HydrophobicContact CD1-CD1 3.73Å; I72-Y212 HydrophobicContact CD1-CE1 3.55Å; I72-A215 HydrophobicContact CG2-CB 3.54Å; I72-L235 HydrophobicContact CG2-CD1 3.53Å; I72-H237 HydrophobicContact CD1-CB 4.03Å
73	V	98.6	Very high	96	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	125.4	173.7	-174.4	0	0	0	0	107.7	A64 V71 V93 L101 T103 C161 Y236 V238	A64-V73 HydrophobicContact CB-CG2 4.18Å; V71-V73 HydrophobicContact CG1-CG2 4.23Å; V73-V93 HydrophobicContact CG1-CG1 4.32Å; V73-V93 HydrophobicContact CG1-CG2 3.98Å; V73-L101 HydrophobicContact CG2-CD1 4.28Å; V73-T103 HydrophobicContact CG1-CG2 3.63Å; V73-C161 HydrophobicContact CG2-CB 3.87Å; V73-C161 VanDerWaalsContact CG2-SG 3.6Å; V73-Y236 PolarHBondContact N-O 2.82Å; V73-Y236 PolarHBondContact O-N 3.26Å; V73-V238 HydrophobicContact CG2-CG2 4.5Å
74	A	98.4	Very high	95.7	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	142.4	177.6	0	0	0	0	0	110.8	T62 L63 A215 I219 N234 L235	T62-A74 WeakPolarHBondContact CA-O 3.25Å; L63-A74 HydrophobicContact CD1-CB 3.95Å; L63-A74 HydrophobicContact CG-CB 4.12Å; L63-A74 PolarHBondContact N-O 3.2Å; L63-A74 PolarHBondContact O-N 3.32Å; A74-A215 HydrophobicContact CB-CB 4.1Å; A74-I219 HydrophobicContact CB-CD1 4.41Å; A74-I219 HydrophobicContact CB-CG1 3.75Å; A74-N234 WeakPolarHBondContact CA-O 3.4Å; A74-L235 HydrophobicContact CB-CD1 3.89Å
75	A	98.1	Very high	95.5	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	146.7	178.2	0	0	0	0	0	111.2	T61 T62 K92 V93 N234	T61-A75 WeakPolarHBondContact O-CA 3.3Å; T62-A75 HydrophobicContact CG2-CB 3.77Å; A75-K92 HydrophobicContact CB-CB 3.92Å; A75-V93 HydrophobicContact CB-CG2 3.87Å; A75-N234 PolarHBondContact N-O 3.08Å; A75-N234 VanDerWaalsContact N-O 3.08Å; A75-N234 PolarHBondContact O-N 2.82Å
76	D	97.7	Very high	95.3	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.233	C	C	.	.			trans	-73.8	177.8	164.9	84.2	-53	0	0	0	111	T61 R78 K92 I219 T223 S229 G230 A232	T61-D76 PolarHBondContact N-OD1 2.92Å; T61-D76 PolarHBondContact O-N 2.87Å; T61-D76 VanDerWaalsContact O-N 3.12Å; T61-D76 VanDerWaalsContact O-OD1 3.12Å; D76-R78 PolarHBondContact OD2-N 2.84Å; D76-K92 VanDerWaalsContact O-CD 3.29Å; D76-K92 WeakPolarHBondContact O-CD 3.47Å; D76-K92 WeakPolarHBondContact O-CG 3.42Å; D76-K92 IonicContact OD1-NZ 2.71Å; D76-K92 PolarHBondContact OD1-NZ 3.04Å; D76-K92 IonicContact OD2-NZ 3.07Å; D76-K92 PolarHBondContact OD2-NZ 3.24Å; D76-I219 HydrophobicContact CB-CG2 4.16Å; D76-T223 HydrophobicContact CB-CG2 3.97Å; D76-S229 VanDerWaalsContact OD2-CA 3.29Å; D76-S229 WeakPolarHBondContact OD2-CA 3.49Å; D76-G230 PolarHBondContact OD2-N 2.9Å; D76-A232 CarbonylContact C-O 3.5Å; D76-A232 WeakPolarHBondContact CA-O 3.14Å
77	S	96.9	Very high	95.2	Very high	2 Å²	2	39.2 Å²	39.2	1%	0.014	23%	0.232	C	C	.	.			trans	-130.3	9.2	-175.7	65.7	0	0	0	0	115	Q88 T89 V90 G230 A232	S77-Q88 WeakPolarHBondContact CB-O 3.26Å; S77-Q88 CarbonylContact O-C 3.54Å; S77-Q88 PolarHBondContact OG-O 2.83Å; S77-T89 PolarHBondContact O-N 2.91Å; S77-V90 VanDerWaalsContact CA-O 3.31Å; S77-V90 WeakPolarHBondContact CA-O 3.35Å; S77-V90 WeakPolarHBondContact CB-O 3.18Å; S77-V90 PolarHBondContact O-N 3.06Å; S77-G230 PolarHBondContact N-O 3.36Å; S77-A232 PolarHBondContact N-O 2.83Å; S77-A232 PolarHBondContact OG-N 3.03Å; S77-A232 PolarHBondContact OG-O 3.46Å
78	R	95.9	Very high	95.1	Very high	49 Å²	49	42.4 Å²	42.4	19%	0.185	25%	0.247	C	C	.	.			trans	-78.6	137.1	176.9	179.7	170.8	-67.2	177.4	2.8	111.8	D76 T80 I85 S87 K92 A227 Y228 G230	D76-R78 PolarHBondContact OD2-N 2.84Å; R78-T80 HydrophobicContact CG-CG2 3.98Å; R78-I85 HydrophobicContact CG-CG2 4.13Å; R78-S87 CarbonylContact C-O 3.08Å; R78-S87 WeakPolarHBondContact CA-O 3.39Å; R78-K92 WeakPolarHBondContact O-CE 3.42Å; R78-K92 PolarHBondContact O-NZ 3.02Å; R78-A227 PolarHBondContact NH1-O 2.62Å; R78-Y228 WeakPolarHBondContact CD-O 3.28Å; R78-G230 WeakPolarHBondContact CB-O 3.5Å; R78-G230 PolarHBondContact N-O 3.03Å
79	A	94.1	Very high	95.1	Very high	27 Å²	27	42.7 Å²	42.7	22%	0.223	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	135.1	167.7	0	0	0	0	0	109.8	A86 S87 V90	A79-A86 PolarHBondContact O-N 3.47Å; A79-S87 PolarHBondContact N-O 3.38Å; A79-S87 PolarHBondContact O-N 3.26Å; A79-S87 VanDerWaalsContact O-N 3.13Å; A79-V90 HydrophobicContact CB-CB 4.33Å; A79-V90 HydrophobicContact CB-CG2 3.56Å
80	T	92.1	Very high	95.1	Very high	30 Å²	30	41 Å²	41	18%	0.184	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	149.2	-174.6	56.3	0	0	0	0	111.3	R78 Y84 I85 Y228	R78-T80 HydrophobicContact CG-CG2 3.98Å; T80-Y84 CarbonylContact C-O 3.38Å; T80-Y84 WeakPolarHBondContact CA-O 3.41Å; T80-I85 HydrophobicContact CG2-CG1 4.25Å; T80-Y228 HydrophobicContact CG2-CD1 3.99Å
81	A	89.4	Confident	94.9	Very high	68 Å²	68	46.3 Å²	46.3	56%	0.562	28%	0.278	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.5	81.9	170	0	0	0	0	0	107.5	A83 Y84	A81-A83 PolarHBondContact O-N 3.44Å; A81-Y84 PolarHBondContact N-O 3.02Å; A81-Y84 PolarHBondContact O-N 2.89Å
82	G	87.6	Confident	94.8	Very high	32 Å²	32	46.4 Å²	46.4	33%	0.33	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.5	-128.4	-167	0	0	0	0	0	111.1	Y84 Y228	G82-Y84 VanDerWaalsContact C-N 3.28Å; G82-Y84 PolarHBondContact O-N 2.79Å; G82-Y228 WeakPolarHBondContact O-CE1 3.19Å
83	A	89.2	Confident	94.8	Very high	105 Å²	105	46.6 Å²	46.6	87%	0.868	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-11.4	177.9	0	0	0	0	0	114.1	A81	A81-A83 PolarHBondContact O-N 3.44Å
84	Y	91.9	Very high	94.7	Very high	168 Å²	168	48.1 Å²	48.1	66%	0.659	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.4	131.5	-179.5	-179.1	-102.3	0	0	0	111.2	T80 A81 G82 A86	T80-Y84 CarbonylContact C-O 3.38Å; T80-Y84 WeakPolarHBondContact CA-O 3.41Å; A81-Y84 PolarHBondContact N-O 3.02Å; A81-Y84 PolarHBondContact O-N 2.89Å; G82-Y84 VanDerWaalsContact C-N 3.28Å; G82-Y84 PolarHBondContact O-N 2.79Å; Y84-A86 PolarHBondContact O-N 2.7Å
85	I	94.9	Very high	94.7	Very high	64 Å²	64	52.1 Å²	52.1	33%	0.328	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	109.9	175	-56.7	178.3	0	0	0	108.8	R78 T80 Q88	R78-I85 HydrophobicContact CG-CG2 4.13Å; T80-I85 HydrophobicContact CG2-CG1 4.25Å; I85-Q88 HydrophobicContact CG2-CG 4.13Å
86	A	94.3	Very high	94.6	Very high	62 Å²	62	52.5 Å²	52.5	51%	0.512	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	-40.4	-179.7	0	0	0	0	0	112.1	A79 Y84	A79-A86 PolarHBondContact O-N 3.47Å; Y84-A86 PolarHBondContact O-N 2.7Å
87	S	95.6	Very high	94.5	Very high	37 Å²	37	53.8 Å²	53.8	26%	0.259	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	152.9	177.8	177.9	0	0	0	0	111.5	R78 A79 T89	R78-S87 CarbonylContact C-O 3.08Å; R78-S87 WeakPolarHBondContact CA-O 3.39Å; A79-S87 PolarHBondContact N-O 3.38Å; A79-S87 PolarHBondContact O-N 3.26Å; A79-S87 VanDerWaalsContact O-N 3.13Å; S87-T89 PolarHBondContact OG-N 3.1Å; S87-T89 VanDerWaalsContact OG-N 3.17Å; S87-T89 PolarHBondContact OG-OG1 2.79Å
88	Q	95.4	Very high	94.5	Very high	67 Å²	67	58.4 Å²	58.4	31%	0.313	35%	0.345	S	S	.	.	S	Bend	trans	-109.6	3.1	173.7	-63.9	-81.9	3.5	0	0	112.2	S77 I85	S77-Q88 WeakPolarHBondContact CB-O 3.26Å; S77-Q88 CarbonylContact O-C 3.54Å; S77-Q88 PolarHBondContact OG-O 2.83Å; I85-Q88 HydrophobicContact CG2-CG 4.13Å
89	T	96.1	Very high	94.5	Very high	114 Å²	114	57.2 Å²	57.2	70%	0.699	34%	0.341	S	S	*	.			trans	-126.9	21.4	-169.5	56.8	0	0	0	0	113.6	S77 S87 K91	S77-T89 PolarHBondContact O-N 2.91Å; S87-T89 PolarHBondContact OG-N 3.1Å; S87-T89 VanDerWaalsContact OG-N 3.17Å; S87-T89 PolarHBondContact OG-OG1 2.79Å; T89-K91 PolarHBondContact O-N 3Å
90	V	96.1	Very high	94.7	Very high	37 Å²	37	56 Å²	56	22%	0.224	33%	0.33	C	S	.	.			trans	-69.2	127.9	179.7	179.5	0	0	0	0	110.5	S77 A79 K92 M104	S77-V90 VanDerWaalsContact CA-O 3.31Å; S77-V90 WeakPolarHBondContact CA-O 3.35Å; S77-V90 WeakPolarHBondContact CB-O 3.18Å; S77-V90 PolarHBondContact O-N 3.06Å; A79-V90 HydrophobicContact CB-CB 4.33Å; A79-V90 HydrophobicContact CB-CG2 3.56Å; V90-K92 HydrophobicContact CG1-CG 4.25Å; V90-K92 PolarHBondContact O-N 2.91Å; V90-M104 HydrophobicContact CG1-CE 3.38Å
91	K	94.6	Very high	95	Very high	110 Å²	110	54.5 Å²	54.5	48%	0.478	32%	0.322	S	S	.	.			trans	-77	103.2	172.1	-76.7	-172.7	153.5	-157.4	0	109.9	T89 E95	T89-K91 PolarHBondContact O-N 3Å; K91-E95 IonicContact NZ-OE1 3.52Å
92	K	96.4	Very high	95.4	Very high	2 Å²	2	51.3 Å²	51.3	1%	0.009	30%	0.295	C	S	.	.			trans	-91.5	-5.5	178.7	-56.3	-170.5	-168.8	176.5	0	114.7	G59 T60 T62 A75 D76 R78 V90 T103 M104	G59-K92 PolarHBondContact O-NZ 2.88Å; T60-K92 HydrophobicContact CG2-CD 3.52Å; T60-K92 PolarHBondContact OG1-NZ 3.48Å; T62-K92 HydrophobicContact CG2-CB 4.41Å; A75-K92 HydrophobicContact CB-CB 3.92Å; D76-K92 VanDerWaalsContact O-CD 3.29Å; D76-K92 WeakPolarHBondContact O-CD 3.47Å; D76-K92 WeakPolarHBondContact O-CG 3.42Å; D76-K92 IonicContact OD1-NZ 2.71Å; D76-K92 PolarHBondContact OD1-NZ 3.04Å; D76-K92 IonicContact OD2-NZ 3.07Å; D76-K92 PolarHBondContact OD2-NZ 3.24Å; R78-K92 WeakPolarHBondContact O-CE 3.42Å; R78-K92 PolarHBondContact O-NZ 3.02Å; V90-K92 HydrophobicContact CG1-CG 4.25Å; V90-K92 PolarHBondContact O-N 2.91Å; K92-T103 CarbonylContact O-C 3.53Å; K92-T103 WeakPolarHBondContact O-CA 3.31Å; K92-M104 HydrophobicContact CB-CB 4.37Å; K92-M104 HydrophobicContact CB-CE 4.5Å; K92-M104 HydrophobicContact CG-CE 4.08Å; K92-M104 PolarHBondContact O-N 3.33Å
93	V	97.7	Very high	95.9	Very high	5 Å²	5	49.8 Å²	49.8	3%	0.03	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	117	166.8	-176.6	0	0	0	0	107.1	V73 A75 L101 G102 Y236	V73-V93 HydrophobicContact CG1-CG1 4.32Å; V73-V93 HydrophobicContact CG1-CG2 3.98Å; A75-V93 HydrophobicContact CB-CG2 3.87Å; V93-L101 HydrophobicContact CG1-CB 4.28Å; V93-L101 HydrophobicContact CG1-CD1 4.14Å; V93-L101 HydrophobicContact CG1-CD2 4.03Å; V93-L101 HydrophobicContact CG1-CG 4.39Å; V93-G102 CarbonylContact C-O 3.56Å; V93-G102 WeakPolarHBondContact CA-O 3.33Å; V93-Y236 HydrophobicContact CB-CD2 3.99Å; V93-Y236 HydrophobicContact CB-CE2 3.77Å; V93-Y236 HydrophobicContact CG1-CD1 4.48Å; V93-Y236 HydrophobicContact CG1-CD2 3.88Å; V93-Y236 HydrophobicContact CG1-CE2 3.97Å; V93-Y236 HydrophobicContact CG1-CG 4.16Å; V93-Y236 HydrophobicContact CG2-CD2 3.97Å; V93-Y236 HydrophobicContact CG2-CE2 4.09Å
94	I	97.3	Very high	96.2	Very high	31 Å²	31	45.3 Å²	45.3	16%	0.159	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	124.8	-179	-64.3	165.7	0	0	0	108.1	I96 G102 M104 C111 E115	I94-I96 HydrophobicContact CG2-CG1 4.44Å; I94-I96 PolarHBondContact O-N 3.2Å; I94-I96 VanDerWaalsContact O-N 3.1Å; I94-G102 PolarHBondContact N-O 3.3Å; I94-G102 PolarHBondContact O-N 3.02Å; I94-M104 HydrophobicContact CD1-CB 4.12Å; I94-C111 HydrophobicContact CD1-CB 4.4Å; I94-E115 WeakPolarHBondContact CB-OE2 3.25Å; I94-E115 HydrophobicContact CD1-CB 4.34Å; I94-E115 HydrophobicContact CD1-CG 4.5Å; I94-E115 VanDerWaalsContact CD1-OE2 3.26Å; I94-E115 WeakPolarHBondContact CD1-OE2 3.44Å; I94-E115 HydrophobicContact CG2-CB 4.2Å
95	E	97.7	Very high	96.3	Very high	84 Å²	84	37.5 Å²	37.5	39%	0.393	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	86.4	179.5	-63.4	164.8	-159.4	0	0	108.5	K91 L101 Y236 W243	K91-E95 IonicContact NZ-OE1 3.52Å; E95-L101 HydrophobicContact CG-CD2 4.23Å; E95-Y236 HydrophobicContact CG-CE1 4.39Å; E95-Y236 PolarHBondContact OE1-OH 3.42Å; E95-W243 HydrophobicContact CB-CH2 4.29Å; E95-W243 HydrophobicContact CB-CZ2 3.75Å; E95-W243 HydrophobicContact CG-CH2 3.61Å; E95-W243 HydrophobicContact CG-CZ2 3.53Å; E95-W243 HydrophobicContact CG-CZ3 4.37Å; E95-W243 WeakPolarHBondContact OE2-CH2 3.31Å
96	I	96.9	Very high	96.1	Very high	9 Å²	9	35.3 Å²	35.3	5%	0.046	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	-52.2	-176.7	-62.7	170.2	0	0	0	110.1	I94 L100 E115 L118 A119 I160	I94-I96 HydrophobicContact CG2-CG1 4.44Å; I94-I96 PolarHBondContact O-N 3.2Å; I94-I96 VanDerWaalsContact O-N 3.1Å; I96-L100 HydrophobicContact CB-CB 4.05Å; I96-L100 HydrophobicContact CG2-CB 4.26Å; I96-L100 HydrophobicContact CG2-CD1 4.49Å; I96-L100 PolarHBondContact N-O 3.46Å; I96-E115 HydrophobicContact CG1-CB 4.36Å; I96-L118 HydrophobicContact CD1-CD2 4.13Å; I96-A119 HydrophobicContact CG2-CB 3.74Å; I96-A119 VanDerWaalsContact O-CB 3.25Å; I96-A119 WeakPolarHBondContact O-CB 3.48Å; I96-I160 HydrophobicContact CD1-CD1 3.94Å
97	N	95.3	Very high	95.9	Very high	26 Å²	26	32.8 Å²	32.8	14%	0.139	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	168.4	177.8	-79.7	-30.9	0	0	0	108.3	Y99 L100 C122 W243	N97-Y99 HydrophobicContact CB-CD1 4Å; N97-Y99 HydrophobicContact CB-CE1 3.75Å; N97-Y99 PolarHBondContact ND2-OH 3.08Å; N97-Y99 PolarHBondContact O-N 2.91Å; N97-L100 HydrophobicContact CB-CB 4.37Å; N97-L100 PolarHBondContact N-O 2.9Å; N97-L100 PolarHBondContact O-N 3.26Å; N97-L100 VanDerWaalsContact O-N 3.15Å; N97-C122 WeakPolarHBondContact ND2-CB 3.35Å; N97-W243 PolarHBondContact O-NE1 3.35Å
98	P	96.3	Very high	95.7	Very high	100 Å²	100	33.6 Å²	33.6	65%	0.649	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-11.1	175.8	-26.5	36	0	0	0	115.8	G242 W243	P98-G242 WeakPolarHBondContact O-CA 3.43Å; P98-W243 VanDerWaalsContact C-CD1 3.47Å; P98-W243 VanDerWaalsContact O-CD1 3.22Å; P98-W243 PolarHBondContact O-N 2.74Å
99	Y	96.7	Very high	95.6	Very high	23 Å²	23	34 Å²	34	9%	0.09	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.6	-0.4	-178.8	62.4	-88.9	0	0	0	114.2	N97 R132 I133 G162	N97-Y99 HydrophobicContact CB-CD1 4Å; N97-Y99 HydrophobicContact CB-CE1 3.75Å; N97-Y99 PolarHBondContact ND2-OH 3.08Å; N97-Y99 PolarHBondContact O-N 2.91Å; Y99-R132 HydrophobicContact CE1-CG 4.46Å; Y99-R132 HydrophobicContact CE2-CB 4.34Å; Y99-I133 HydrophobicContact CE2-CG2 4.19Å; Y99-G162 WeakPolarHBondContact O-CA 3.4Å
100	L	98	Very high	95.6	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.005	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	133	177.5	-70.8	172.7	0	0	0	110.3	I96 N97 I133 V135 A138 I160 C161	I96-L100 HydrophobicContact CB-CB 4.05Å; I96-L100 HydrophobicContact CG2-CB 4.26Å; I96-L100 HydrophobicContact CG2-CD1 4.49Å; I96-L100 PolarHBondContact N-O 3.46Å; N97-L100 HydrophobicContact CB-CB 4.37Å; N97-L100 PolarHBondContact N-O 2.9Å; N97-L100 PolarHBondContact O-N 3.26Å; N97-L100 VanDerWaalsContact O-N 3.15Å; L100-I133 HydrophobicContact CD1-CG2 4.11Å; L100-V135 HydrophobicContact CD2-CB 4.44Å; L100-V135 HydrophobicContact CD2-CG1 4.32Å; L100-V135 HydrophobicContact CD2-CG2 3.94Å; L100-A138 HydrophobicContact CD1-CB 4.04Å; L100-I160 HydrophobicContact CD2-CG2 4.44Å; L100-C161 WeakPolarHBondContact CA-O 3.46Å
101	L	98.6	Very high	95.5	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	143.2	169.3	-66.2	179.6	0	0	0	109.9	V73 V93 E95 C161 Y236 V238 W243	V73-L101 HydrophobicContact CG2-CD1 4.28Å; V93-L101 HydrophobicContact CG1-CB 4.28Å; V93-L101 HydrophobicContact CG1-CD1 4.14Å; V93-L101 HydrophobicContact CG1-CD2 4.03Å; V93-L101 HydrophobicContact CG1-CG 4.39Å; E95-L101 HydrophobicContact CG-CD2 4.23Å; L101-C161 HydrophobicContact CB-CB 4.33Å; L101-C161 PolarHBondContact N-O 3.48Å; L101-C161 PolarHBondContact O-N 2.9Å; L101-Y236 HydrophobicContact CD1-CD1 3.94Å; L101-Y236 HydrophobicContact CD1-CG 4.02Å; L101-Y236 HydrophobicContact CD2-CD1 4.33Å; L101-V238 HydrophobicContact CD1-CG2 3.73Å; L101-V238 HydrophobicContact CG-CG2 4.28Å; L101-W243 HydrophobicContact CD1-CB 3.87Å; L101-W243 HydrophobicContact CD1-CG 4.08Å; L101-W243 HydrophobicContact CD2-CB 4.37Å; L101-W243 HydrophobicContact CD2-CD2 3.79Å; L101-W243 HydrophobicContact CD2-CG 3.68Å; L101-W243 HydrophobicContact CG-CB 4.05Å; L101-W243 HydrophobicContact CG-CD2 4.44Å; L101-W243 HydrophobicContact CG-CG 3.83Å
102	G	98	Very high	95.6	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	161.2	168.6	0	0	0	0	0	110.7	V93 I94 E115 M159	V93-G102 CarbonylContact C-O 3.56Å; V93-G102 WeakPolarHBondContact CA-O 3.33Å; I94-G102 PolarHBondContact N-O 3.3Å; I94-G102 PolarHBondContact O-N 3.02Å; G102-E115 VanDerWaalsContact CA-OE2 3.28Å; G102-E115 WeakPolarHBondContact CA-OE2 3.3Å; G102-M159 WeakPolarHBondContact CA-O 3.19Å
103	T	97.5	Very high	95.6	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	137.3	177.9	65.3	0	0	0	0	111.5	V73 K92 T158 M159	V73-T103 HydrophobicContact CG1-CG2 3.63Å; K92-T103 CarbonylContact O-C 3.53Å; K92-T103 WeakPolarHBondContact O-CA 3.31Å; T103-T158 PolarHBondContact N-OG1 2.69Å; T103-T158 VanDerWaalsContact O-CA 3.27Å; T103-T158 WeakPolarHBondContact O-CA 3.2Å; T103-T158 WeakPolarHBondContact O-CB 3.5Å; T103-T158 PolarHBondContact O-OG1 2.77Å; T103-M159 HydrophobicContact CG2-CB 4.21Å; T103-M159 HydrophobicContact CG2-CE 3.8Å; T103-M159 PolarHBondContact N-O 3.4Å; T103-M159 WeakPolarHBondContact OG1-CE 3.4Å; T103-M159 PolarHBondContact OG1-N 3.38Å
104	M	95.8	Very high	95.6	Very high	12 Å²	12	32.7 Å²	32.7	6%	0.059	20%	0.197	C	C	.	.			trans	-94	107.3	178.1	179.5	164.7	72	0	0	110.5	V90 K92 I94 A108 C111	V90-M104 HydrophobicContact CG1-CE 3.38Å; K92-M104 HydrophobicContact CB-CB 4.37Å; K92-M104 HydrophobicContact CB-CE 4.5Å; K92-M104 HydrophobicContact CG-CE 4.08Å; K92-M104 PolarHBondContact O-N 3.33Å; I94-M104 HydrophobicContact CD1-CB 4.12Å; M104-A108 HydrophobicContact CE-CB 4.31Å; M104-A108 WeakPolarHBondContact SD-CA 3.33Å; M104-A108 HydrophobicContact SD-CB 3.72Å; M104-A108 VanDerWaalsContact SD-O 3.34Å; M104-C111 HydrophobicContact CB-CB 3.96Å; M104-C111 HydrophobicContact CG-CB 3.64Å; M104-C111 HydrophobicContact SD-CB 4.28Å
105	A	92.9	Very high	95.7	Very high	3 Å²	3	31.2 Å²	31.2	3%	0.025	19%	0.19	C	C	.	.			trans	-137.3	135.6	161.2	0	0	0	0	0	108.3	T60 C111 G157 V187	T60-A105 HydrophobicContact CG2-CB 4.12Å; A105-C111 PolarHBondContact O-SG 3Å; A105-C111 VanDerWaalsContact O-SG 3.39Å; A105-G157 WeakPolarHBondContact CB-O 3.43Å; A105-G157 PolarHBondContact O-N 3.3Å; A105-V187 HydrophobicContact CB-CB 4.18Å; A105-V187 HydrophobicContact CB-CG1 3.74Å
106	G	90.6	Very high	95.7	Very high	19 Å²	19	36.6 Å²	36.6	20%	0.196	21%	0.206	C	C	.	.	B	Isolated β-bridge	trans	116.3	-152.9	-164.8	0	0	0	0	0	112.1	H58 A108	H58-G106 WeakPolarHBondContact CD2-CA 3.46Å; G106-A108 PolarHBondContact O-N 2.91Å
107	G	91.6	Very high	95.7	Very high	8 Å²	8	38.6 Å²	38.6	8%	0.082	22%	0.217	C	C	.	.			trans	-63.2	119.4	167.5	0	0	0	0	0	110.5	A109 D110 C111 S155	G107-A109 VanDerWaalsContact C-N 3.27Å; G107-A109 PolarHBondContact O-N 3.45Å; G107-D110 PolarHBondContact O-N 3.37Å; G107-C111 PolarHBondContact O-N 3.19Å; G107-C111 VanDerWaalsContact O-N 3.09Å; G107-C111 PolarHBondContact O-SG 3.04Å; G107-S155 PolarHBondContact N-O 3.1Å
108	A	91.3	Very high	95.9	Very high	55 Å²	55	37.3 Å²	37.3	46%	0.455	21%	0.21	S	C	.	.	H	α-helix	trans	-61	-37.6	-177.9	0	0	0	0	0	112.5	M104 G106 S112	M104-A108 HydrophobicContact CE-CB 4.31Å; M104-A108 WeakPolarHBondContact SD-CA 3.33Å; M104-A108 HydrophobicContact SD-CB 3.72Å; M104-A108 VanDerWaalsContact SD-O 3.34Å; G106-A108 PolarHBondContact O-N 2.91Å; A108-S112 VanDerWaalsContact O-CB 3.24Å; A108-S112 WeakPolarHBondContact O-CB 3.47Å; A108-S112 PolarHBondContact O-N 3.39Å; A108-S112 VanDerWaalsContact O-N 3.16Å; A108-S112 PolarHBondContact O-OG 3.19Å
109	A	93.5	Very high	95.9	Very high	75 Å²	75	33.4 Å²	33.4	62%	0.62	19%	0.186	S	C	*	.	H	α-helix	trans	-67.4	-43.4	176.5	0	0	0	0	0	111.9	G107 S112 F113	G107-A109 VanDerWaalsContact C-N 3.27Å; G107-A109 PolarHBondContact O-N 3.45Å; A109-S112 PolarHBondContact O-N 2.91Å; A109-F113 VanDerWaalsContact O-CB 3.25Å; A109-F113 WeakPolarHBondContact O-CB 3.47Å; A109-F113 PolarHBondContact O-N 2.86Å
110	D	94.5	Very high	96	Very high	34 Å²	34	39.5 Å²	39.5	18%	0.182	21%	0.209	C	C	.	.	H	α-helix	trans	-61.2	-53.1	-179.1	-64.5	-20.6	0	0	0	110.9	G107 S112 F113 W114 S155	G107-D110 PolarHBondContact O-N 3.37Å; D110-S112 PolarHBondContact O-N 2.9Å; D110-F113 PolarHBondContact O-N 3.35Å; D110-W114 WeakPolarHBondContact O-CB 3.4Å; D110-W114 PolarHBondContact O-N 2.95Å; D110-S155 PolarHBondContact OD2-N 3.05Å
111	C	95.1	Very high	96	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-58.9	-49	178.9	-55.4	0	0	0	0	110.8	I94 M104 A105 G107 F113 E115 M156	I94-C111 HydrophobicContact CD1-CB 4.4Å; M104-C111 HydrophobicContact CB-CB 3.96Å; M104-C111 HydrophobicContact CG-CB 3.64Å; M104-C111 HydrophobicContact SD-CB 4.28Å; A105-C111 PolarHBondContact O-SG 3Å; A105-C111 VanDerWaalsContact O-SG 3.39Å; G107-C111 PolarHBondContact O-N 3.19Å; G107-C111 VanDerWaalsContact O-N 3.09Å; G107-C111 PolarHBondContact O-SG 3.04Å; C111-F113 VanDerWaalsContact C-N 3.3Å; C111-F113 PolarHBondContact O-N 3.22Å; C111-E115 VanDerWaalsContact O-CB 3.25Å; C111-E115 WeakPolarHBondContact O-CB 3.47Å; C111-E115 VanDerWaalsContact O-CG 3.29Å; C111-E115 WeakPolarHBondContact O-CG 3.2Å; C111-E115 PolarHBondContact O-N 3.37Å; C111-M156 HydrophobicContact CB-CG 4.44Å
112	S	95.9	Very high	95.9	Very high	56 Å²	56	42.4 Å²	42.4	39%	0.392	22%	0.222	S	C	.	.	H	α-helix	trans	-60.5	-39.8	-178.4	-63.3	0	0	0	0	112.4	A108 A109 D110 R116	A108-S112 VanDerWaalsContact O-CB 3.24Å; A108-S112 WeakPolarHBondContact O-CB 3.47Å; A108-S112 PolarHBondContact O-N 3.39Å; A108-S112 VanDerWaalsContact O-N 3.16Å; A108-S112 PolarHBondContact O-OG 3.19Å; A109-S112 PolarHBondContact O-N 2.91Å; D110-S112 PolarHBondContact O-N 2.9Å; S112-R116 WeakPolarHBondContact O-CB 3.42Å; S112-R116 PolarHBondContact O-N 3.48Å
113	F	97.7	Very high	95.9	Very high	127 Å²	127	48.2 Å²	48.2	56%	0.557	24%	0.244	S	C	*	.	H	α-helix	trans	-73.2	-52.4	-179.2	179.6	-96.9	0	0	0	111.9	A109 D110 C111 E115 R116 L117	A109-F113 VanDerWaalsContact O-CB 3.25Å; A109-F113 WeakPolarHBondContact O-CB 3.47Å; A109-F113 PolarHBondContact O-N 2.86Å; D110-F113 PolarHBondContact O-N 3.35Å; C111-F113 VanDerWaalsContact C-N 3.3Å; C111-F113 PolarHBondContact O-N 3.22Å; F113-E115 PolarHBondContact O-N 3.01Å; F113-R116 PolarHBondContact O-N 3.4Å; F113-L117 PolarHBondContact O-N 3.27Å
114	W	97.5	Very high	96	Very high	24 Å²	24	50.3 Å²	50.3	9%	0.091	26%	0.255	C	S	.	.	H	α-helix	trans	-68.6	-36.2	-174.7	-73.3	114.7	0	0	0	112.6	D110 L117 L118 L142 M145 V146 Y149 L154 M156	D110-W114 WeakPolarHBondContact O-CB 3.4Å; D110-W114 PolarHBondContact O-N 2.95Å; W114-L117 HydrophobicContact CE3-CD2 3.75Å; W114-L117 HydrophobicContact CZ3-CD2 3.58Å; W114-L117 PolarHBondContact O-N 3.4Å; W114-L118 WeakPolarHBondContact O-CB 3.43Å; W114-L118 PolarHBondContact O-N 3.32Å; W114-L142 HydrophobicContact CB-CD1 4.02Å; W114-M145 HydrophobicContact CE3-CB 4.24Å; W114-M145 HydrophobicContact CZ3-CB 4Å; W114-V146 HydrophobicContact CD2-CG2 4.49Å; W114-V146 HydrophobicContact CG-CG2 4.44Å; W114-Y149 AromaticContact CH2-CD2 3.85Å; W114-Y149 HydrophobicContact CH2-CD2 3.85Å; W114-Y149 AromaticContact CH2-CE2 3.47Å; W114-Y149 HydrophobicContact CH2-CE2 3.47Å; W114-Y149 VanDerWaalsContact CH2-CE2 3.47Å; W114-Y149 AromaticContact CZ2-CD2 3.89Å; W114-Y149 HydrophobicContact CZ2-CD2 3.89Å; W114-Y149 AromaticContact CZ2-CE2 3.88Å; W114-Y149 HydrophobicContact CZ2-CE2 3.88Å; W114-Y149 HydrophobicContact CZ2-CG 4.42Å; W114-L154 HydrophobicContact CZ2-CD1 4.38Å; W114-M156 HydrophobicContact CB-SD 4.08Å
115	E	97.6	Very high	96.1	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-71.6	-34.4	175.3	-67.6	-177.5	-156.6	0	0	112.4	I94 I96 G102 C111 F113 L117 L118 A119 T158	I94-E115 WeakPolarHBondContact CB-OE2 3.25Å; I94-E115 HydrophobicContact CD1-CB 4.34Å; I94-E115 HydrophobicContact CD1-CG 4.5Å; I94-E115 VanDerWaalsContact CD1-OE2 3.26Å; I94-E115 WeakPolarHBondContact CD1-OE2 3.44Å; I94-E115 HydrophobicContact CG2-CB 4.2Å; I96-E115 HydrophobicContact CG1-CB 4.36Å; G102-E115 VanDerWaalsContact CA-OE2 3.28Å; G102-E115 WeakPolarHBondContact CA-OE2 3.3Å; C111-E115 VanDerWaalsContact O-CB 3.25Å; C111-E115 WeakPolarHBondContact O-CB 3.47Å; C111-E115 VanDerWaalsContact O-CG 3.29Å; C111-E115 WeakPolarHBondContact O-CG 3.2Å; C111-E115 PolarHBondContact O-N 3.37Å; F113-E115 PolarHBondContact O-N 3.01Å; E115-L117 VanDerWaalsContact C-N 3.35Å; E115-L118 WeakPolarHBondContact O-CB 3.37Å; E115-L118 PolarHBondContact O-N 3.46Å; E115-A119 PolarHBondContact O-N 2.99Å; E115-T158 WeakPolarHBondContact OE1-CB 3.28Å; E115-T158 PolarHBondContact OE1-OG1 2.94Å
116	R	98	Very high	96.2	Very high	197 Å²	197	55.2 Å²	55.2	74%	0.743	27%	0.274	S	S	*	.	H	α-helix	trans	-66.5	-38	171.2	-176.8	174.7	-178.6	160.6	1.1	111.8	S112 F113 L118 A119 R120	S112-R116 WeakPolarHBondContact O-CB 3.42Å; S112-R116 PolarHBondContact O-N 3.48Å; F113-R116 PolarHBondContact O-N 3.4Å; R116-L118 VanDerWaalsContact C-N 3.34Å; R116-A119 WeakPolarHBondContact O-CB 3.48Å; R116-A119 PolarHBondContact O-N 3Å; R116-R120 PolarHBondContact O-N 3.02Å
117	L	98.1	Very high	96.6	Very high	50 Å²	50	59.7 Å²	59.7	26%	0.262	29%	0.293	S	S	.	.	H	α-helix	trans	-65.9	-39.4	173.3	-177.2	61.7	0	0	0	111.3	F113 W114 E115 R120 Q121 M145	F113-L117 PolarHBondContact O-N 3.27Å; W114-L117 HydrophobicContact CE3-CD2 3.75Å; W114-L117 HydrophobicContact CZ3-CD2 3.58Å; W114-L117 PolarHBondContact O-N 3.4Å; E115-L117 VanDerWaalsContact C-N 3.35Å; L117-R120 WeakPolarHBondContact O-CB 3.34Å; L117-R120 PolarHBondContact O-N 2.96Å; L117-Q121 PolarHBondContact O-N 2.92Å; L117-M145 HydrophobicContact CD2-SD 3.98Å; L117-M145 HydrophobicContact CG-SD 4.22Å
118	L	98	Very high	96.9	Very high	0 Å²	0	68.5 Å²	68.5	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-59.6	-45.4	172.7	178.8	66.1	0	0	0	111.1	I96 W114 E115 R116 R120 Q121 C122 A138 L141 L142 M145 I160	I96-L118 HydrophobicContact CD1-CD2 4.13Å; W114-L118 WeakPolarHBondContact O-CB 3.43Å; W114-L118 PolarHBondContact O-N 3.32Å; E115-L118 WeakPolarHBondContact O-CB 3.37Å; E115-L118 PolarHBondContact O-N 3.46Å; R116-L118 VanDerWaalsContact C-N 3.34Å; L118-R120 VanDerWaalsContact C-N 3.29Å; L118-R120 PolarHBondContact O-N 3.3Å; L118-Q121 PolarHBondContact O-N 3.33Å; L118-C122 WeakPolarHBondContact O-CB 3.22Å; L118-C122 PolarHBondContact O-N 3.31Å; L118-C122 PolarHBondContact O-SG 2.9Å; L118-A138 WeakPolarHBondContact CD1-O 3.26Å; L118-L141 HydrophobicContact CD1-CB 4.18Å; L118-L142 HydrophobicContact CD1-CB 4.31Å; L118-L142 HydrophobicContact CD2-CB 4.13Å; L118-L142 HydrophobicContact CD2-CD2 4.23Å; L118-M145 HydrophobicContact CB-CE 4.27Å; L118-M145 HydrophobicContact CD1-CE 4.23Å; L118-I160 HydrophobicContact CD2-CD1 4.14Å
119	A	97.9	Very high	97.2	Very high	17 Å²	17	70.2 Å²	70.2	14%	0.14	33%	0.325	C	S	.	.	H	α-helix	trans	-54.1	-45.5	175.9	0	0	0	0	0	111.9	I96 E115 R116 Q121 C122 R123	I96-A119 HydrophobicContact CG2-CB 3.74Å; I96-A119 VanDerWaalsContact O-CB 3.25Å; I96-A119 WeakPolarHBondContact O-CB 3.48Å; E115-A119 PolarHBondContact O-N 2.99Å; R116-A119 WeakPolarHBondContact O-CB 3.48Å; R116-A119 PolarHBondContact O-N 3Å; A119-Q121 PolarHBondContact O-N 2.89Å; A119-C122 PolarHBondContact O-N 2.79Å; A119-R123 PolarHBondContact O-N 2.97Å
120	R	98.2	Very high	97.3	Very high	152 Å²	152	76 Å²	76	57%	0.574	34%	0.337	S	S	*	.	H	α-helix	trans	-59.5	-46.3	174.4	176.3	-178.8	172.7	-93.8	1.4	111.8	R116 L117 L118 R123 I124	R116-R120 PolarHBondContact O-N 3.02Å; L117-R120 WeakPolarHBondContact O-CB 3.34Å; L117-R120 PolarHBondContact O-N 2.96Å; L118-R120 VanDerWaalsContact C-N 3.29Å; L118-R120 PolarHBondContact O-N 3.3Å; R120-R123 PolarHBondContact O-N 3.02Å; R120-I124 HydrophobicContact CG-CD1 4.11Å; R120-I124 WeakPolarHBondContact O-CG1 3.47Å; R120-I124 PolarHBondContact O-N 2.86Å
121	Q	98	Very high	97.4	Very high	61 Å²	61	78.5 Å²	78.5	29%	0.285	35%	0.347	S	S	.	.	H	α-helix	trans	-65.3	-41.6	-179.4	-171.4	61	23.8	0	0	111.9	L117 L118 A119 R123 I124 Y125 L141	L117-Q121 PolarHBondContact O-N 2.92Å; L118-Q121 PolarHBondContact O-N 3.33Å; A119-Q121 PolarHBondContact O-N 2.89Å; Q121-R123 VanDerWaalsContact C-N 3.31Å; Q121-R123 PolarHBondContact O-N 2.82Å; Q121-I124 PolarHBondContact O-N 2.79Å; Q121-Y125 PolarHBondContact O-N 3.43Å; Q121-L141 HydrophobicContact CG-CD1 3.98Å
122	C	97.4	Very high	97.4	Very high	0 Å²	0	85.2 Å²	85.2	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-59.8	-40.8	174.1	-66.6	0	0	0	0	111.5	N97 L118 A119 Y125 E126 I133	N97-C122 WeakPolarHBondContact ND2-CB 3.35Å; L118-C122 WeakPolarHBondContact O-CB 3.22Å; L118-C122 PolarHBondContact O-N 3.31Å; L118-C122 PolarHBondContact O-SG 2.9Å; A119-C122 PolarHBondContact O-N 2.79Å; C122-Y125 WeakPolarHBondContact O-CB 3.27Å; C122-Y125 PolarHBondContact O-N 2.89Å; C122-E126 PolarHBondContact O-N 2.86Å; C122-I133 HydrophobicContact CB-CG2 3.91Å
123	R	97.4	Very high	97.5	Very high	123 Å²	123	82.9 Å²	82.9	46%	0.464	36%	0.356	S	S	.	.	H	α-helix	trans	-67.3	-40.1	177.6	-174.8	56.9	177.1	169.9	0.2	112.8	A119 R120 Q121 Y125 E126 L127	A119-R123 PolarHBondContact O-N 2.97Å; R120-R123 PolarHBondContact O-N 3.02Å; Q121-R123 VanDerWaalsContact C-N 3.31Å; Q121-R123 PolarHBondContact O-N 2.82Å; R123-Y125 VanDerWaalsContact C-N 3.34Å; R123-E126 IonicContact CZ-OE2 3.74Å; R123-E126 IonicContact NH1-OE1 2.69Å; R123-E126 PolarHBondContact NH1-OE1 2.85Å; R123-E126 IonicContact NH1-OE2 3.03Å; R123-E126 PolarHBondContact NH1-OE2 2.88Å; R123-E126 PolarHBondContact O-N 3.25Å; R123-L127 WeakPolarHBondContact O-CG 3.32Å; R123-L127 PolarHBondContact O-N 2.85Å; R123-L127 VanDerWaalsContact O-N 3.12Å
124	I	98.2	Very high	97.4	Very high	43 Å²	43	78.4 Å²	78.4	22%	0.221	34%	0.34	C	S	.	.	H	α-helix	trans	-64	-42.3	175.4	-68	167.2	0	0	0	110.6	R120 Q121 E126 L127 R128	R120-I124 HydrophobicContact CG-CD1 4.11Å; R120-I124 WeakPolarHBondContact O-CG1 3.47Å; R120-I124 PolarHBondContact O-N 2.86Å; Q121-I124 PolarHBondContact O-N 2.79Å; I124-E126 VanDerWaalsContact C-N 3.34Å; I124-E126 PolarHBondContact O-N 2.91Å; I124-L127 PolarHBondContact O-N 3.37Å; I124-R128 HydrophobicContact CG2-CG 4.48Å; I124-R128 WeakPolarHBondContact O-CG 3.44Å; I124-R128 PolarHBondContact O-N 2.89Å; I124-R128 VanDerWaalsContact O-N 3.1Å
125	Y	98	Very high	97.4	Very high	73 Å²	73	77.3 Å²	77.3	29%	0.286	34%	0.336	S	S	.	.	H	α-helix	trans	-57.7	-48.1	175.2	-179.7	-87.1	0	0	0	111.2	Q121 C122 R123 L127 R128 N129 I133	Q121-Y125 PolarHBondContact O-N 3.43Å; C122-Y125 WeakPolarHBondContact O-CB 3.27Å; C122-Y125 PolarHBondContact O-N 2.89Å; R123-Y125 VanDerWaalsContact C-N 3.34Å; Y125-L127 VanDerWaalsContact C-N 3.34Å; Y125-L127 PolarHBondContact O-N 3.05Å; Y125-R128 PolarHBondContact O-N 2.92Å; Y125-N129 HydrophobicContact CE1-CB 4.26Å; Y125-N129 WeakPolarHBondContact O-CB 3.2Å; Y125-N129 PolarHBondContact O-N 3.15Å; Y125-N129 PolarHBondContact O-OD1 2.88Å; Y125-I133 HydrophobicContact CD1-CB 3.64Å; Y125-I133 HydrophobicContact CD1-CD1 4.39Å; Y125-I133 HydrophobicContact CD1-CG1 3.99Å; Y125-I133 HydrophobicContact CE1-CB 3.97Å; Y125-I133 HydrophobicContact CE1-CG1 4.12Å; Y125-I133 HydrophobicContact CG-CB 4.3Å; Y125-I133 HydrophobicContact CG-CD1 4.23Å; Y125-I133 HydrophobicContact CG-CG1 4.31Å
126	E	96.7	Very high	97.4	Very high	45 Å²	45	78.4 Å²	78.4	21%	0.21	35%	0.345	C	S	.	.	H	α-helix	trans	-58.9	-43	179.5	-171.7	-175.2	-174.8	0	0	112.5	C122 R123 I124 K130 E131	C122-E126 PolarHBondContact O-N 2.86Å; R123-E126 IonicContact CZ-OE2 3.74Å; R123-E126 IonicContact NH1-OE1 2.69Å; R123-E126 PolarHBondContact NH1-OE1 2.85Å; R123-E126 IonicContact NH1-OE2 3.03Å; R123-E126 PolarHBondContact NH1-OE2 2.88Å; R123-E126 PolarHBondContact O-N 3.25Å; I124-E126 VanDerWaalsContact C-N 3.34Å; I124-E126 PolarHBondContact O-N 2.91Å; E126-K130 WeakPolarHBondContact O-CA 3.5Å; E126-K130 PolarHBondContact O-N 2.86Å; E126-E131 WeakPolarHBondContact CA-O 3.48Å
127	L	97.8	Very high	97.4	Very high	114 Å²	114	70.5 Å²	70.5	60%	0.597	32%	0.322	S	S	*	.	H	α-helix	trans	-68	-35.7	178.8	-68.7	173.2	0	0	0	113.1	R123 I124 Y125	R123-L127 WeakPolarHBondContact O-CG 3.32Å; R123-L127 PolarHBondContact O-N 2.85Å; R123-L127 VanDerWaalsContact O-N 3.12Å; I124-L127 PolarHBondContact O-N 3.37Å; Y125-L127 VanDerWaalsContact C-N 3.34Å; Y125-L127 PolarHBondContact O-N 3.05Å
128	R	98.1	Very high	97.4	Very high	193 Å²	193	68.1 Å²	68.1	73%	0.728	31%	0.31	S	S	*	.	H	α-helix	trans	-73.7	-43.8	179.4	-73.6	176	177	177.3	-0.8	112.2	I124 Y125	I124-R128 HydrophobicContact CG2-CG 4.48Å; I124-R128 WeakPolarHBondContact O-CG 3.44Å; I124-R128 PolarHBondContact O-N 2.89Å; I124-R128 VanDerWaalsContact O-N 3.1Å; Y125-R128 PolarHBondContact O-N 2.92Å
129	N	97.3	Very high	97.4	Very high	90 Å²	90	68.1 Å²	68.1	48%	0.481	31%	0.31	S	S	.	.	H	α-helix	trans	-95	-11.1	-171.9	-69.3	62	0	0	0	112.8	Y125 E131	Y125-N129 HydrophobicContact CE1-CB 4.26Å; Y125-N129 WeakPolarHBondContact O-CB 3.2Å; Y125-N129 PolarHBondContact O-N 3.15Å; Y125-N129 PolarHBondContact O-OD1 2.88Å; N129-E131 HydrophobicContact CB-CB 4.49Å; N129-E131 PolarHBondContact O-N 3.05Å
130	K	97.1	Very high	97.4	Very high	198 Å²	198	72.2 Å²	72.2	86%	0.861	32%	0.324	S	S	*	.	S	Bend	trans	54.2	28.1	-171.4	-56.2	-178.9	-179.7	-179.9	0	112.5	E126	E126-K130 WeakPolarHBondContact O-CA 3.5Å; E126-K130 PolarHBondContact O-N 2.86Å
131	E	96.1	Very high	97.4	Very high	86 Å²	86	67.6 Å²	67.6	40%	0.402	31%	0.311	S	S	.	.	S	Bend	trans	-143.4	141	-176.8	-168.2	-172.7	125.9	0	0	109.6	E126 N129 K165	E126-E131 WeakPolarHBondContact CA-O 3.48Å; N129-E131 HydrophobicContact CB-CB 4.49Å; N129-E131 PolarHBondContact O-N 3.05Å; E131-K165 WeakPolarHBondContact OE1-CE 3.49Å; E131-K165 IonicContact OE1-NZ 2.85Å; E131-K165 PolarHBondContact OE1-NZ 3.46Å; E131-K165 IonicContact OE2-NZ 3.87Å; E131-K165 PolarHBondContact OE2-NZ 3.02Å
132	R	95.1	Very high	97.4	Very high	140 Å²	140	64.7 Å²	64.7	53%	0.528	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-63.9	144.9	175.5	-57.2	-178.4	-154.8	170.9	5.8	110.4	Y99	Y99-R132 HydrophobicContact CE1-CG 4.46Å; Y99-R132 HydrophobicContact CE2-CB 4.34Å
133	I	97	Very high	97.4	Very high	8 Å²	8	64.9 Å²	64.9	4%	0.041	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-70.5	142.6	175.4	-165.2	169.4	0	0	0	110.6	Y99 L100 C122 Y125 A137 A138 L141	Y99-I133 HydrophobicContact CE2-CG2 4.19Å; L100-I133 HydrophobicContact CD1-CG2 4.11Å; C122-I133 HydrophobicContact CB-CG2 3.91Å; Y125-I133 HydrophobicContact CD1-CB 3.64Å; Y125-I133 HydrophobicContact CD1-CD1 4.39Å; Y125-I133 HydrophobicContact CD1-CG1 3.99Å; Y125-I133 HydrophobicContact CE1-CB 3.97Å; Y125-I133 HydrophobicContact CE1-CG1 4.12Å; Y125-I133 HydrophobicContact CG-CB 4.3Å; Y125-I133 HydrophobicContact CG-CD1 4.23Å; Y125-I133 HydrophobicContact CG-CG1 4.31Å; I133-A137 HydrophobicContact CD1-CB 4.05Å; I133-A137 HydrophobicContact CG1-CB 3.72Å; I133-A138 HydrophobicContact CD1-CB 4.23Å; I133-A138 HydrophobicContact CG2-CB 4.26Å; I133-L141 HydrophobicContact CD1-CD1 3.57Å
134	S	97.2	Very high	97.4	Very high	33 Å²	33	62.6 Å²	62.6	23%	0.231	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-71.6	150.4	171.6	61.5	0	0	0	0	111.7	A136 A137 A138 D164	S134-A136 PolarHBondContact O-N 3.31Å; S134-A137 PolarHBondContact O-N 3.17Å; S134-A137 VanDerWaalsContact O-N 3.08Å; S134-A137 WeakPolarHBondContact OG-CB 3.41Å; S134-A137 PolarHBondContact OG-N 3.01Å; S134-A137 VanDerWaalsContact OG-N 3.14Å; S134-A138 PolarHBondContact O-N 3.47Å; S134-D164 VanDerWaalsContact CB-OD1 3.25Å; S134-D164 WeakPolarHBondContact CB-OD1 3.48Å; S134-D164 VanDerWaalsContact CB-OD2 3.28Å; S134-D164 WeakPolarHBondContact CB-OD2 3.33Å
135	V	97.4	Very high	97.3	Very high	1 Å²	1	62.2 Å²	62.2	1%	0.006	29%	0.293	C	S	.	.	H	α-helix	trans	-59.5	-35.7	175.5	-169	0	0	0	0	110.6	L100 S139 I160 D164 Y171	L100-V135 HydrophobicContact CD2-CB 4.44Å; L100-V135 HydrophobicContact CD2-CG1 4.32Å; L100-V135 HydrophobicContact CD2-CG2 3.94Å; V135-S139 WeakPolarHBondContact O-CB 3.17Å; V135-S139 PolarHBondContact O-N 3.27Å; V135-S139 PolarHBondContact O-OG 2.98Å; V135-I160 HydrophobicContact CG1-CG2 4.05Å; V135-D164 HydrophobicContact CG2-CB 4.1Å; V135-Y171 HydrophobicContact CB-CD2 4.47Å; V135-Y171 HydrophobicContact CB-CE2 4.35Å; V135-Y171 HydrophobicContact CG1-CD2 3.79Å; V135-Y171 HydrophobicContact CG1-CE2 4.14Å
136	A	97.4	Very high	97.1	Very high	22 Å²	22	58.8 Å²	58.8	18%	0.182	28%	0.28	C	S	.	.	H	α-helix	trans	-63	-43.2	175.1	0	0	0	0	0	112.4	S134 S139 K140 Y171 R179	S134-A136 PolarHBondContact O-N 3.31Å; A136-S139 PolarHBondContact O-OG 3.12Å; A136-K140 WeakPolarHBondContact O-CB 3.25Å; A136-K140 PolarHBondContact O-N 3.5Å; A136-Y171 HydrophobicContact CB-CE2 4.2Å; A136-Y171 WeakPolarHBondContact CB-OH 3.26Å; A136-R179 PolarHBondContact O-NH2 3.48Å
137	A	97.5	Very high	97.1	Very high	32 Å²	32	63 Å²	63	26%	0.264	30%	0.295	S	S	.	.	H	α-helix	trans	-71.5	-42.9	178.3	0	0	0	0	0	111.6	I133 S134 S139 K140 L141	I133-A137 HydrophobicContact CD1-CB 4.05Å; I133-A137 HydrophobicContact CG1-CB 3.72Å; S134-A137 PolarHBondContact O-N 3.17Å; S134-A137 VanDerWaalsContact O-N 3.08Å; S134-A137 WeakPolarHBondContact OG-CB 3.41Å; S134-A137 PolarHBondContact OG-N 3.01Å; S134-A137 VanDerWaalsContact OG-N 3.14Å; A137-S139 PolarHBondContact O-N 3.37Å; A137-K140 PolarHBondContact O-N 3.08Å; A137-L141 WeakPolarHBondContact O-CG 3.26Å; A137-L141 PolarHBondContact O-N 3.28Å
138	A	97.9	Very high	97	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-58.8	-48.4	177.3	0	0	0	0	0	112	L100 L118 I133 S134 K140 L141 L142	L100-A138 HydrophobicContact CD1-CB 4.04Å; L118-A138 WeakPolarHBondContact CD1-O 3.26Å; I133-A138 HydrophobicContact CD1-CB 4.23Å; I133-A138 HydrophobicContact CG2-CB 4.26Å; S134-A138 PolarHBondContact O-N 3.47Å; A138-K140 VanDerWaalsContact C-N 3.31Å; A138-K140 PolarHBondContact O-N 3Å; A138-L141 PolarHBondContact O-N 3.45Å; A138-L142 PolarHBondContact O-N 3.01Å; A138-L142 VanDerWaalsContact O-N 3.08Å
139	S	97.6	Very high	96.8	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-61.9	-36.3	176.1	55	0	0	0	0	112.9	V135 A136 A137 A143 R179	V135-S139 WeakPolarHBondContact O-CB 3.17Å; V135-S139 PolarHBondContact O-N 3.27Å; V135-S139 PolarHBondContact O-OG 2.98Å; A136-S139 PolarHBondContact O-OG 3.12Å; A137-S139 PolarHBondContact O-N 3.37Å; S139-A143 WeakPolarHBondContact O-CB 3.45Å; S139-A143 PolarHBondContact O-N 2.95Å; S139-R179 PolarHBondContact OG-NE 2.96Å; S139-R179 PolarHBondContact OG-NH2 2.7Å; S139-R179 VanDerWaalsContact OG-NH2 3.16Å
140	K	98.1	Very high	96.6	Very high	103 Å²	103	60.1 Å²	60.1	45%	0.448	28%	0.278	S	S	.	.	H	α-helix	trans	-72.3	-36.4	178.3	-173.3	55.1	173.6	161.6	0	112.4	A136 A137 A138 N144	A136-K140 WeakPolarHBondContact O-CB 3.25Å; A136-K140 PolarHBondContact O-N 3.5Å; A137-K140 PolarHBondContact O-N 3.08Å; A138-K140 VanDerWaalsContact C-N 3.31Å; A138-K140 PolarHBondContact O-N 3Å; K140-N144 VanDerWaalsContact CE-OD1 3.28Å; K140-N144 WeakPolarHBondContact CE-OD1 3.3Å; K140-N144 PolarHBondContact NZ-OD1 2.96Å; K140-N144 VanDerWaalsContact NZ-OD1 3.07Å; K140-N144 WeakPolarHBondContact O-CB 3.16Å; K140-N144 PolarHBondContact O-N 3.37Å; K140-N144 PolarHBondContact O-OD1 3.18Å
141	L	97.9	Very high	96.2	Very high	55 Å²	55	53.6 Å²	53.6	29%	0.288	27%	0.267	S	S	.	.	H	α-helix	trans	-61.3	-46	172.8	-73.7	174.2	0	0	0	111	L118 Q121 I133 A137 A138 N144 M145	L118-L141 HydrophobicContact CD1-CB 4.18Å; Q121-L141 HydrophobicContact CG-CD1 3.98Å; I133-L141 HydrophobicContact CD1-CD1 3.57Å; A137-L141 WeakPolarHBondContact O-CG 3.26Å; A137-L141 PolarHBondContact O-N 3.28Å; A138-L141 PolarHBondContact O-N 3.45Å; L141-N144 PolarHBondContact O-N 3.5Å; L141-M145 WeakPolarHBondContact O-CG 3.2Å; L141-M145 PolarHBondContact O-N 3.39Å
142	L	97.7	Very high	96	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-60.5	-50.1	177.1	-176.1	61	0	0	0	112	W114 L118 A138 N144 M145 V146 M156 T158 I160 V173	W114-L142 HydrophobicContact CB-CD1 4.02Å; L118-L142 HydrophobicContact CD1-CB 4.31Å; L118-L142 HydrophobicContact CD2-CB 4.13Å; L118-L142 HydrophobicContact CD2-CD2 4.23Å; A138-L142 PolarHBondContact O-N 3.01Å; A138-L142 VanDerWaalsContact O-N 3.08Å; L142-N144 VanDerWaalsContact C-N 3.27Å; L142-N144 PolarHBondContact O-N 3.12Å; L142-M145 HydrophobicContact CD1-CE 4.05Å; L142-M145 PolarHBondContact O-N 3.4Å; L142-M145 VanDerWaalsContact O-N 3.12Å; L142-V146 HydrophobicContact CD1-CG2 3.96Å; L142-V146 HydrophobicContact CG-CG2 4.3Å; L142-V146 VanDerWaalsContact O-CG2 3.28Å; L142-V146 WeakPolarHBondContact O-CG2 3.45Å; L142-V146 PolarHBondContact O-N 2.83Å; L142-M156 HydrophobicContact CD1-CE 4.26Å; L142-M156 HydrophobicContact CD2-CE 4.07Å; L142-M156 HydrophobicContact CG-CE 4.12Å; L142-T158 HydrophobicContact CD2-CG2 3.57Å; L142-I160 HydrophobicContact CD2-CD1 3.86Å; L142-I160 HydrophobicContact CD2-CG1 4.19Å; L142-V173 HydrophobicContact CD2-CB 4.44Å; L142-V173 HydrophobicContact CD2-CG1 4.32Å; L142-V173 HydrophobicContact CG-CG1 4.27Å
143	A	97.5	Very high	95.8	Very high	3 Å²	3	51.7 Å²	51.7	3%	0.025	28%	0.281	C	S	.	.	H	α-helix	trans	-56.7	-42.3	178	0	0	0	0	0	111.9	S139 Y147 V173 R179	S139-A143 WeakPolarHBondContact O-CB 3.45Å; S139-A143 PolarHBondContact O-N 2.95Å; A143-Y147 WeakPolarHBondContact O-CB 3.36Å; A143-Y147 PolarHBondContact O-N 2.75Å; A143-V173 HydrophobicContact CB-CG1 3.96Å; A143-R179 HydrophobicContact CB-CB 4.2Å
144	N	97.6	Very high	95.6	Very high	76 Å²	76	53 Å²	53	41%	0.406	29%	0.288	S	S	.	.	H	α-helix	trans	-69	-33.9	178.6	-70.8	-6	0	0	0	113.2	K140 L141 L142 Q148	K140-N144 VanDerWaalsContact CE-OD1 3.28Å; K140-N144 WeakPolarHBondContact CE-OD1 3.3Å; K140-N144 PolarHBondContact NZ-OD1 2.96Å; K140-N144 VanDerWaalsContact NZ-OD1 3.07Å; K140-N144 WeakPolarHBondContact O-CB 3.16Å; K140-N144 PolarHBondContact O-N 3.37Å; K140-N144 PolarHBondContact O-OD1 3.18Å; L141-N144 PolarHBondContact O-N 3.5Å; L142-N144 VanDerWaalsContact C-N 3.27Å; L142-N144 PolarHBondContact O-N 3.12Å; N144-Q148 WeakPolarHBondContact O-CG 3.35Å
145	M	96.1	Very high	95.3	Very high	34 Å²	34	52.5 Å²	52.5	17%	0.167	28%	0.284	C	S	.	.	H	α-helix	trans	-67.6	-47.1	175.1	-72.4	-174.1	-64	0	0	110.8	W114 L117 L118 L141 L142 Q148	W114-M145 HydrophobicContact CE3-CB 4.24Å; W114-M145 HydrophobicContact CZ3-CB 4Å; L117-M145 HydrophobicContact CD2-SD 3.98Å; L117-M145 HydrophobicContact CG-SD 4.22Å; L118-M145 HydrophobicContact CB-CE 4.27Å; L118-M145 HydrophobicContact CD1-CE 4.23Å; L141-M145 WeakPolarHBondContact O-CG 3.2Å; L141-M145 PolarHBondContact O-N 3.39Å; L142-M145 HydrophobicContact CD1-CE 4.05Å; L142-M145 PolarHBondContact O-N 3.4Å; L142-M145 VanDerWaalsContact O-N 3.12Å; M145-Q148 WeakPolarHBondContact O-CB 3.4Å; M145-Q148 PolarHBondContact O-N 3.36Å
146	V	94.9	Very high	95.1	Very high	1 Å²	1	52.7 Å²	52.7	1%	0.006	29%	0.285	C	S	.	.	H	α-helix	trans	-69.8	-38.1	-175.8	174.2	0	0	0	0	111.3	W114 L142 Q148 Y149 L154 M156	W114-V146 HydrophobicContact CD2-CG2 4.49Å; W114-V146 HydrophobicContact CG-CG2 4.44Å; L142-V146 HydrophobicContact CD1-CG2 3.96Å; L142-V146 HydrophobicContact CG-CG2 4.3Å; L142-V146 VanDerWaalsContact O-CG2 3.28Å; L142-V146 WeakPolarHBondContact O-CG2 3.45Å; L142-V146 PolarHBondContact O-N 2.83Å; V146-Q148 PolarHBondContact O-N 3.19Å; V146-Q148 VanDerWaalsContact O-N 3.14Å; V146-Y149 PolarHBondContact O-N 3.21Å; V146-L154 HydrophobicContact CG1-CD1 4.24Å; V146-M156 HydrophobicContact CB-CE 4.37Å; V146-M156 HydrophobicContact CG1-CE 4.21Å; V146-M156 HydrophobicContact CG2-CE 3.47Å; V146-M156 VanDerWaalsContact CG2-CE 3.47Å; V146-M156 HydrophobicContact CG2-SD 4.41Å
147	Y	95.8	Very high	94.9	Very high	135 Å²	135	51.9 Å²	51.9	53%	0.529	28%	0.279	S	S	.	.	H	α-helix	trans	-60.7	-25.3	179.1	-171.7	-103.3	0	0	0	113.7	A143 Y149 K150	A143-Y147 WeakPolarHBondContact O-CB 3.36Å; A143-Y147 PolarHBondContact O-N 2.75Å; Y147-Y149 PolarHBondContact O-N 2.96Å; Y147-K150 HydrophobicContact CD2-CB 4.45Å; Y147-K150 HydrophobicContact CD2-CD 4.03Å; Y147-K150 HydrophobicContact CE2-CD 3.6Å; Y147-K150 WeakPolarHBondContact O-CB 3.43Å; Y147-K150 PolarHBondContact O-N 3.14Å
148	Q	95.9	Very high	94.9	Very high	140 Å²	140	50.4 Å²	50.4	65%	0.654	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-20.3	175.1	-66.7	173.5	18.4	0	0	113	N144 M145 V146	N144-Q148 WeakPolarHBondContact O-CG 3.35Å; M145-Q148 WeakPolarHBondContact O-CB 3.4Å; M145-Q148 PolarHBondContact O-N 3.36Å; V146-Q148 PolarHBondContact O-N 3.19Å; V146-Q148 VanDerWaalsContact O-N 3.14Å
149	Y	94.2	Very high	94.9	Very high	99 Å²	99	50.4 Å²	50.4	39%	0.388	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.7	18.3	-179.2	-65.5	-93.9	0	0	0	111.7	W114 V146 Y147 G151 M152 L154	W114-Y149 AromaticContact CH2-CD2 3.85Å; W114-Y149 HydrophobicContact CH2-CD2 3.85Å; W114-Y149 AromaticContact CH2-CE2 3.47Å; W114-Y149 HydrophobicContact CH2-CE2 3.47Å; W114-Y149 VanDerWaalsContact CH2-CE2 3.47Å; W114-Y149 AromaticContact CZ2-CD2 3.89Å; W114-Y149 HydrophobicContact CZ2-CD2 3.89Å; W114-Y149 AromaticContact CZ2-CE2 3.88Å; W114-Y149 HydrophobicContact CZ2-CE2 3.88Å; W114-Y149 HydrophobicContact CZ2-CG 4.42Å; V146-Y149 PolarHBondContact O-N 3.21Å; Y147-Y149 PolarHBondContact O-N 2.96Å; Y149-G151 PolarHBondContact O-N 2.98Å; Y149-M152 HydrophobicContact CD1-SD 3.63Å; Y149-M152 HydrophobicContact CE1-SD 4.44Å; Y149-M152 HydrophobicContact CG-SD 4.33Å; Y149-M152 WeakPolarHBondContact O-CB 3.15Å; Y149-M152 PolarHBondContact O-N 3.32Å; Y149-L154 VanDerWaalsContact CB-CD1 3.42Å; Y149-L154 HydrophobicContact CG-CD1 4.16Å
150	K	91.9	Very high	94.9	Very high	96 Å²	96	50.4 Å²	50.4	42%	0.417	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	131.9	176.5	-178.4	165.4	-175.2	143.5	0	110.4	Y147 M152 E176	Y147-K150 HydrophobicContact CD2-CB 4.45Å; Y147-K150 HydrophobicContact CD2-CD 4.03Å; Y147-K150 HydrophobicContact CE2-CD 3.6Å; Y147-K150 WeakPolarHBondContact O-CB 3.43Å; Y147-K150 PolarHBondContact O-N 3.14Å; K150-M152 VanDerWaalsContact C-N 3.3Å; K150-E176 WeakPolarHBondContact CE-OE2 3.14Å; K150-E176 PolarHBondContact NZ-O 3.23Å; K150-E176 IonicContact NZ-OE2 2.58Å; K150-E176 PolarHBondContact NZ-OE2 3.4Å
151	G	89.6	Confident	94.9	Very high	61 Å²	61	45.5 Å²	45.5	63%	0.629	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.9	-0.1	-176.8	0	0	0	0	0	115.1	Y149 G153	Y149-G151 PolarHBondContact O-N 2.98Å; G151-G153 VanDerWaalsContact C-N 3.34Å
152	M	92.6	Very high	94.9	Very high	131 Å²	131	42.9 Å²	42.9	65%	0.645	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.7	15.8	178.4	-56.1	-172.7	-172.7	0	0	113.7	Y149 K150	Y149-M152 HydrophobicContact CD1-SD 3.63Å; Y149-M152 HydrophobicContact CE1-SD 4.44Å; Y149-M152 HydrophobicContact CG-SD 4.33Å; Y149-M152 WeakPolarHBondContact O-CB 3.15Å; Y149-M152 PolarHBondContact O-N 3.32Å; K150-M152 VanDerWaalsContact C-N 3.3Å
153	G	89.9	Confident	94.9	Very high	56 Å²	56	46 Å²	46	58%	0.577	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	77.4	21.8	177.6	0	0	0	0	0	115.6	G151	G151-G153 VanDerWaalsContact C-N 3.34Å
154	L	91.8	Very high	94.7	Very high	36 Å²	36	47.2 Å²	47.2	19%	0.188	25%	0.25	C	C	.	.			trans	-68	138.7	170	-72.1	-173.4	0	0	0	110.8	W114 V146 Y149 S175	W114-L154 HydrophobicContact CZ2-CD1 4.38Å; V146-L154 HydrophobicContact CG1-CD1 4.24Å; Y149-L154 VanDerWaalsContact CB-CD1 3.42Å; Y149-L154 HydrophobicContact CG-CD1 4.16Å; L154-S175 VanDerWaalsContact O-CB 3.22Å; L154-S175 WeakPolarHBondContact O-CB 3.48Å; L154-S175 PolarHBondContact O-OG 3.11Å
155	S	92.1	Very high	94.3	Very high	21 Å²	21	51.3 Å²	51.3	15%	0.147	26%	0.264	C	S	.	.			trans	-125.7	103.4	175.2	-170.6	0	0	0	0	110.6	H58 G107 D110	H58-S155 PolarHBondContact NE2-OG 3.38Å; G107-S155 PolarHBondContact N-O 3.1Å; D110-S155 PolarHBondContact OD2-N 3.05Å
156	M	92.1	Very high	94.1	Very high	6 Å²	6	61 Å²	61	3%	0.03	30%	0.298	C	S	.	.	B	Isolated β-bridge	trans	-147.3	129.7	-178.7	-168.7	-176.4	72.2	0	0	109.8	C111 W114 L142 V146 T158 V173 D174 S175	C111-M156 HydrophobicContact CB-CG 4.44Å; W114-M156 HydrophobicContact CB-SD 4.08Å; L142-M156 HydrophobicContact CD1-CE 4.26Å; L142-M156 HydrophobicContact CD2-CE 4.07Å; L142-M156 HydrophobicContact CG-CE 4.12Å; V146-M156 HydrophobicContact CB-CE 4.37Å; V146-M156 HydrophobicContact CG1-CE 4.21Å; V146-M156 HydrophobicContact CG2-CE 3.47Å; V146-M156 VanDerWaalsContact CG2-CE 3.47Å; V146-M156 HydrophobicContact CG2-SD 4.41Å; M156-T158 HydrophobicContact CE-CG2 3.8Å; M156-T158 HydrophobicContact CG-CG2 4.19Å; M156-T158 HydrophobicContact SD-CG2 4.01Å; M156-V173 HydrophobicContact CE-CG1 4.39Å; M156-D174 CarbonylContact O-C 3.6Å; M156-D174 WeakPolarHBondContact O-CA 3.23Å; M156-S175 PolarHBondContact O-N 2.88Å
157	G	94.3	Very high	94.1	Very high	5 Å²	5	61.7 Å²	61.7	5%	0.052	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	92.4	169.1	0	0	0	0	0	108.1	A105	A105-G157 WeakPolarHBondContact CB-O 3.43Å; A105-G157 PolarHBondContact O-N 3.3Å
158	T	96.8	Very high	94.2	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	146.8	-174.2	-178	0	0	0	0	111.7	T103 E115 L142 M156 I160 V173	T103-T158 PolarHBondContact N-OG1 2.69Å; T103-T158 VanDerWaalsContact O-CA 3.27Å; T103-T158 WeakPolarHBondContact O-CA 3.2Å; T103-T158 WeakPolarHBondContact O-CB 3.5Å; T103-T158 PolarHBondContact O-OG1 2.77Å; E115-T158 WeakPolarHBondContact OE1-CB 3.28Å; E115-T158 PolarHBondContact OE1-OG1 2.94Å; L142-T158 HydrophobicContact CD2-CG2 3.57Å; M156-T158 HydrophobicContact CE-CG2 3.8Å; M156-T158 HydrophobicContact CG-CG2 4.19Å; M156-T158 HydrophobicContact SD-CG2 4.01Å; T158-I160 HydrophobicContact CG2-CD1 4.29Å; T158-V173 HydrophobicContact CG2-CB 4.25Å; T158-V173 PolarHBondContact N-O 3.2Å; T158-V173 PolarHBondContact O-N 3.27Å; T158-V173 VanDerWaalsContact O-O 3.14Å
159	M	98.3	Very high	94.3	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	121.3	172.4	-64.2	174.8	-70.7	0	0	108.9	T62 A64 G102 T103 L170 Y171 Y172 F185 V187	T62-M159 VanDerWaalsContact OG1-CE 3.26Å; T62-M159 WeakPolarHBondContact OG1-CE 3.38Å; A64-M159 HydrophobicContact CB-CE 4.16Å; A64-M159 HydrophobicContact CB-SD 3.81Å; G102-M159 WeakPolarHBondContact CA-O 3.19Å; T103-M159 HydrophobicContact CG2-CB 4.21Å; T103-M159 HydrophobicContact CG2-CE 3.8Å; T103-M159 PolarHBondContact N-O 3.4Å; T103-M159 WeakPolarHBondContact OG1-CE 3.4Å; T103-M159 PolarHBondContact OG1-N 3.38Å; M159-L170 HydrophobicContact CB-CD1 4.32Å; M159-Y171 CarbonylContact C-O 3.47Å; M159-Y171 VanDerWaalsContact CA-O 3.25Å; M159-Y171 WeakPolarHBondContact CA-O 3.37Å; M159-Y172 HydrophobicContact CG-CD2 4.25Å; M159-F185 HydrophobicContact CG-CB 4.3Å; M159-F185 HydrophobicContact SD-CB 3.41Å; M159-F185 WeakPolarHBondContact SD-CB 3.22Å; M159-F185 HydrophobicContact SD-CG 4.45Å; M159-V187 HydrophobicContact CE-CG2 4.24Å; M159-V187 HydrophobicContact CG-CG2 4.11Å; M159-V187 HydrophobicContact SD-CG2 4.01Å
160	I	98.4	Very high	94.5	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	113	174.3	-53	-56.5	0	0	0	108.3	I96 L100 L118 V135 L142 T158 Y171 V173	I96-I160 HydrophobicContact CD1-CD1 3.94Å; L100-I160 HydrophobicContact CD2-CG2 4.44Å; L118-I160 HydrophobicContact CD2-CD1 4.14Å; V135-I160 HydrophobicContact CG1-CG2 4.05Å; L142-I160 HydrophobicContact CD2-CD1 3.86Å; L142-I160 HydrophobicContact CD2-CG1 4.19Å; T158-I160 HydrophobicContact CG2-CD1 4.29Å; I160-Y171 PolarHBondContact N-O 3.12Å; I160-Y171 PolarHBondContact O-N 3.41Å; I160-V173 HydrophobicContact CG1-CG2 4.49Å
161	C	98.2	Very high	94.8	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	138.4	-175.7	-51.4	0	0	0	0	109.7	V71 V73 L100 L101 L170 V238	V71-C161 HydrophobicContact CG1-CB 4.19Å; V73-C161 HydrophobicContact CG2-CB 3.87Å; V73-C161 VanDerWaalsContact CG2-SG 3.6Å; L100-C161 WeakPolarHBondContact CA-O 3.46Å; L101-C161 HydrophobicContact CB-CB 4.33Å; L101-C161 PolarHBondContact N-O 3.48Å; L101-C161 PolarHBondContact O-N 2.9Å; C161-L170 WeakPolarHBondContact SG-CD1 3.48Å; C161-V238 HydrophobicContact CB-CG2 4.37Å
162	G	97.8	Very high	95.2	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.7	176.7	177.7	0	0	0	0	0	112.4	Y99 G169	Y99-G162 WeakPolarHBondContact O-CA 3.4Å; G162-G169 PolarHBondContact N-O 3.13Å; G162-G169 PolarHBondContact O-N 3.21Å
163	W	96.8	Very high	95.5	Very high	65 Å²	65	36.7 Å²	36.7	25%	0.246	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	126	168.5	-162.8	-76.8	0	0	0	109.7	P168 R239 E240	W163-P168 HydrophobicContact CD2-CG 4.41Å; W163-P168 HydrophobicContact CE3-CB 4.45Å; W163-P168 HydrophobicContact CE3-CG 3.87Å; W163-P168 HydrophobicContact CH2-CG 3.9Å; W163-P168 HydrophobicContact CZ2-CG 4.43Å; W163-P168 HydrophobicContact CZ3-CG 3.63Å; W163-R239 WeakPolarHBondContact CB-O 3.21Å; W163-E240 HydrophobicContact CD2-CB 3.87Å; W163-E240 HydrophobicContact CD2-CG 4.42Å; W163-E240 HydrophobicContact CE3-CB 4.31Å; W163-E240 HydrophobicContact CG-CB 4.19Å; W163-E240 HydrophobicContact CG-CG 4.42Å; W163-E240 HydrophobicContact CH2-CB 4.43Å; W163-E240 HydrophobicContact CZ2-CB 3.99Å; W163-E240 HydrophobicContact CZ2-CG 4.43Å
164	D	92.6	Very high	95.7	Very high	30 Å²	30	34.8 Å²	34.8	16%	0.16	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	172.2	-180	-161.9	3.6	0	0	0	110.5	S134 V135 R166 G167	S134-D164 VanDerWaalsContact CB-OD1 3.25Å; S134-D164 WeakPolarHBondContact CB-OD1 3.48Å; S134-D164 VanDerWaalsContact CB-OD2 3.28Å; S134-D164 WeakPolarHBondContact CB-OD2 3.33Å; V135-D164 HydrophobicContact CG2-CB 4.1Å; D164-R166 PolarHBondContact O-N 3.42Å; D164-G167 PolarHBondContact N-O 3.49Å; D164-G167 PolarHBondContact O-N 3.15Å
165	K	91.3	Very high	95.7	Very high	161 Å²	161	34 Å²	34	70%	0.7	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-21.1	171.3	-66	177.8	170.9	-179.8	0	113.3	E131	E131-K165 WeakPolarHBondContact OE1-CE 3.49Å; E131-K165 IonicContact OE1-NZ 2.85Å; E131-K165 PolarHBondContact OE1-NZ 3.46Å; E131-K165 IonicContact OE2-NZ 3.87Å; E131-K165 PolarHBondContact OE2-NZ 3.02Å
166	R	91.3	Very high	95.7	Very high	238 Å²	238	37.6 Å²	37.6	90%	0.898	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.4	9.1	178	-59.9	-180	-177.5	173.1	0.5	113	D164	D164-R166 PolarHBondContact O-N 3.42Å
167	G	95.3	Very high	95.5	Very high	15 Å²	15	38.5 Å²	38.5	16%	0.155	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	95.9	-159.3	-175.9	0	0	0	0	0	113.6	D164 G169	D164-G167 PolarHBondContact N-O 3.49Å; D164-G167 PolarHBondContact O-N 3.15Å; G167-G169 PolarHBondContact O-N 3.11Å
168	P	97.3	Very high	95.5	Very high	35 Å²	35	42.4 Å²	42.4	23%	0.227	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.9	124	-177.3	-22	31.7	0	0	0	112.7	K66 V71 W163	K66-P168 HydrophobicContact CB-CB 4.38Å; V71-P168 HydrophobicContact CG2-CB 3.81Å; W163-P168 HydrophobicContact CD2-CG 4.41Å; W163-P168 HydrophobicContact CE3-CB 4.45Å; W163-P168 HydrophobicContact CE3-CG 3.87Å; W163-P168 HydrophobicContact CH2-CG 3.9Å; W163-P168 HydrophobicContact CZ2-CG 4.43Å; W163-P168 HydrophobicContact CZ3-CG 3.63Å
169	G	97.5	Very high	95.5	Very high	10 Å²	10	46 Å²	46	10%	0.103	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	129.7	177.9	0	0	0	0	0	111.7	G162 G167	G162-G169 PolarHBondContact N-O 3.13Å; G162-G169 PolarHBondContact O-N 3.21Å; G167-G169 PolarHBondContact O-N 3.11Å
170	L	98.4	Very high	95.5	Very high	4 Å²	4	50.1 Å²	50.1	2%	0.021	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	119.2	176	175.7	61.1	0	0	0	109.6	A64 M159 C161 S181 G182 F185	A64-L170 HydrophobicContact CB-CD1 3.74Å; A64-L170 HydrophobicContact CB-CD2 4.31Å; M159-L170 HydrophobicContact CB-CD1 4.32Å; C161-L170 WeakPolarHBondContact SG-CD1 3.48Å; L170-S181 WeakPolarHBondContact O-CA 3.27Å; L170-G182 PolarHBondContact O-N 2.96Å; L170-F185 HydrophobicContact CD1-CD2 4.2Å; L170-F185 HydrophobicContact CD2-CD2 3.8Å; L170-F185 HydrophobicContact CD2-CE2 4.36Å; L170-F185 HydrophobicContact CG-CD2 3.72Å; L170-F185 HydrophobicContact CG-CE2 4.04Å
171	Y	98.6	Very high	95.5	Very high	41 Å²	41	54.1 Å²	54.1	16%	0.161	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	137	-180	-69.6	-94.1	0	0	0	110.5	V135 A136 M159 I160 R179 I180	V135-Y171 HydrophobicContact CB-CD2 4.47Å; V135-Y171 HydrophobicContact CB-CE2 4.35Å; V135-Y171 HydrophobicContact CG1-CD2 3.79Å; V135-Y171 HydrophobicContact CG1-CE2 4.14Å; A136-Y171 HydrophobicContact CB-CE2 4.2Å; A136-Y171 WeakPolarHBondContact CB-OH 3.26Å; M159-Y171 CarbonylContact C-O 3.47Å; M159-Y171 VanDerWaalsContact CA-O 3.25Å; M159-Y171 WeakPolarHBondContact CA-O 3.37Å; I160-Y171 PolarHBondContact N-O 3.12Å; I160-Y171 PolarHBondContact O-N 3.41Å; Y171-R179 HydrophobicContact CD1-CG 4.49Å; Y171-I180 CarbonylContact C-O 3.59Å; Y171-I180 WeakPolarHBondContact CA-O 3.43Å
172	Y	98.3	Very high	95.4	Very high	48 Å²	48	54.8 Å²	54.8	19%	0.188	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	134.5	166.9	172.3	-109.4	0	0	0	109.5	M159 D174 R179 I180 V187	M159-Y172 HydrophobicContact CG-CD2 4.25Å; Y172-D174 HydrophobicContact CE1-CB 4.02Å; Y172-R179 WeakPolarHBondContact O-CA 3.18Å; Y172-I180 HydrophobicContact CD1-CD1 4.08Å; Y172-I180 HydrophobicContact CD1-CG1 3.98Å; Y172-I180 HydrophobicContact CG-CG1 4.47Å; Y172-I180 PolarHBondContact N-O 2.9Å; Y172-I180 PolarHBondContact O-N 3.15Å; Y172-I180 VanDerWaalsContact O-N 3.1Å; Y172-V187 HydrophobicContact CD2-CG2 3.76Å; Y172-V187 HydrophobicContact CE2-CB 4.47Å; Y172-V187 HydrophobicContact CE2-CG1 3.99Å; Y172-V187 HydrophobicContact CE2-CG2 3.55Å
173	V	97.8	Very high	95.4	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	131.1	177.1	-178.1	0	0	0	0	109	L142 A143 M156 T158 I160 N178 R179	L142-V173 HydrophobicContact CD2-CB 4.44Å; L142-V173 HydrophobicContact CD2-CG1 4.32Å; L142-V173 HydrophobicContact CG-CG1 4.27Å; A143-V173 HydrophobicContact CB-CG1 3.96Å; M156-V173 HydrophobicContact CE-CG1 4.39Å; T158-V173 HydrophobicContact CG2-CB 4.25Å; T158-V173 PolarHBondContact N-O 3.2Å; T158-V173 PolarHBondContact O-N 3.27Å; T158-V173 VanDerWaalsContact O-O 3.14Å; I160-V173 HydrophobicContact CG1-CG2 4.49Å; V173-N178 WeakPolarHBondContact CA-O 3.2Å; V173-R179 HydrophobicContact CG2-CG 4.24Å
174	D	94.6	Very high	95.4	Very high	16 Å²	16	54.9 Å²	54.9	9%	0.086	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	173.1	176.6	70.5	17.3	0	0	0	114.1	M156 Y172 E176 G177 N178	M156-D174 CarbonylContact O-C 3.6Å; M156-D174 WeakPolarHBondContact O-CA 3.23Å; Y172-D174 HydrophobicContact CE1-CB 4.02Å; D174-E176 PolarHBondContact O-N 3.11Å; D174-E176 WeakPolarHBondContact OD1-CA 3.4Å; D174-E176 WeakPolarHBondContact OD1-CB 3.46Å; D174-E176 PolarHBondContact OD1-N 3.46Å; D174-G177 PolarHBondContact O-N 3.31Å; D174-G177 PolarHBondContact OD1-N 3.4Å; D174-N178 PolarHBondContact N-O 2.87Å; D174-N178 WeakPolarHBondContact OD1-CA 3.45Å; D174-N178 VanDerWaalsContact OD1-CB 3.31Å; D174-N178 WeakPolarHBondContact OD1-CB 3.33Å; D174-N178 PolarHBondContact OD1-N 3.35Å; D174-N178 PolarHBondContact OD1-ND2 3.08Å; D174-N178 VanDerWaalsContact OD2-CB 3.3Å; D174-N178 WeakPolarHBondContact OD2-CB 3.41Å; D174-N178 PolarHBondContact OD2-ND2 2.86Å
175	S	92.8	Very high	95.7	Very high	20 Å²	20	54.5 Å²	54.5	14%	0.14	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-19	176.7	47.7	0	0	0	0	113.9	L154 M156 G177	L154-S175 VanDerWaalsContact O-CB 3.22Å; L154-S175 WeakPolarHBondContact O-CB 3.48Å; L154-S175 PolarHBondContact O-OG 3.11Å; M156-S175 PolarHBondContact O-N 2.88Å; S175-G177 VanDerWaalsContact C-N 3.26Å; S175-G177 PolarHBondContact O-N 3.46Å
176	E	91	Very high	96	Very high	95 Å²	95	47.1 Å²	47.1	44%	0.444	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-8.4	177	-69.6	-53	126.8	0	0	113.4	K150 D174	K150-E176 WeakPolarHBondContact CE-OE2 3.14Å; K150-E176 PolarHBondContact NZ-O 3.23Å; K150-E176 IonicContact NZ-OE2 2.58Å; K150-E176 PolarHBondContact NZ-OE2 3.4Å; D174-E176 PolarHBondContact O-N 3.11Å; D174-E176 WeakPolarHBondContact OD1-CA 3.4Å; D174-E176 WeakPolarHBondContact OD1-CB 3.46Å; D174-E176 PolarHBondContact OD1-N 3.46Å
177	G	88.3	Confident	96.2	Very high	26 Å²	26	36.5 Å²	36.5	27%	0.268	21%	0.211	S	C	.	.			trans	91.6	8.8	-178.3	0	0	0	0	0	113.6	D174 S175	D174-G177 PolarHBondContact O-N 3.31Å; D174-G177 PolarHBondContact OD1-N 3.4Å; S175-G177 VanDerWaalsContact C-N 3.26Å; S175-G177 PolarHBondContact O-N 3.46Å
178	N	94.6	Very high	96.2	Very high	86 Å²	86	36.7 Å²	36.7	46%	0.46	21%	0.213	S	C	.	.			trans	-66.2	138.6	173.4	-61.9	-50.3	0	0	0	109.3	V173 D174	V173-N178 WeakPolarHBondContact CA-O 3.2Å; D174-N178 PolarHBondContact N-O 2.87Å; D174-N178 WeakPolarHBondContact OD1-CA 3.45Å; D174-N178 VanDerWaalsContact OD1-CB 3.31Å; D174-N178 WeakPolarHBondContact OD1-CB 3.33Å; D174-N178 PolarHBondContact OD1-N 3.35Å; D174-N178 PolarHBondContact OD1-ND2 3.08Å; D174-N178 VanDerWaalsContact OD2-CB 3.3Å; D174-N178 WeakPolarHBondContact OD2-CB 3.41Å; D174-N178 PolarHBondContact OD2-ND2 2.86Å
179	R	97.8	Very high	96	Very high	77 Å²	77	37 Å²	37	29%	0.291	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	106.4	174.1	179.2	-176.5	166.5	-76.8	3.8	109.1	A136 S139 A143 Y171 Y172 V173	A136-R179 PolarHBondContact O-NH2 3.48Å; S139-R179 PolarHBondContact OG-NE 2.96Å; S139-R179 PolarHBondContact OG-NH2 2.7Å; S139-R179 VanDerWaalsContact OG-NH2 3.16Å; A143-R179 HydrophobicContact CB-CB 4.2Å; Y171-R179 HydrophobicContact CD1-CG 4.49Å; Y172-R179 WeakPolarHBondContact O-CA 3.18Å; V173-R179 HydrophobicContact CG2-CG 4.24Å
180	I	98	Very high	95.8	Very high	86 Å²	86	36.5 Å²	36.5	44%	0.441	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	140.4	-177.2	58.9	175.2	0	0	0	110.3	Y171 Y172 F185	Y171-I180 CarbonylContact C-O 3.59Å; Y171-I180 WeakPolarHBondContact CA-O 3.43Å; Y172-I180 HydrophobicContact CD1-CD1 4.08Å; Y172-I180 HydrophobicContact CD1-CG1 3.98Å; Y172-I180 HydrophobicContact CG-CG1 4.47Å; Y172-I180 PolarHBondContact N-O 2.9Å; Y172-I180 PolarHBondContact O-N 3.15Å; Y172-I180 VanDerWaalsContact O-N 3.1Å; I180-F185 HydrophobicContact CD1-CE1 3.66Å; I180-F185 HydrophobicContact CD1-CZ 4Å; I180-F185 HydrophobicContact CG1-CE1 4.01Å; I180-F185 HydrophobicContact CG1-CZ 3.83Å
181	S	97.8	Very high	95.7	Very high	83 Å²	83	37.3 Å²	37.3	58%	0.58	22%	0.217	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-92.2	139.1	169.3	58	0	0	0	0	109.1	L170	L170-S181 WeakPolarHBondContact O-CA 3.27Å
182	G	95.6	Very high	95.6	Very high	15 Å²	15	40.1 Å²	40.1	16%	0.155	24%	0.238	C	C	.	.			trans	-144.5	-177	-177.7	0	0	0	0	0	112.9	K66 L170 F185	K66-G182 WeakPolarHBondContact CD-O 3.1Å; K66-G182 WeakPolarHBondContact CE-O 3.39Å; K66-G182 PolarHBondContact NZ-O 3.31Å; L170-G182 PolarHBondContact O-N 2.96Å; G182-F185 VanDerWaalsContact CA-CE2 3.49Å; G182-F185 VanDerWaalsContact CA-CZ 3.46Å
183	A	97.1	Very high	95.5	Very high	34 Å²	34	43 Å²	43	28%	0.281	25%	0.249	S	C	.	.	S	Bend	trans	-104.3	-37.2	171.9	0	0	0	0	0	111.9	F65 K66	F65-A183 CarbonylContact C-O 3.49Å; F65-A183 WeakPolarHBondContact CA-O 3.28Å; K66-A183 HydrophobicContact CD-CB 4.34Å; K66-A183 HydrophobicContact CG-CB 4.2Å; K66-A183 PolarHBondContact N-O 2.77Å
184	T	98.1	Very high	95.5	Very high	33 Å²	33	43 Å²	43	20%	0.202	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	138.9	180	50.9	0	0	0	0	108.1	F65 M198 Y202	F65-T184 HydrophobicContact CB-CG2 3.72Å; T184-M198 HydrophobicContact CG2-CE 4.47Å; T184-M198 HydrophobicContact CG2-SD 4.29Å; T184-Y202 HydrophobicContact CG2-CD1 4.12Å; T184-Y202 HydrophobicContact CG2-CD2 3.93Å; T184-Y202 HydrophobicContact CG2-CE1 4.1Å; T184-Y202 HydrophobicContact CG2-CE2 3.92Å; T184-Y202 HydrophobicContact CG2-CG 4.03Å
185	F	98.4	Very high	95.7	Very high	21 Å²	21	45.5 Å²	45.5	9%	0.092	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	147.6	171.9	-70.4	-61	0	0	0	109.5	L63 A64 M159 L170 I180 G182	L63-F185 CarbonylContact C-O 3.57Å; L63-F185 VanDerWaalsContact CA-O 3.26Å; L63-F185 WeakPolarHBondContact CA-O 3.26Å; A64-F185 PolarHBondContact N-O 3.39Å; A64-F185 PolarHBondContact O-N 3.24Å; M159-F185 HydrophobicContact CG-CB 4.3Å; M159-F185 HydrophobicContact SD-CB 3.41Å; M159-F185 WeakPolarHBondContact SD-CB 3.22Å; M159-F185 HydrophobicContact SD-CG 4.45Å; L170-F185 HydrophobicContact CD1-CD2 4.2Å; L170-F185 HydrophobicContact CD2-CD2 3.8Å; L170-F185 HydrophobicContact CD2-CE2 4.36Å; L170-F185 HydrophobicContact CG-CD2 3.72Å; L170-F185 HydrophobicContact CG-CE2 4.04Å; I180-F185 HydrophobicContact CD1-CE1 3.66Å; I180-F185 HydrophobicContact CD1-CZ 4Å; I180-F185 HydrophobicContact CG1-CE1 4.01Å; I180-F185 HydrophobicContact CG1-CZ 3.83Å; G182-F185 VanDerWaalsContact CA-CE2 3.49Å; G182-F185 VanDerWaalsContact CA-CZ 3.46Å
186	S	97.6	Very high	95.9	Very high	6 Å²	6	47 Å²	47	4%	0.042	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	139.3	164.6	-172.8	0	0	0	0	109.6	T62 S191 A194 Y195	T62-S186 CarbonylContact O-C 3.54Å; T62-S186 WeakPolarHBondContact O-CA 3.29Å; T62-S186 PolarHBondContact O-OG 2.84Å; S186-S191 VanDerWaalsContact OG-CA 3.25Å; S186-S191 WeakPolarHBondContact OG-CA 3.25Å; S186-S191 WeakPolarHBondContact OG-CB 3.39Å; S186-A194 WeakPolarHBondContact OG-CB 3.25Å; S186-Y195 VanDerWaalsContact N-CZ 3.26Å; S186-Y195 PolarHBondContact N-OH 3.02Å; S186-Y195 PolarHBondContact O-OH 3.48Å
187	V	96.4	Very high	96.1	Very high	16 Å²	16	44.3 Å²	44.3	10%	0.097	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	144	-172.7	-167.8	0	0	0	0	110	T62 A105 M159 Y172	T62-V187 PolarHBondContact N-O 3.21Å; T62-V187 PolarHBondContact O-N 2.57Å; T62-V187 PolarHBondContact OG1-O 2.87Å; A105-V187 HydrophobicContact CB-CB 4.18Å; A105-V187 HydrophobicContact CB-CG1 3.74Å; M159-V187 HydrophobicContact CE-CG2 4.24Å; M159-V187 HydrophobicContact CG-CG2 4.11Å; M159-V187 HydrophobicContact SD-CG2 4.01Å; Y172-V187 HydrophobicContact CD2-CG2 3.76Å; Y172-V187 HydrophobicContact CE2-CB 4.47Å; Y172-V187 HydrophobicContact CE2-CG1 3.99Å; Y172-V187 HydrophobicContact CE2-CG2 3.55Å
188	G	93.7	Very high	96.6	Very high	18 Å²	18	43.1 Å²	43.1	19%	0.186	25%	0.254	C	S	.	.	S	Bend	trans	108.5	179.5	-179.8	0	0	0	0	0	113.4	T60 G190 S191	T60-G188 CarbonylContact O-C 3.42Å; T60-G188 WeakPolarHBondContact O-CA 3.22Å; G188-G190 VanDerWaalsContact C-N 3.32Å; G188-G190 PolarHBondContact O-N 3.28Å; G188-S191 WeakPolarHBondContact O-CB 3.45Å; G188-S191 PolarHBondContact O-N 3.3Å; G188-S191 VanDerWaalsContact O-N 3.11Å; G188-S191 PolarHBondContact O-OG 3.49Å
189	S	93.5	Very high	96.7	Very high	41 Å²	41	43.4 Å²	43.4	29%	0.287	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-41.3	-177	51.2	0	0	0	0	114.1	H58 T60 S191 D226	H58-S189 WeakPolarHBondContact O-CB 3.42Å; H58-S189 PolarHBondContact O-N 2.77Å; H58-S189 VanDerWaalsContact O-N 3.15Å; H58-S189 PolarHBondContact O-OG 2.92Å; T60-S189 PolarHBondContact N-OG 3.26Å; T60-S189 PolarHBondContact O-N 2.84Å; T60-S189 PolarHBondContact O-OG 3.26Å; S189-S191 VanDerWaalsContact C-N 3.34Å; S189-D226 WeakPolarHBondContact CB-OD2 3.35Å; S189-D226 PolarHBondContact OG-OD2 3.32Å
190	G	94.5	Very high	96.7	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	8.2	-178.9	0	0	0	0	0	114.6	T60 T61 G188 V192 Y193 A194 D226	T60-G190 PolarHBondContact O-N 3.1Å; T61-G190 WeakPolarHBondContact OG1-CA 3.44Å; T61-G190 PolarHBondContact OG1-N 2.77Å; G188-G190 VanDerWaalsContact C-N 3.32Å; G188-G190 PolarHBondContact O-N 3.28Å; G190-V192 VanDerWaalsContact C-N 3.31Å; G190-V192 PolarHBondContact O-N 3.35Å; G190-Y193 PolarHBondContact O-N 2.85Å; G190-Y193 VanDerWaalsContact O-N 3.11Å; G190-A194 PolarHBondContact O-N 3.31Å; G190-D226 PolarHBondContact N-OD2 2.9Å
191	S	95	Very high	96.5	Very high	22 Å²	22	48 Å²	48	15%	0.154	28%	0.279	C	S	.	.	H	α-helix	trans	-57.9	-40.3	-176.2	56.8	0	0	0	0	113.8	S186 G188 S189 Y193 A194 Y195	S186-S191 VanDerWaalsContact OG-CA 3.25Å; S186-S191 WeakPolarHBondContact OG-CA 3.25Å; S186-S191 WeakPolarHBondContact OG-CB 3.39Å; G188-S191 WeakPolarHBondContact O-CB 3.45Å; G188-S191 PolarHBondContact O-N 3.3Å; G188-S191 VanDerWaalsContact O-N 3.11Å; G188-S191 PolarHBondContact O-OG 3.49Å; S189-S191 VanDerWaalsContact C-N 3.34Å; S191-Y193 VanDerWaalsContact C-N 3.25Å; S191-Y193 PolarHBondContact O-N 3.04Å; S191-A194 WeakPolarHBondContact O-CB 3.44Å; S191-A194 PolarHBondContact O-N 3.27Å; S191-A194 VanDerWaalsContact O-N 3.13Å; S191-Y195 WeakPolarHBondContact O-CD2 3.35Å; S191-Y195 PolarHBondContact O-N 3.22Å
192	V	96.1	Very high	96.5	Very high	100 Å²	100	46.8 Å²	46.8	61%	0.606	26%	0.262	S	S	*	.	H	α-helix	trans	-62	-32.6	178.9	-63.6	0	0	0	0	112.7	G190	G190-V192 VanDerWaalsContact C-N 3.31Å; G190-V192 PolarHBondContact O-N 3.35Å
193	Y	97.4	Very high	96.6	Very high	107 Å²	107	48.8 Å²	48.8	42%	0.42	27%	0.274	S	S	.	.	H	α-helix	trans	-75.2	-37.5	175.8	-58.5	-58.8	0	0	0	111.5	G190 S191 R225 D226	G190-Y193 PolarHBondContact O-N 2.85Å; G190-Y193 VanDerWaalsContact O-N 3.11Å; S191-Y193 VanDerWaalsContact C-N 3.25Å; S191-Y193 PolarHBondContact O-N 3.04Å; Y193-R225 HydrophobicContact CD1-CB 3.98Å; Y193-R225 HydrophobicContact CD1-CG 4.34Å; Y193-R225 HydrophobicContact CD2-CB 3.91Å; Y193-R225 HydrophobicContact CE1-CB 4Å; Y193-R225 HydrophobicContact CE2-CB 3.94Å; Y193-R225 HydrophobicContact CG-CB 3.94Å; Y193-D226 HydrophobicContact CD2-CB 4.05Å; Y193-D226 HydrophobicContact CE2-CB 3.99Å
194	A	97.4	Very high	96.6	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-65.4	-41.1	177.4	0	0	0	0	0	112.1	T61 L63 S186 G190 S191 G196 V197 M198 A222	T61-A194 HydrophobicContact CG2-CB 3.99Å; L63-A194 HydrophobicContact CD2-CB 4.02Å; S186-A194 WeakPolarHBondContact OG-CB 3.25Å; G190-A194 PolarHBondContact O-N 3.31Å; S191-A194 WeakPolarHBondContact O-CB 3.44Å; S191-A194 PolarHBondContact O-N 3.27Å; S191-A194 VanDerWaalsContact O-N 3.13Å; A194-G196 PolarHBondContact O-N 2.94Å; A194-V197 PolarHBondContact O-N 3.05Å; A194-M198 VanDerWaalsContact O-CB 3.22Å; A194-M198 WeakPolarHBondContact O-CB 3.41Å; A194-M198 PolarHBondContact O-N 3.4Å; A194-A222 HydrophobicContact CB-CB 4.33Å
195	Y	97.9	Very high	96.5	Very high	69 Å²	69	55.5 Å²	55.5	27%	0.271	30%	0.296	S	S	.	.	H	α-helix	trans	-56.1	-46.8	177.5	-82.1	-63.9	0	0	0	112.5	S186 S191 V197 M198 D199	S186-Y195 VanDerWaalsContact N-CZ 3.26Å; S186-Y195 PolarHBondContact N-OH 3.02Å; S186-Y195 PolarHBondContact O-OH 3.48Å; S191-Y195 WeakPolarHBondContact O-CD2 3.35Å; S191-Y195 PolarHBondContact O-N 3.22Å; Y195-V197 VanDerWaalsContact C-N 3.27Å; Y195-V197 PolarHBondContact O-N 3.37Å; Y195-M198 HydrophobicContact CD1-CE 3.6Å; Y195-M198 HydrophobicContact CE1-CE 3.82Å; Y195-M198 PolarHBondContact O-N 3.04Å; Y195-D199 VanDerWaalsContact O-CB 3.3Å; Y195-D199 WeakPolarHBondContact O-CB 3.09Å; Y195-D199 VanDerWaalsContact O-CG 3.29Å; Y195-D199 PolarHBondContact O-N 2.9Å
196	G	96.9	Very high	96.4	Very high	53 Å²	53	55.4 Å²	55.4	55%	0.546	30%	0.296	S	S	.	.	H	α-helix	trans	-59.5	-35.2	-177	0	0	0	0	0	114.2	A194	A194-G196 PolarHBondContact O-N 2.94Å
197	V	96.9	Very high	96.4	Very high	37 Å²	37	60.9 Å²	60.9	22%	0.224	32%	0.321	C	S	.	.	H	α-helix	trans	-82.5	-43.4	178.1	-178.3	0	0	0	0	111	A194 Y195 G201 R217 A218 Q221	A194-V197 PolarHBondContact O-N 3.05Å; Y195-V197 VanDerWaalsContact C-N 3.27Å; Y195-V197 PolarHBondContact O-N 3.37Å; V197-G201 PolarHBondContact O-N 3.01Å; V197-R217 HydrophobicContact CG1-CG 4.24Å; V197-A218 HydrophobicContact CB-CB 4.32Å; V197-A218 HydrophobicContact CG1-CB 4.27Å; V197-Q221 HydrophobicContact CG2-CB 3.79Å; V197-Q221 HydrophobicContact CG2-CG 3.91Å
198	M	97.2	Very high	96.5	Very high	1 Å²	1	62 Å²	62	1%	0.005	33%	0.328	C	S	.	.	H	α-helix	trans	-62.3	-51.6	-179.9	-178.9	171.9	58.6	0	0	111	L63 F65 T184 A194 Y195 R200 G201 Y202 A218	L63-M198 HydrophobicContact CD1-SD 4.36Å; F65-M198 HydrophobicContact CB-SD 4.25Å; F65-M198 HydrophobicContact CD1-CG 4.4Å; F65-M198 HydrophobicContact CD1-SD 3.83Å; F65-M198 HydrophobicContact CG-SD 4.44Å; T184-M198 HydrophobicContact CG2-CE 4.47Å; T184-M198 HydrophobicContact CG2-SD 4.29Å; A194-M198 VanDerWaalsContact O-CB 3.22Å; A194-M198 WeakPolarHBondContact O-CB 3.41Å; A194-M198 PolarHBondContact O-N 3.4Å; Y195-M198 HydrophobicContact CD1-CE 3.6Å; Y195-M198 HydrophobicContact CE1-CE 3.82Å; Y195-M198 PolarHBondContact O-N 3.04Å; M198-R200 PolarHBondContact O-N 2.88Å; M198-G201 PolarHBondContact O-N 3.27Å; M198-G201 VanDerWaalsContact O-N 3.15Å; M198-Y202 WeakPolarHBondContact O-CB 3.47Å; M198-Y202 PolarHBondContact O-N 3.46Å; M198-A218 HydrophobicContact CB-CB 4.48Å
199	D	97.2	Very high	96.6	Very high	92 Å²	92	67.1 Å²	67.1	49%	0.492	35%	0.347	S	S	.	.	H	α-helix	trans	-65.5	-28.1	-175.5	-67.7	-19.3	0	0	0	112.5	Y195	Y195-D199 VanDerWaalsContact O-CB 3.3Å; Y195-D199 WeakPolarHBondContact O-CB 3.09Å; Y195-D199 VanDerWaalsContact O-CG 3.29Å; Y195-D199 PolarHBondContact O-N 2.9Å
200	R	97.5	Very high	96.8	Very high	223 Å²	223	69.6 Å²	69.6	84%	0.842	35%	0.354	S	S	*	.	H	α-helix	trans	-71.5	-39.2	175.5	178.9	60.9	69.8	168.2	5.4	112.6	M198	M198-R200 PolarHBondContact O-N 2.88Å
201	G	94.6	Very high	97	Very high	36 Å²	36	69.6 Å²	69.6	37%	0.371	35%	0.354	S	S	.	.	H	α-helix	trans	-98.6	-7.8	-175	0	0	0	0	0	114.7	V197 M198	V197-G201 PolarHBondContact O-N 3.01Å; M198-G201 PolarHBondContact O-N 3.27Å; M198-G201 VanDerWaalsContact O-N 3.15Å
202	Y	97.8	Very high	97.2	Very high	59 Å²	59	69.4 Å²	69.4	23%	0.231	35%	0.35	C	S	.	.			trans	-74.5	132.8	-175.5	177.5	-101.5	0	0	0	112	F65 K66 T184 M198	F65-Y202 HydrophobicContact CB-CD2 4.33Å; F65-Y202 HydrophobicContact CB-CE2 4.06Å; F65-Y202 AromaticContact CD2-CD2 3.95Å; F65-Y202 HydrophobicContact CD2-CD2 3.95Å; F65-Y202 AromaticContact CD2-CE2 3.8Å; F65-Y202 HydrophobicContact CD2-CE2 3.8Å; F65-Y202 HydrophobicContact CG-CD2 4.23Å; F65-Y202 HydrophobicContact CG-CE2 4.22Å; K66-Y202 WeakPolarHBondContact O-CE2 3.46Å; K66-Y202 PolarHBondContact O-OH 3.34Å; T184-Y202 HydrophobicContact CG2-CD1 4.12Å; T184-Y202 HydrophobicContact CG2-CD2 3.93Å; T184-Y202 HydrophobicContact CG2-CE1 4.1Å; T184-Y202 HydrophobicContact CG2-CE2 3.92Å; T184-Y202 HydrophobicContact CG2-CG 4.03Å; M198-Y202 WeakPolarHBondContact O-CB 3.47Å; M198-Y202 PolarHBondContact O-N 3.46Å
203	S	97.3	Very high	97.2	Very high	57 Å²	57	66.4 Å²	66.4	40%	0.399	33%	0.331	S	S	.	.			trans	-142.8	148.4	165.3	175.5	0	0	0	0	108.5	D205 L206	S203-D205 PolarHBondContact O-N 3.16Å; S203-D205 PolarHBondContact OG-N 3.03Å; S203-L206 WeakPolarHBondContact O-CD1 3.4Å; S203-L206 VanDerWaalsContact O-CG 3.25Å; S203-L206 WeakPolarHBondContact O-CG 3.37Å
204	Y	96.5	Very high	97.3	Very high	115 Å²	115	62 Å²	62	45%	0.451	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-31.7	178.2	-175.6	-103.3	0	0	0	112.1	R68 L206	R68-Y204 HydrophobicContact CB-CE1 4.16Å; R68-Y204 PolarHBondContact N-O 2.82Å; Y204-L206 PolarHBondContact O-N 3.36Å
205	D	97.1	Very high	97.3	Very high	92 Å²	92	62 Å²	62	49%	0.492	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	21.4	-174	-72	-57.3	0	0	0	114.5	R68 S203	R68-D205 IonicContact CZ-OD1 3.64Å; R68-D205 IonicContact NH1-OD1 3.88Å; R68-D205 PolarHBondContact NH1-OD1 3.37Å; S203-D205 PolarHBondContact O-N 3.16Å; S203-D205 PolarHBondContact OG-N 3.03Å
206	L	96.2	Very high	97.3	Very high	20 Å²	20	60 Å²	60	11%	0.105	31%	0.306	C	S	.	.			trans	-57.8	145	176.8	-74.9	169.8	0	0	0	112.6	F67 H69 S203 Y204 Q210 A211 L214	F67-L206 HydrophobicContact CD2-CB 4.42Å; H69-L206 PolarHBondContact CD2-O 2.95Å; S203-L206 WeakPolarHBondContact O-CD1 3.4Å; S203-L206 VanDerWaalsContact O-CG 3.25Å; S203-L206 WeakPolarHBondContact O-CG 3.37Å; Y204-L206 PolarHBondContact O-N 3.36Å; L206-Q210 HydrophobicContact CD2-CB 4.12Å; L206-A211 HydrophobicContact CB-CB 4.42Å; L206-L214 HydrophobicContact CD1-CD2 3.9Å
207	E	97.8	Very high	97.3	Very high	120 Å²	120	61.8 Å²	61.8	56%	0.561	30%	0.296	S	S	*	.			trans	-70	154.5	163.9	-62.7	-175.1	163.4	0	0	110.6	E209 Q210 A211	E207-E209 PolarHBondContact O-N 2.94Å; E207-Q210 HydrophobicContact CB-CB 4.37Å; E207-Q210 HydrophobicContact CB-CG 4.03Å; E207-Q210 PolarHBondContact O-N 3.33Å; E207-A211 PolarHBondContact O-N 3.41Å
208	V	97.5	Very high	97.4	Very high	40 Å²	40	60.1 Å²	60.1	24%	0.242	29%	0.286	C	S	.	.	H	α-helix	trans	-59.2	-45.6	-175.5	176.5	0	0	0	0	111.8	F67 H69 Q210 A211 Y212	F67-V208 HydrophobicContact CE2-CG2 4.29Å; F67-V208 HydrophobicContact CZ-CG2 4.44Å; H69-V208 HydrophobicContact CB-CG2 3.93Å; V208-Q210 PolarHBondContact O-N 2.68Å; V208-A211 WeakPolarHBondContact O-CB 3.29Å; V208-A211 PolarHBondContact O-N 3.42Å; V208-Y212 HydrophobicContact CG1-CD1 4.47Å; V208-Y212 HydrophobicContact CG1-CD2 4.29Å; V208-Y212 HydrophobicContact CG1-CE1 3.75Å; V208-Y212 HydrophobicContact CG1-CE2 3.56Å; V208-Y212 VanDerWaalsContact CG1-OH 3.27Å; V208-Y212 WeakPolarHBondContact CG1-OH 3.43Å; V208-Y212 WeakPolarHBondContact O-CD1 3.19Å; V208-Y212 VanDerWaalsContact O-CG 3.29Å; V208-Y212 PolarHBondContact O-N 3.36Å
209	E	97.4	Very high	97.5	Very high	125 Å²	125	60 Å²	60	58%	0.584	29%	0.286	S	S	*	.	H	α-helix	trans	-67.1	-35.6	178.9	-68.4	-55	139.6	0	0	113	E207 A211 Y212 D213	E207-E209 PolarHBondContact O-N 2.94Å; E209-A211 VanDerWaalsContact C-N 3.35Å; E209-Y212 PolarHBondContact O-N 2.59Å; E209-D213 PolarHBondContact O-N 2.85Å
210	Q	97.5	Very high	97.5	Very high	94 Å²	94	56.4 Å²	56.4	44%	0.439	27%	0.265	S	S	.	.	H	α-helix	trans	-65.6	-40.8	175.2	-64.7	173.6	-11.1	0	0	110.8	L206 E207 V208 Y212 D213 L214	L206-Q210 HydrophobicContact CD2-CB 4.12Å; E207-Q210 HydrophobicContact CB-CB 4.37Å; E207-Q210 HydrophobicContact CB-CG 4.03Å; E207-Q210 PolarHBondContact O-N 3.33Å; V208-Q210 PolarHBondContact O-N 2.68Å; Q210-Y212 VanDerWaalsContact C-N 3.35Å; Q210-D213 PolarHBondContact O-N 2.98Å; Q210-L214 WeakPolarHBondContact O-CB 3.39Å; Q210-L214 PolarHBondContact O-N 2.71Å
211	A	98.1	Very high	97.5	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-63.9	-39.7	175.2	0	0	0	0	0	111.7	F65 F67 I72 L206 E207 V208 E209 L214 A215	F65-A211 HydrophobicContact CE2-CB 4.03Å; F65-A211 HydrophobicContact CZ-CB 4.14Å; F67-A211 HydrophobicContact CD2-CB 4.31Å; F67-A211 HydrophobicContact CE2-CB 3.99Å; F67-A211 HydrophobicContact CZ-CB 4.12Å; I72-A211 HydrophobicContact CG1-CB 4.04Å; L206-A211 HydrophobicContact CB-CB 4.42Å; E207-A211 PolarHBondContact O-N 3.41Å; V208-A211 WeakPolarHBondContact O-CB 3.29Å; V208-A211 PolarHBondContact O-N 3.42Å; E209-A211 VanDerWaalsContact C-N 3.35Å; A211-L214 PolarHBondContact O-N 2.88Å; A211-A215 WeakPolarHBondContact O-CB 3.35Å; A211-A215 PolarHBondContact O-N 2.89Å
212	Y	98.3	Very high	97.6	Very high	17 Å²	17	47.7 Å²	47.7	7%	0.067	22%	0.224	C	C	.	.	H	α-helix	trans	-63	-46.5	174.8	-63.2	-17.5	0	0	0	112.4	I72 V208 E209 Q210 A215 R216 L235 H237 V246	I72-Y212 HydrophobicContact CD1-CD1 3.73Å; I72-Y212 HydrophobicContact CD1-CE1 3.55Å; V208-Y212 HydrophobicContact CG1-CD1 4.47Å; V208-Y212 HydrophobicContact CG1-CD2 4.29Å; V208-Y212 HydrophobicContact CG1-CE1 3.75Å; V208-Y212 HydrophobicContact CG1-CE2 3.56Å; V208-Y212 VanDerWaalsContact CG1-OH 3.27Å; V208-Y212 WeakPolarHBondContact CG1-OH 3.43Å; V208-Y212 WeakPolarHBondContact O-CD1 3.19Å; V208-Y212 VanDerWaalsContact O-CG 3.29Å; V208-Y212 PolarHBondContact O-N 3.36Å; E209-Y212 PolarHBondContact O-N 2.59Å; Q210-Y212 VanDerWaalsContact C-N 3.35Å; Y212-A215 PolarHBondContact O-N 2.62Å; Y212-R216 WeakPolarHBondContact O-CG 3.35Å; Y212-R216 PolarHBondContact O-N 3.28Å; Y212-R216 PolarHBondContact O-NH1 2.95Å; Y212-L235 HydrophobicContact CD1-CD2 4.01Å; Y212-L235 HydrophobicContact CG-CD2 3.99Å; Y212-H237 HydrophobicContact CE1-CB 3.9Å; Y212-H237 AromaticContact CE1-ND1 4Å; Y212-H237 AromaticContact CZ-ND1 3.9Å; Y212-H237 PolarHBondContact OH-ND1 3Å; Y212-V246 HydrophobicContact CD1-CG1 4.38Å; Y212-V246 HydrophobicContact CD1-CG2 4.5Å; Y212-V246 HydrophobicContact CD2-CG1 3.87Å; Y212-V246 HydrophobicContact CE1-CG1 4.26Å; Y212-V246 HydrophobicContact CE1-CG2 3.84Å; Y212-V246 HydrophobicContact CE2-CG1 3.71Å; Y212-V246 HydrophobicContact CE2-CG2 4.45Å; Y212-V246 HydrophobicContact CG-CG1 4.19Å
213	D	97.7	Very high	97.6	Very high	38 Å²	38	45.6 Å²	45.6	20%	0.203	22%	0.218	C	C	.	.	H	α-helix	trans	-66.4	-38.4	178.5	-170.5	57.5	0	0	0	112.1	E209 Q210 R216 R217 Y258	E209-D213 PolarHBondContact O-N 2.85Å; Q210-D213 PolarHBondContact O-N 2.98Å; D213-R216 PolarHBondContact O-N 2.72Å; D213-R217 VanDerWaalsContact O-CB 3.23Å; D213-R217 WeakPolarHBondContact O-CB 3.36Å; D213-R217 PolarHBondContact O-N 3.31Å; D213-R217 IonicContact OD1-NH2 3.69Å; D213-R217 IonicContact OD2-CZ 3.02Å; D213-R217 IonicContact OD2-NH1 2.91Å; D213-R217 PolarHBondContact OD2-NH1 2.83Å; D213-R217 IonicContact OD2-NH2 2.91Å; D213-R217 PolarHBondContact OD2-NH2 2.66Å; D213-Y258 PolarHBondContact OD1-OH 3.32Å
214	L	98	Very high	97.6	Very high	13 Å²	13	49.5 Å²	49.5	7%	0.068	23%	0.225	C	C	.	.	H	α-helix	trans	-59	-48.7	174	179.6	62.2	0	0	0	111.6	F65 L206 Q210 A211 R217 A218	F65-L214 HydrophobicContact CZ-CD2 4.32Å; L206-L214 HydrophobicContact CD1-CD2 3.9Å; Q210-L214 WeakPolarHBondContact O-CB 3.39Å; Q210-L214 PolarHBondContact O-N 2.71Å; A211-L214 PolarHBondContact O-N 2.88Å; L214-R217 PolarHBondContact O-N 3.04Å; L214-A218 VanDerWaalsContact O-CB 3.32Å; L214-A218 WeakPolarHBondContact O-CB 3.41Å; L214-A218 PolarHBondContact O-N 3.12Å
215	A	98.2	Very high	97.6	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-64.2	-44.4	-179.7	0	0	0	0	0	112.3	L63 F65 I72 A74 A211 Y212 A218 I219 L235	L63-A215 HydrophobicContact CD1-CB 4.31Å; F65-A215 HydrophobicContact CE1-CB 3.89Å; F65-A215 HydrophobicContact CZ-CB 4.28Å; I72-A215 HydrophobicContact CG2-CB 3.54Å; A74-A215 HydrophobicContact CB-CB 4.1Å; A211-A215 WeakPolarHBondContact O-CB 3.35Å; A211-A215 PolarHBondContact O-N 2.89Å; Y212-A215 PolarHBondContact O-N 2.62Å; A215-A218 PolarHBondContact O-N 3.42Å; A215-I219 PolarHBondContact O-N 2.91Å; A215-I219 VanDerWaalsContact O-N 3.12Å; A215-L235 HydrophobicContact CB-CD1 3.68Å
216	R	98.1	Very high	97.6	Very high	28 Å²	28	48.6 Å²	48.6	11%	0.106	22%	0.215	C	C	.	.	H	α-helix	trans	-60.1	-47.9	175.1	-72.3	-174.8	-150.1	98	-1	111.5	Y212 D213 A218 I219 Y220 L235 D249	Y212-R216 WeakPolarHBondContact O-CG 3.35Å; Y212-R216 PolarHBondContact O-N 3.28Å; Y212-R216 PolarHBondContact O-NH1 2.95Å; D213-R216 PolarHBondContact O-N 2.72Å; R216-A218 VanDerWaalsContact C-N 3.33Å; R216-A218 PolarHBondContact O-N 3.23Å; R216-I219 PolarHBondContact O-N 3.12Å; R216-Y220 VanDerWaalsContact O-CB 3.29Å; R216-Y220 WeakPolarHBondContact O-CB 3.49Å; R216-Y220 PolarHBondContact O-N 3.05Å; R216-L235 HydrophobicContact CG-CD2 4.25Å; R216-D249 WeakPolarHBondContact CD-OD2 3.38Å; R216-D249 IonicContact NE-OD2 2.79Å; R216-D249 PolarHBondContact NE-OD2 2.85Å
217	R	97.6	Very high	97.5	Very high	91 Å²	91	51.1 Å²	51.1	34%	0.343	24%	0.239	S	C	.	.	H	α-helix	trans	-63.4	-39.9	-179.9	-173	178.4	-70.7	118.4	5.8	111.5	V197 D213 L214 Y220 Q221	V197-R217 HydrophobicContact CG1-CG 4.24Å; D213-R217 VanDerWaalsContact O-CB 3.23Å; D213-R217 WeakPolarHBondContact O-CB 3.36Å; D213-R217 PolarHBondContact O-N 3.31Å; D213-R217 IonicContact OD1-NH2 3.69Å; D213-R217 IonicContact OD2-CZ 3.02Å; D213-R217 IonicContact OD2-NH1 2.91Å; D213-R217 PolarHBondContact OD2-NH1 2.83Å; D213-R217 IonicContact OD2-NH2 2.91Å; D213-R217 PolarHBondContact OD2-NH2 2.66Å; L214-R217 PolarHBondContact O-N 3.04Å; R217-Y220 PolarHBondContact O-N 2.86Å; R217-Q221 HydrophobicContact CG-CG 4.38Å; R217-Q221 VanDerWaalsContact O-CG 3.26Å; R217-Q221 WeakPolarHBondContact O-CG 3.07Å; R217-Q221 PolarHBondContact O-N 2.96Å
218	A	98.1	Very high	97.3	Very high	1 Å²	1	49 Å²	49	1%	0.008	23%	0.226	C	C	.	.	H	α-helix	trans	-63.7	-45.7	178.2	0	0	0	0	0	112.2	L63 V197 M198 L214 A215 R216 A222	L63-A218 HydrophobicContact CD2-CB 3.57Å; V197-A218 HydrophobicContact CB-CB 4.32Å; V197-A218 HydrophobicContact CG1-CB 4.27Å; M198-A218 HydrophobicContact CB-CB 4.48Å; L214-A218 VanDerWaalsContact O-CB 3.32Å; L214-A218 WeakPolarHBondContact O-CB 3.41Å; L214-A218 PolarHBondContact O-N 3.12Å; A215-A218 PolarHBondContact O-N 3.42Å; R216-A218 VanDerWaalsContact C-N 3.33Å; R216-A218 PolarHBondContact O-N 3.23Å; A218-A222 PolarHBondContact O-N 3.47Å; A218-A222 VanDerWaalsContact O-N 3.15Å
219	I	98.2	Very high	97.2	Very high	0 Å²	0	47 Å²	47	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-65.1	-44.4	173.8	-64.8	-64.1	0	0	0	110.9	T61 L63 A74 D76 A215 R216 Q221 A222 T223 V233	T61-I219 HydrophobicContact CG2-CD1 3.73Å; L63-I219 HydrophobicContact CD2-CD1 3.57Å; L63-I219 HydrophobicContact CD2-CG1 3.8Å; L63-I219 HydrophobicContact CG-CD1 3.87Å; L63-I219 HydrophobicContact CG-CG1 4.23Å; A74-I219 HydrophobicContact CB-CD1 4.41Å; A74-I219 HydrophobicContact CB-CG1 3.75Å; D76-I219 HydrophobicContact CB-CG2 4.16Å; A215-I219 PolarHBondContact O-N 2.91Å; A215-I219 VanDerWaalsContact O-N 3.12Å; R216-I219 PolarHBondContact O-N 3.12Å; I219-Q221 VanDerWaalsContact C-N 3.32Å; I219-Q221 PolarHBondContact O-N 2.96Å; I219-A222 WeakPolarHBondContact O-CB 3.29Å; I219-A222 PolarHBondContact O-N 3.32Å; I219-A222 VanDerWaalsContact O-N 3.11Å; I219-T223 HydrophobicContact CG2-CG2 3.95Å; I219-T223 WeakPolarHBondContact O-CG2 3.47Å; I219-T223 PolarHBondContact O-N 2.76Å; I219-T223 PolarHBondContact O-OG1 3.32Å; I219-V233 HydrophobicContact CB-CG1 3.88Å; I219-V233 HydrophobicContact CB-CG2 4.27Å; I219-V233 HydrophobicContact CG1-CG1 4.21Å; I219-V233 HydrophobicContact CG2-CB 4.29Å; I219-V233 HydrophobicContact CG2-CG1 3.87Å; I219-V233 HydrophobicContact CG2-CG2 3.63Å
220	Y	98.1	Very high	97.2	Very high	16 Å²	16	41.2 Å²	41.2	6%	0.063	19%	0.188	C	C	.	.	H	α-helix	trans	-55.8	-44.4	178.2	167.8	-97.2	0	0	0	112.6	R216 R217 A222 T223 Y224 V251 L254 H255 Y258	R216-Y220 VanDerWaalsContact O-CB 3.29Å; R216-Y220 WeakPolarHBondContact O-CB 3.49Å; R216-Y220 PolarHBondContact O-N 3.05Å; R217-Y220 PolarHBondContact O-N 2.86Å; Y220-A222 VanDerWaalsContact C-N 3.33Å; Y220-A222 PolarHBondContact O-N 2.79Å; Y220-T223 PolarHBondContact O-N 2.78Å; Y220-T223 PolarHBondContact O-OG1 3.2Å; Y220-Y224 WeakPolarHBondContact O-CB 3.4Å; Y220-Y224 PolarHBondContact O-N 3.27Å; Y220-V251 HydrophobicContact CD2-CG1 4.17Å; Y220-V251 HydrophobicContact CE2-CG1 4.47Å; Y220-L254 HydrophobicContact CD2-CB 3.91Å; Y220-L254 HydrophobicContact CE2-CB 4.41Å; Y220-H255 HydrophobicContact CE2-CB 3.88Å; Y220-H255 AromaticContact CZ-ND1 3.97Å; Y220-H255 PolarHBondContact OH-ND1 3.13Å; Y220-Y258 AromaticContact CD1-CD2 3.8Å; Y220-Y258 HydrophobicContact CD1-CD2 3.8Å; Y220-Y258 HydrophobicContact CD1-CE2 4.35Å; Y220-Y258 HydrophobicContact CD2-CD2 4.35Å; Y220-Y258 HydrophobicContact CE1-CD2 4Å; Y220-Y258 AromaticContact CG-CD2 3.99Å; Y220-Y258 HydrophobicContact CG-CD2 3.99Å; Y220-Y258 HydrophobicContact CG-CE2 4.27Å
221	Q	97.8	Very high	97.1	Very high	75 Å²	75	37.5 Å²	37.5	35%	0.35	18%	0.175	S	C	.	.	H	α-helix	trans	-69.5	-33	178.4	-67.1	-67.3	72.3	0	0	112.3	V197 R217 I219 R225	V197-Q221 HydrophobicContact CG2-CB 3.79Å; V197-Q221 HydrophobicContact CG2-CG 3.91Å; R217-Q221 HydrophobicContact CG-CG 4.38Å; R217-Q221 VanDerWaalsContact O-CG 3.26Å; R217-Q221 WeakPolarHBondContact O-CG 3.07Å; R217-Q221 PolarHBondContact O-N 2.96Å; I219-Q221 VanDerWaalsContact C-N 3.32Å; I219-Q221 PolarHBondContact O-N 2.96Å; Q221-R225 PolarHBondContact O-N 3.09Å
222	A	97.4	Very high	97.1	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-66.9	-46.6	173	0	0	0	0	0	111.6	T61 A194 A218 I219 Y220 Y224 R225 D226	T61-A222 HydrophobicContact CG2-CB 3.76Å; A194-A222 HydrophobicContact CB-CB 4.33Å; A218-A222 PolarHBondContact O-N 3.47Å; A218-A222 VanDerWaalsContact O-N 3.15Å; I219-A222 WeakPolarHBondContact O-CB 3.29Å; I219-A222 PolarHBondContact O-N 3.32Å; I219-A222 VanDerWaalsContact O-N 3.11Å; Y220-A222 VanDerWaalsContact C-N 3.33Å; Y220-A222 PolarHBondContact O-N 2.79Å; A222-Y224 VanDerWaalsContact C-N 3.26Å; A222-Y224 PolarHBondContact O-N 2.99Å; A222-R225 PolarHBondContact O-N 3.16Å; A222-R225 VanDerWaalsContact O-N 3.16Å; A222-D226 WeakPolarHBondContact O-CB 3.46Å; A222-D226 PolarHBondContact O-N 3.43Å
223	T	97.1	Very high	97.1	Very high	16 Å²	16	37.7 Å²	37.7	10%	0.098	18%	0.18	C	C	.	.	H	α-helix	trans	-67.4	-26.1	178	61.4	0	0	0	0	113	D76 I219 Y220 R225 V251	D76-T223 HydrophobicContact CB-CG2 3.97Å; I219-T223 HydrophobicContact CG2-CG2 3.95Å; I219-T223 WeakPolarHBondContact O-CG2 3.47Å; I219-T223 PolarHBondContact O-N 2.76Å; I219-T223 PolarHBondContact O-OG1 3.32Å; Y220-T223 PolarHBondContact O-N 2.78Å; Y220-T223 PolarHBondContact O-OG1 3.2Å; T223-R225 VanDerWaalsContact C-N 3.34Å; T223-V251 HydrophobicContact CG2-CG2 4.26Å
224	Y	96.9	Very high	97.1	Very high	138 Å²	138	36.3 Å²	36.3	54%	0.541	17%	0.173	S	C	.	.	H	α-helix	trans	-70.8	-29.9	173.9	-173	-97.3	0	0	0	112.8	Y220 A222	Y220-Y224 WeakPolarHBondContact O-CB 3.4Å; Y220-Y224 PolarHBondContact O-N 3.27Å; A222-Y224 VanDerWaalsContact C-N 3.26Å; A222-Y224 PolarHBondContact O-N 2.99Å
225	R	96.6	Very high	97.1	Very high	171 Å²	171	35.7 Å²	35.7	65%	0.645	17%	0.17	S	C	*	.	H	α-helix	trans	-100.4	-40.9	-176	-68.8	-68.4	172.4	-179.7	-5	113.7	Y193 Q221 A222 T223	Y193-R225 HydrophobicContact CD1-CB 3.98Å; Y193-R225 HydrophobicContact CD1-CG 4.34Å; Y193-R225 HydrophobicContact CD2-CB 3.91Å; Y193-R225 HydrophobicContact CE1-CB 4Å; Y193-R225 HydrophobicContact CE2-CB 3.94Å; Y193-R225 HydrophobicContact CG-CB 3.94Å; Q221-R225 PolarHBondContact O-N 3.09Å; A222-R225 PolarHBondContact O-N 3.16Å; A222-R225 VanDerWaalsContact O-N 3.16Å; T223-R225 VanDerWaalsContact C-N 3.34Å
226	D	96.3	Very high	97.1	Very high	17 Å²	17	35.8 Å²	35.8	9%	0.091	17%	0.17	C	C	.	.			trans	-87.7	123.4	-178.9	177.8	28.1	0	0	0	111.1	S189 G190 Y193 A222 Y228 S229	S189-D226 WeakPolarHBondContact CB-OD2 3.35Å; S189-D226 PolarHBondContact OG-OD2 3.32Å; G190-D226 PolarHBondContact N-OD2 2.9Å; Y193-D226 HydrophobicContact CD2-CB 4.05Å; Y193-D226 HydrophobicContact CE2-CB 3.99Å; A222-D226 WeakPolarHBondContact O-CB 3.46Å; A222-D226 PolarHBondContact O-N 3.43Å; D226-Y228 PolarHBondContact O-N 2.95Å; D226-Y228 PolarHBondContact OD1-N 3.43Å; D226-S229 PolarHBondContact O-N 3.31Å; D226-S229 WeakPolarHBondContact OD2-CB 3.49Å; D226-S229 PolarHBondContact OD2-N 3.33Å; D226-S229 PolarHBondContact OD2-OG 3Å
227	A	94.4	Very high	97.2	Very high	74 Å²	74	34.8 Å²	34.8	61%	0.612	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64	-30.8	-178.5	0	0	0	0	0	112.8	R78	R78-A227 PolarHBondContact NH1-O 2.62Å
228	Y	94.2	Very high	97.2	Very high	74 Å²	74	30.5 Å²	30.5	29%	0.29	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-7	-174.7	-57.3	-76.1	0	0	0	114.1	G59 R78 T80 G82 D226	G59-Y228 CarbonylContact C-O 3.56Å; R78-Y228 WeakPolarHBondContact CD-O 3.28Å; T80-Y228 HydrophobicContact CG2-CD1 3.99Å; G82-Y228 WeakPolarHBondContact O-CE1 3.19Å; D226-Y228 PolarHBondContact O-N 2.95Å; D226-Y228 PolarHBondContact OD1-N 3.43Å
229	S	96.1	Very high	97.2	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.166	C	C	.	.			trans	-100.4	137.9	175.4	-64	0	0	0	0	110.6	T60 T61 D76 D226	T60-S229 VanDerWaalsContact C-OG 3.31Å; T61-S229 PolarHBondContact N-OG 2.9Å; T61-S229 PolarHBondContact OG1-OG 3.3Å; D76-S229 VanDerWaalsContact OD2-CA 3.29Å; D76-S229 WeakPolarHBondContact OD2-CA 3.49Å; D226-S229 PolarHBondContact O-N 3.31Å; D226-S229 WeakPolarHBondContact OD2-CB 3.49Å; D226-S229 PolarHBondContact OD2-N 3.33Å; D226-S229 PolarHBondContact OD2-OG 3Å
230	G	95.8	Very high	97	Very high	3 Å²	3	41.3 Å²	41.3	3%	0.031	20%	0.197	C	C	.	.			trans	168.8	-162.1	177.9	0	0	0	0	0	115.5	D76 S77 R78	D76-G230 PolarHBondContact OD2-N 2.9Å; S77-G230 PolarHBondContact N-O 3.36Å; R78-G230 WeakPolarHBondContact CB-O 3.5Å; R78-G230 PolarHBondContact N-O 3.03Å
231	G	96.3	Very high	96.9	Very high	15 Å²	15	45.7 Å²	45.7	16%	0.155	22%	0.221	C	C	.	.	S	Bend	trans	86.8	-120.4	-179	0	0	0	0	0	111.5	V251	G231-V251 WeakPolarHBondContact O-CB 3.39Å; G231-V251 WeakPolarHBondContact O-CG2 3.47Å; G231-V251 PolarHBondContact O-N 3.2Å; G231-V251 VanDerWaalsContact O-N 3.15Å
232	A	97.3	Very high	96.8	Very high	22 Å²	22	42.5 Å²	42.5	18%	0.182	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	153.5	175.9	0	0	0	0	0	111	D76 S77 D249	D76-A232 CarbonylContact C-O 3.5Å; D76-A232 WeakPolarHBondContact CA-O 3.14Å; S77-A232 PolarHBondContact N-O 2.83Å; S77-A232 PolarHBondContact OG-N 3.03Å; S77-A232 PolarHBondContact OG-O 3.46Å; A232-D249 CarbonylContact C-O 3.54Å; A232-D249 VanDerWaalsContact CA-O 3.31Å; A232-D249 WeakPolarHBondContact CA-O 3.18Å
233	V	98.1	Very high	96.8	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	107.6	174.1	-175.4	0	0	0	0	108	I219 S248 D249 V251 L254	I219-V233 HydrophobicContact CB-CG1 3.88Å; I219-V233 HydrophobicContact CB-CG2 4.27Å; I219-V233 HydrophobicContact CG1-CG1 4.21Å; I219-V233 HydrophobicContact CG2-CB 4.29Å; I219-V233 HydrophobicContact CG2-CG1 3.87Å; I219-V233 HydrophobicContact CG2-CG2 3.63Å; V233-S248 WeakPolarHBondContact O-CA 3.25Å; V233-D249 PolarHBondContact N-O 3.41Å; V233-D249 PolarHBondContact O-N 3.04Å; V233-V251 HydrophobicContact CG2-CG2 3.86Å; V233-L254 HydrophobicContact CB-CD1 4.22Å; V233-L254 HydrophobicContact CG2-CD1 3.73Å
234	N	98.2	Very high	96.9	Very high	9 Å²	9	47 Å²	47	5%	0.048	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	127.4	173.7	-69.1	-70	0	0	0	109.4	A74 A75 Y236 R245 S248	A74-N234 WeakPolarHBondContact CA-O 3.4Å; A75-N234 PolarHBondContact N-O 3.08Å; A75-N234 VanDerWaalsContact N-O 3.08Å; A75-N234 PolarHBondContact O-N 2.82Å; N234-Y236 HydrophobicContact CB-CE2 4.18Å; N234-R245 PolarHBondContact OD1-NH2 3.49Å; N234-S248 PolarHBondContact OD1-OG 3.42Å
235	L	98.4	Very high	96.9	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	128.8	-178.8	-173.6	67.3	0	0	0	110.6	I72 A74 Y212 A215 R216 V246 S247	I72-L235 HydrophobicContact CG2-CD1 3.53Å; A74-L235 HydrophobicContact CB-CD1 3.89Å; Y212-L235 HydrophobicContact CD1-CD2 4.01Å; Y212-L235 HydrophobicContact CG-CD2 3.99Å; A215-L235 HydrophobicContact CB-CD1 3.68Å; R216-L235 HydrophobicContact CG-CD2 4.25Å; L235-V246 HydrophobicContact CB-CB 4.27Å; L235-V246 HydrophobicContact CD2-CB 4.02Å; L235-V246 HydrophobicContact CD2-CG1 3.82Å; L235-V246 HydrophobicContact CG-CB 4.02Å; L235-V246 HydrophobicContact CG-CG1 4.38Å; L235-V246 HydrophobicContact CG-CG2 4.4Å; L235-V246 PolarHBondContact O-N 2.96Å; L235-S247 PolarHBondContact N-O 3.05Å; L235-S247 PolarHBondContact O-N 2.93Å
236	Y	98.7	Very high	97	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.008	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	146.3	177.8	-72.8	-105.5	0	0	0	110.3	V73 V93 E95 L101 N234 W243 I244 R245	V73-Y236 PolarHBondContact N-O 2.82Å; V73-Y236 PolarHBondContact O-N 3.26Å; V93-Y236 HydrophobicContact CB-CD2 3.99Å; V93-Y236 HydrophobicContact CB-CE2 3.77Å; V93-Y236 HydrophobicContact CG1-CD1 4.48Å; V93-Y236 HydrophobicContact CG1-CD2 3.88Å; V93-Y236 HydrophobicContact CG1-CE2 3.97Å; V93-Y236 HydrophobicContact CG1-CG 4.16Å; V93-Y236 HydrophobicContact CG2-CD2 3.97Å; V93-Y236 HydrophobicContact CG2-CE2 4.09Å; E95-Y236 HydrophobicContact CG-CE1 4.39Å; E95-Y236 PolarHBondContact OE1-OH 3.42Å; L101-Y236 HydrophobicContact CD1-CD1 3.94Å; L101-Y236 HydrophobicContact CD1-CG 4.02Å; L101-Y236 HydrophobicContact CD2-CD1 4.33Å; N234-Y236 HydrophobicContact CB-CE2 4.18Å; Y236-W243 HydrophobicContact CD1-CD2 4.43Å; Y236-W243 AromaticContact CD1-CE3 3.71Å; Y236-W243 HydrophobicContact CD1-CE3 3.71Å; Y236-W243 HydrophobicContact CD1-CZ3 4.1Å; Y236-W243 AromaticContact CE1-CE3 3.8Å; Y236-W243 HydrophobicContact CE1-CE3 3.8Å; Y236-W243 HydrophobicContact CE1-CH2 4.45Å; Y236-W243 AromaticContact CE1-CZ3 3.7Å; Y236-W243 HydrophobicContact CE1-CZ3 3.7Å; Y236-I244 WeakPolarHBondContact CA-O 3.25Å; Y236-R245 HydrophobicContact CD1-CB 4.2Å; Y236-R245 HydrophobicContact CE1-CB 3.91Å; Y236-R245 HydrophobicContact CE1-CG 4.1Å; Y236-R245 HydrophobicContact CE2-CG 4.3Å
237	H	98.6	Very high	97	Very high	6 Å²	6	40 Å²	40	3%	0.028	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	118.1	174.5	179.7	-161.4	0	0	0	109.4	F67 H69 I72 Y212 R239 W243 I244 V246	F67-H237 AromaticContact CE1-NE2 3.96Å; F67-H237 AromaticContact CZ-NE2 3.85Å; H69-H237 PolarHBondContact O-NE2 3.39Å; I72-H237 HydrophobicContact CD1-CB 4.03Å; Y212-H237 HydrophobicContact CE1-CB 3.9Å; Y212-H237 AromaticContact CE1-ND1 4Å; Y212-H237 AromaticContact CZ-ND1 3.9Å; Y212-H237 PolarHBondContact OH-ND1 3Å; H237-R239 VanDerWaalsContact CE1-CG 3.47Å; H237-R239 WeakPolarHBondContact CE1-CG 3.49Å; H237-W243 CarbonylContact O-C 3.59Å; H237-W243 VanDerWaalsContact O-CA 3.3Å; H237-W243 WeakPolarHBondContact O-CA 3.25Å; H237-I244 HydrophobicContact CB-CD1 4.43Å; H237-I244 HydrophobicContact CB-CG1 3.92Å; H237-I244 PolarHBondContact N-O 3.2Å; H237-I244 PolarHBondContact O-N 3.44Å; H237-V246 HydrophobicContact CB-CG2 3.58Å
238	V	98.4	Very high	97.2	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.006	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	116.9	172.9	-173.4	0	0	0	0	108.9	G70 V71 V73 L101 C161 W243	G70-V238 VanDerWaalsContact CA-O 3.28Å; G70-V238 WeakPolarHBondContact CA-O 3.28Å; V71-V238 HydrophobicContact CB-CB 4.06Å; V71-V238 HydrophobicContact CB-CG2 4.29Å; V71-V238 PolarHBondContact N-O 2.95Å; V71-V238 PolarHBondContact O-N 2.92Å; V73-V238 HydrophobicContact CG2-CG2 4.5Å; L101-V238 HydrophobicContact CD1-CG2 3.73Å; L101-V238 HydrophobicContact CG-CG2 4.28Å; C161-V238 HydrophobicContact CB-CG2 4.37Å; V238-W243 HydrophobicContact CG2-CB 4.17Å
239	R	97.3	Very high	97.3	Very high	90 Å²	90	37.9 Å²	37.9	34%	0.34	20%	0.195	S	C	.	.			trans	-109.9	-179.9	174.3	-59.9	-173.7	-47.8	-163.7	1.2	110	W163 H237 D241 G242	W163-R239 WeakPolarHBondContact CB-O 3.21Å; H237-R239 VanDerWaalsContact CE1-CG 3.47Å; H237-R239 WeakPolarHBondContact CE1-CG 3.49Å; R239-D241 VanDerWaalsContact C-N 3.32Å; R239-D241 WeakPolarHBondContact CB-OD1 3.46Å; R239-D241 IonicContact CZ-OD1 3.82Å; R239-D241 IonicContact CZ-OD2 3.43Å; R239-D241 IonicContact NE-OD1 3.13Å; R239-D241 PolarHBondContact NE-OD1 3.25Å; R239-D241 IonicContact NE-OD2 3.5Å; R239-D241 IonicContact NH2-OD1 2.75Å; R239-D241 PolarHBondContact NH2-OD1 3Å; R239-D241 IonicContact NH2-OD2 3.05Å; R239-D241 PolarHBondContact NH2-OD2 3.15Å; R239-D241 PolarHBondContact O-N 3.05Å; R239-G242 PolarHBondContact N-O 3.4Å; R239-G242 PolarHBondContact O-N 3.23Å
240	E	96	Very high	97.4	Very high	139 Å²	139	41.6 Å²	41.6	65%	0.65	22%	0.215	S	C	*	.	S	Bend	trans	-63.1	-35.7	179	-177.7	167	-157.6	0	0	113.6	W163	W163-E240 HydrophobicContact CD2-CB 3.87Å; W163-E240 HydrophobicContact CD2-CG 4.42Å; W163-E240 HydrophobicContact CE3-CB 4.31Å; W163-E240 HydrophobicContact CG-CB 4.19Å; W163-E240 HydrophobicContact CG-CG 4.42Å; W163-E240 HydrophobicContact CH2-CB 4.43Å; W163-E240 HydrophobicContact CZ2-CB 3.99Å; W163-E240 HydrophobicContact CZ2-CG 4.43Å
241	D	94.5	Very high	97.5	Very high	107 Å²	107	42.8 Å²	42.8	57%	0.572	22%	0.222	S	C	*	.	S	Bend	trans	-78.4	-23.1	-179.7	60.4	-34	0	0	0	113.4	R239	R239-D241 VanDerWaalsContact C-N 3.32Å; R239-D241 WeakPolarHBondContact CB-OD1 3.46Å; R239-D241 IonicContact CZ-OD1 3.82Å; R239-D241 IonicContact CZ-OD2 3.43Å; R239-D241 IonicContact NE-OD1 3.13Å; R239-D241 PolarHBondContact NE-OD1 3.25Å; R239-D241 IonicContact NE-OD2 3.5Å; R239-D241 IonicContact NH2-OD1 2.75Å; R239-D241 PolarHBondContact NH2-OD1 3Å; R239-D241 IonicContact NH2-OD2 3.05Å; R239-D241 PolarHBondContact NH2-OD2 3.15Å; R239-D241 PolarHBondContact O-N 3.05Å
242	G	95.9	Very high	97.5	Very high	8 Å²	8	44.6 Å²	44.6	8%	0.082	24%	0.235	C	C	.	.			trans	151.9	-171.1	-176.7	0	0	0	0	0	111.3	P98 R239	P98-G242 WeakPolarHBondContact O-CA 3.43Å; R239-G242 PolarHBondContact N-O 3.4Å; R239-G242 PolarHBondContact O-N 3.23Å
243	W	98.1	Very high	97.4	Very high	55 Å²	55	48.2 Å²	48.2	21%	0.208	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	150.4	173.9	60.2	-99.9	0	0	0	111.9	E95 N97 P98 L101 Y236 H237 V238	E95-W243 HydrophobicContact CB-CH2 4.29Å; E95-W243 HydrophobicContact CB-CZ2 3.75Å; E95-W243 HydrophobicContact CG-CH2 3.61Å; E95-W243 HydrophobicContact CG-CZ2 3.53Å; E95-W243 HydrophobicContact CG-CZ3 4.37Å; E95-W243 WeakPolarHBondContact OE2-CH2 3.31Å; N97-W243 PolarHBondContact O-NE1 3.35Å; P98-W243 VanDerWaalsContact C-CD1 3.47Å; P98-W243 VanDerWaalsContact O-CD1 3.22Å; P98-W243 PolarHBondContact O-N 2.74Å; L101-W243 HydrophobicContact CD1-CB 3.87Å; L101-W243 HydrophobicContact CD1-CG 4.08Å; L101-W243 HydrophobicContact CD2-CB 4.37Å; L101-W243 HydrophobicContact CD2-CD2 3.79Å; L101-W243 HydrophobicContact CD2-CG 3.68Å; L101-W243 HydrophobicContact CG-CB 4.05Å; L101-W243 HydrophobicContact CG-CD2 4.44Å; L101-W243 HydrophobicContact CG-CG 3.83Å; Y236-W243 HydrophobicContact CD1-CD2 4.43Å; Y236-W243 AromaticContact CD1-CE3 3.71Å; Y236-W243 HydrophobicContact CD1-CE3 3.71Å; Y236-W243 HydrophobicContact CD1-CZ3 4.1Å; Y236-W243 AromaticContact CE1-CE3 3.8Å; Y236-W243 HydrophobicContact CE1-CE3 3.8Å; Y236-W243 HydrophobicContact CE1-CH2 4.45Å; Y236-W243 AromaticContact CE1-CZ3 3.7Å; Y236-W243 HydrophobicContact CE1-CZ3 3.7Å; H237-W243 CarbonylContact O-C 3.59Å; H237-W243 VanDerWaalsContact O-CA 3.3Å; H237-W243 WeakPolarHBondContact O-CA 3.25Å; V238-W243 HydrophobicContact CG2-CB 4.17Å
244	I	98.1	Very high	97.3	Very high	57 Å²	57	48.6 Å²	48.6	29%	0.292	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	143.1	168.8	62.6	172	0	0	0	109.3	Y236 H237 V246	Y236-I244 WeakPolarHBondContact CA-O 3.25Å; H237-I244 HydrophobicContact CB-CD1 4.43Å; H237-I244 HydrophobicContact CB-CG1 3.92Å; H237-I244 PolarHBondContact N-O 3.2Å; H237-I244 PolarHBondContact O-N 3.44Å; I244-V246 HydrophobicContact CD1-CG2 4.49Å; I244-V246 HydrophobicContact CG1-CG2 4.28Å; I244-V246 PolarHBondContact O-N 3.29Å
245	R	97.8	Very high	97.2	Very high	113 Å²	113	52.3 Å²	52.3	43%	0.426	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	115.3	166.5	-172.4	177.5	-175.2	-175.5	2.3	107.5	N234 Y236 S248	N234-R245 PolarHBondContact OD1-NH2 3.49Å; Y236-R245 HydrophobicContact CD1-CB 4.2Å; Y236-R245 HydrophobicContact CE1-CB 3.91Å; Y236-R245 HydrophobicContact CE1-CG 4.1Å; Y236-R245 HydrophobicContact CE2-CG 4.3Å; R245-S248 PolarHBondContact NH2-OG 3.07Å
246	V	97.8	Very high	97.1	Very high	43 Å²	43	57.9 Å²	57.9	26%	0.261	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	-56.7	-174.4	179.5	0	0	0	0	110.2	Y212 L235 H237 I244	Y212-V246 HydrophobicContact CD1-CG1 4.38Å; Y212-V246 HydrophobicContact CD1-CG2 4.5Å; Y212-V246 HydrophobicContact CD2-CG1 3.87Å; Y212-V246 HydrophobicContact CE1-CG1 4.26Å; Y212-V246 HydrophobicContact CE1-CG2 3.84Å; Y212-V246 HydrophobicContact CE2-CG1 3.71Å; Y212-V246 HydrophobicContact CE2-CG2 4.45Å; Y212-V246 HydrophobicContact CG-CG1 4.19Å; L235-V246 HydrophobicContact CB-CB 4.27Å; L235-V246 HydrophobicContact CD2-CB 4.02Å; L235-V246 HydrophobicContact CD2-CG1 3.82Å; L235-V246 HydrophobicContact CG-CB 4.02Å; L235-V246 HydrophobicContact CG-CG1 4.38Å; L235-V246 HydrophobicContact CG-CG2 4.4Å; L235-V246 PolarHBondContact O-N 2.96Å; H237-V246 HydrophobicContact CB-CG2 3.58Å; I244-V246 HydrophobicContact CD1-CG2 4.49Å; I244-V246 HydrophobicContact CG1-CG2 4.28Å; I244-V246 PolarHBondContact O-N 3.29Å
247	S	97.1	Very high	96.8	Very high	22 Å²	22	63.7 Å²	63.7	15%	0.154	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	171.9	-178.4	66.3	0	0	0	0	112	L235 D249	L235-S247 PolarHBondContact N-O 3.05Å; L235-S247 PolarHBondContact O-N 2.93Å; S247-D249 WeakPolarHBondContact CB-OD2 3.29Å; S247-D249 PolarHBondContact OG-OD2 3.27Å
248	S	97.7	Very high	96.6	Very high	59 Å²	59	66 Å²	66	41%	0.413	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	82.2	176.6	179.5	0	0	0	0	107.5	V233 N234 R245	V233-S248 WeakPolarHBondContact O-CA 3.25Å; N234-S248 PolarHBondContact OD1-OG 3.42Å; R245-S248 PolarHBondContact NH2-OG 3.07Å
249	D	97.7	Very high	96	Very high	45 Å²	45	68.9 Å²	68.9	24%	0.241	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	135.9	-166.7	-54.9	-44.6	0	0	0	110.3	R216 A232 V233 S247 L254	R216-D249 WeakPolarHBondContact CD-OD2 3.38Å; R216-D249 IonicContact NE-OD2 2.79Å; R216-D249 PolarHBondContact NE-OD2 2.85Å; A232-D249 CarbonylContact C-O 3.54Å; A232-D249 VanDerWaalsContact CA-O 3.31Å; A232-D249 WeakPolarHBondContact CA-O 3.18Å; V233-D249 PolarHBondContact N-O 3.41Å; V233-D249 PolarHBondContact O-N 3.04Å; S247-D249 WeakPolarHBondContact CB-OD2 3.29Å; S247-D249 PolarHBondContact OG-OD2 3.27Å; D249-L254 HydrophobicContact CB-CD1 4.08Å; D249-L254 HydrophobicContact CB-CD2 4.13Å; D249-L254 HydrophobicContact CB-CG 4.09Å
250	N	97.8	Very high	94.9	Very high	77 Å²	77	67.5 Å²	67.5	41%	0.412	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	139.2	175.7	-167	-32.8	0	0	0	110.1	A252 D253 L254	N250-A252 PolarHBondContact O-N 2.81Å; N250-A252 PolarHBondContact OD1-N 3.02Å; N250-D253 HydrophobicContact CB-CB 4.49Å; N250-D253 WeakPolarHBondContact CB-OD2 3.44Å; N250-D253 PolarHBondContact O-N 3.02Å; N250-L254 WeakPolarHBondContact O-CG 3.21Å; N250-L254 PolarHBondContact O-N 3.24Å
251	V	97.3	Very high	92.7	Very high	29 Å²	29	64.4 Å²	64.4	18%	0.176	36%	0.358	C	S	.	.	H	α-helix	trans	-59.4	-30.7	175.3	172.6	0	0	0	0	111.8	Y220 T223 G231 V233 H255	Y220-V251 HydrophobicContact CD2-CG1 4.17Å; Y220-V251 HydrophobicContact CE2-CG1 4.47Å; T223-V251 HydrophobicContact CG2-CG2 4.26Å; G231-V251 WeakPolarHBondContact O-CB 3.39Å; G231-V251 WeakPolarHBondContact O-CG2 3.47Å; G231-V251 PolarHBondContact O-N 3.2Å; G231-V251 VanDerWaalsContact O-N 3.15Å; V233-V251 HydrophobicContact CG2-CG2 3.86Å; V251-H255 WeakPolarHBondContact O-CB 3.5Å; V251-H255 PolarHBondContact O-N 2.8Å
252	A	96.4	Very high	90.2	Very high	53 Å²	53	65 Å²	65	44%	0.438	37%	0.366	S	S	.	.	H	α-helix	trans	-63.9	-49.1	175.3	0	0	0	0	0	112.1	N250 L254 H255 E256	N250-A252 PolarHBondContact O-N 2.81Å; N250-A252 PolarHBondContact OD1-N 3.02Å; A252-L254 VanDerWaalsContact C-N 3.29Å; A252-L254 PolarHBondContact O-N 2.88Å; A252-H255 WeakPolarHBondContact O-CA 3.31Å; A252-H255 VanDerWaalsContact O-CB 3.25Å; A252-H255 WeakPolarHBondContact O-CB 2.99Å; A252-H255 PolarHBondContact O-N 2.87Å; A252-E256 PolarHBondContact O-N 3.22Å
253	D	96.2	Very high	87.8	Confident	97 Å²	97	73.8 Å²	73.8	52%	0.519	42%	0.421	S	S	.	.	H	α-helix	trans	-65	-37.4	178.8	-49.1	-23	0	0	0	111	N250 H255 E256 K257	N250-D253 HydrophobicContact CB-CB 4.49Å; N250-D253 WeakPolarHBondContact CB-OD2 3.44Å; N250-D253 PolarHBondContact O-N 3.02Å; D253-H255 VanDerWaalsContact C-N 3.27Å; D253-H255 PolarHBondContact O-N 2.59Å; D253-E256 PolarHBondContact O-N 3.41Å; D253-K257 WeakPolarHBondContact O-CB 3.43Å; D253-K257 PolarHBondContact O-N 2.76Å
254	L	96	Very high	87.3	Confident	8 Å²	8	74.8 Å²	74.8	4%	0.042	43%	0.432	C	S	.	.	H	α-helix	trans	-65	-31.7	172.9	-67.6	177.1	0	0	0	112.1	Y220 V233 D249 N250 A252 K257 Y258	Y220-L254 HydrophobicContact CD2-CB 3.91Å; Y220-L254 HydrophobicContact CE2-CB 4.41Å; V233-L254 HydrophobicContact CB-CD1 4.22Å; V233-L254 HydrophobicContact CG2-CD1 3.73Å; D249-L254 HydrophobicContact CB-CD1 4.08Å; D249-L254 HydrophobicContact CB-CD2 4.13Å; D249-L254 HydrophobicContact CB-CG 4.09Å; N250-L254 WeakPolarHBondContact O-CG 3.21Å; N250-L254 PolarHBondContact O-N 3.24Å; A252-L254 VanDerWaalsContact C-N 3.29Å; A252-L254 PolarHBondContact O-N 2.88Å; L254-K257 PolarHBondContact O-N 3.27Å; L254-Y258 HydrophobicContact CB-CD2 4.28Å; L254-Y258 HydrophobicContact CB-CE2 4.16Å; L254-Y258 HydrophobicContact CD2-CE2 4.12Å; L254-Y258 WeakPolarHBondContact O-CB 3.24Å; L254-Y258 WeakPolarHBondContact O-CD2 3.33Å; L254-Y258 PolarHBondContact O-N 2.79Å
255	H	96.3	Very high	86.7	Confident	87 Å²	87	75.7 Å²	75.7	40%	0.403	44%	0.439	S	S	.	.	H	α-helix	trans	-64.4	-48.6	175.7	-176.6	79.1	0	0	0	111.2	Y220 V251 A252 D253 K257 Y258 S259	Y220-H255 HydrophobicContact CE2-CB 3.88Å; Y220-H255 AromaticContact CZ-ND1 3.97Å; Y220-H255 PolarHBondContact OH-ND1 3.13Å; V251-H255 WeakPolarHBondContact O-CB 3.5Å; V251-H255 PolarHBondContact O-N 2.8Å; A252-H255 WeakPolarHBondContact O-CA 3.31Å; A252-H255 VanDerWaalsContact O-CB 3.25Å; A252-H255 WeakPolarHBondContact O-CB 2.99Å; A252-H255 PolarHBondContact O-N 2.87Å; D253-H255 VanDerWaalsContact C-N 3.27Å; D253-H255 PolarHBondContact O-N 2.59Å; H255-K257 VanDerWaalsContact C-N 3.3Å; H255-K257 PolarHBondContact O-N 3.49Å; H255-Y258 PolarHBondContact O-N 3.34Å; H255-S259 VanDerWaalsContact O-CB 3.25Å; H255-S259 WeakPolarHBondContact O-CB 3.34Å; H255-S259 PolarHBondContact O-N 3.46Å; H255-S259 PolarHBondContact O-OG 3.13Å
256	E	94.9	Very high	86.1	Confident	118 Å²	118	73.6 Å²	73.6	55%	0.551	44%	0.44	S	S	*	.	H	α-helix	trans	-60.9	-40.2	176.2	-64.5	177.9	-179	0	0	111.9	A252 D253 Y258 S259	A252-E256 PolarHBondContact O-N 3.22Å; D253-E256 PolarHBondContact O-N 3.41Å; E256-Y258 PolarHBondContact O-N 3.22Å; E256-S259 PolarHBondContact O-OG 2.88Å; E256-S259 VanDerWaalsContact O-OG 3.04Å
257	K	93.8	Very high	85.4	Confident	123 Å²	123	75.4 Å²	75.4	54%	0.535	45%	0.451	S	S	.	.	H	α-helix	trans	-62.7	-41.6	177	-175.5	-178.1	179.2	-174.9	0	112.7	D253 L254 H255	D253-K257 WeakPolarHBondContact O-CB 3.43Å; D253-K257 PolarHBondContact O-N 2.76Å; L254-K257 PolarHBondContact O-N 3.27Å; H255-K257 VanDerWaalsContact C-N 3.3Å; H255-K257 PolarHBondContact O-N 3.49Å
258	Y	93.6	Very high	84.7	Confident	55 Å²	55	78.8 Å²	78.8	22%	0.216	47%	0.469	C	S	.	.	H	α-helix	trans	-93.6	-15	-174.4	-64.4	-46.9	0	0	0	114.3	D213 Y220 L254 H255 E256 G260	D213-Y258 PolarHBondContact OD1-OH 3.32Å; Y220-Y258 AromaticContact CD1-CD2 3.8Å; Y220-Y258 HydrophobicContact CD1-CD2 3.8Å; Y220-Y258 HydrophobicContact CD1-CE2 4.35Å; Y220-Y258 HydrophobicContact CD2-CD2 4.35Å; Y220-Y258 HydrophobicContact CE1-CD2 4Å; Y220-Y258 AromaticContact CG-CD2 3.99Å; Y220-Y258 HydrophobicContact CG-CD2 3.99Å; Y220-Y258 HydrophobicContact CG-CE2 4.27Å; L254-Y258 HydrophobicContact CB-CD2 4.28Å; L254-Y258 HydrophobicContact CB-CE2 4.16Å; L254-Y258 HydrophobicContact CD2-CE2 4.12Å; L254-Y258 WeakPolarHBondContact O-CB 3.24Å; L254-Y258 WeakPolarHBondContact O-CD2 3.33Å; L254-Y258 PolarHBondContact O-N 2.79Å; H255-Y258 PolarHBondContact O-N 3.34Å; E256-Y258 PolarHBondContact O-N 3.22Å; Y258-G260 VanDerWaalsContact C-N 3.27Å
259	S	86.6	Confident	83.8	Confident	61 Å²	61	80.1 Å²	80.1	43%	0.427	47%	0.473	S	S	.	.	H	α-helix	trans	-76.4	-12.9	174.1	60.5	0	0	0	0	113.3	H255 E256 S261	H255-S259 VanDerWaalsContact O-CB 3.25Å; H255-S259 WeakPolarHBondContact O-CB 3.34Å; H255-S259 PolarHBondContact O-N 3.46Å; H255-S259 PolarHBondContact O-OG 3.13Å; E256-S259 PolarHBondContact O-OG 2.88Å; E256-S259 VanDerWaalsContact O-OG 3.04Å; S259-S261 PolarHBondContact O-N 3.36Å; S259-S261 PolarHBondContact OG-N 3.17Å; S259-S261 PolarHBondContact OG-OG 3.35Å
260	G	72.9	Confident	82.8	Confident	62 Å²	62	82.6 Å²	82.6	64%	0.639	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.9	8.4	-176.1	0	0	0	0	0	113.8	Y258 T262	Y258-G260 VanDerWaalsContact C-N 3.27Å; G260-T262 VanDerWaalsContact C-N 3.25Å; G260-T262 PolarHBondContact O-N 3.28Å
261	S	49.9	Very low	81.7	Confident	73 Å²	73	83 Å²	83	51%	0.51	50%	0.496	S	S	.	.			trans	-81.4	73.8	171.9	58.2	0	0	0	0	109.8	S259	S259-S261 PolarHBondContact O-N 3.36Å; S259-S261 PolarHBondContact OG-N 3.17Å; S259-S261 PolarHBondContact OG-OG 3.35Å
262	T	41.8	Very low	80.4	Confident	121 Å²	121	87.5 Å²	87.5	74%	0.742	52%	0.522	S	S	*	.			trans	-88.1	131.9	158.4	-33.8	0	0	0	0	106.7	G260	G260-T262 VanDerWaalsContact C-N 3.25Å; G260-T262 PolarHBondContact O-N 3.28Å
263	P	46.4	Very low	78.9	Confident	192 Å²	192	90.6 Å²	90.6	100%	1.247	53%	0.53	S	S	*	.			trans	-61.1	0	168.2	26	-32.6	0	0	0	112.2

Retrieved 263 of 263 residues in 887.9 ms (Link to these results)

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