A0A096NJE7_PAPAN Loading...

Nipsnap homolog 1

Protein involved in mitophagy by facilitating recruitment of the autophagy machinery required for clearance of damaged mitochondria. Accumulates on the mitochondria surface in response to mitochondrial depolarization and acts as a 'eat me' signal by recruiting proteins involved in selective autophagy, such as autophagy receptors (CALCOCO2/NDP52, NBR1, SQSTM1/p62, TAX1BP1 and WDFY3/ALFY) and ATG8 family proteins (MAP1LC3A, MAP1LC3B, MAP1LC3C, GABARAP, GABARAPL1 and GABARAPL2).

AlphaFold DB (A0A2K6A2B3), UniProt , Accession A0A096NJE7, Species PAPAN (Papio anubis, Olive baboon), Gene NIPSNAP1, Length 284 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	41.5	Very low	31.5	Very low	252 Å²	252	148.5 Å²	148.5	100%	1.241	87%	0.866	S	S	*	*				0	98.8	0	-91.3	173.2	165	0	0	108
2	A	28.4	Very low	31.4	Very low	97 Å²	97	143.7 Å²	143.7	80%	0.802	86%	0.856	S	S	*	*			trans	-96.3	157.3	177.8	0	0	0	0	0	110.1
3	P	36.3	Very low	31.4	Very low	118 Å²	118	150.2 Å²	150.2	77%	0.766	86%	0.857	S	S	*	*			trans	-91.2	149.9	-154.6	35	-32.9	0	0	0	113.4
4	R	30.5	Very low	31.4	Very low	252 Å²	252	154.5 Å²	154.5	95%	0.951	85%	0.852	S	S	*	*			trans	-98.8	107.6	166.1	-76.2	-171.6	174.9	-165.2	-1	109.8
5	L	30.2	Very low	31.4	Very low	166 Å²	166	155.3 Å²	155.3	87%	0.869	85%	0.853	S	S	*	*			trans	-70.3	136.5	157.7	-78	148.6	0	0	0	108.7
6	C	27.5	Very low	31.5	Very low	127 Å²	127	156 Å²	156	86%	0.858	86%	0.855	S	S	*	*			trans	-132.6	94	166.8	-154.4	0	0	0	0	110.8
7	S	30.2	Very low	31.2	Very low	110 Å²	110	152 Å²	152	77%	0.769	86%	0.858	S	S	*	*			trans	10	128.5	142	-32.6	0	0	0	0	120.6
8	I	30	Very low	31	Very low	166 Å²	166	147.9 Å²	147.9	85%	0.851	86%	0.855	S	S	*	*			trans	-78.5	131.9	159.2	-64	167	0	0	0	108.3
9	S	30.3	Very low	31.2	Very low	115 Å²	115	147.3 Å²	147.3	80%	0.804	86%	0.856	S	S	*	*			trans	-107	117.5	174.2	178.3	0	0	0	0	110.9
10	V	30.8	Very low	31.3	Very low	132 Å²	132	143.5 Å²	143.5	80%	0.8	85%	0.85	S	S	*	*			trans	-101.7	128.7	164.2	170.4	0	0	0	0	107.2
11	A	30.5	Very low	31.5	Very low	99 Å²	99	143.2 Å²	143.2	82%	0.818	85%	0.853	S	S	*	*			trans	-144.9	115.4	164.9	0	0	0	0	0	111
12	A	30.3	Very low	31.1	Very low	90 Å²	90	142.7 Å²	142.7	74%	0.744	84%	0.837	S	S	*	*			trans	-134.1	124.1	164.7	0	0	0	0	0	108.1
13	R	32.1	Very low	31.1	Very low	228 Å²	228	143.2 Å²	143.2	86%	0.86	84%	0.841	S	S	*	*			trans	176.1	123.4	138.9	-105	177.2	176.1	-145.5	0.8	114.2
14	R	30.8	Very low	30.8	Very low	211 Å²	211	140.8 Å²	140.8	80%	0.796	84%	0.838	S	S	*	*				45.6	127.4	127.3	-76.2	-174.6	172.3	-159.5	-2.4	122.3
15	L	31.8	Very low	30.6	Very low	166 Å²	166	136.2 Å²	136.2	87%	0.869	83%	0.832	S	S	*	*			trans	-147.6	110.1	138.2	-72.2	172	0	0	0	106.4
16	L	32.1	Very low	30.6	Very low	167 Å²	167	134.7 Å²	134.7	87%	0.874	83%	0.829	S	S	*	*				66.3	115.4	83.5	-74.9	176.2	0	0	0	117.3
17	G	26.8	Very low	30.6	Very low	88 Å²	88	132.9 Å²	132.9	91%	0.907	82%	0.823	S	S	*	*			trans	120.4	117.4	134.3	0	0	0	0	0	119.9
18	G	27.7	Very low	30.6	Very low	78 Å²	78	132.6 Å²	132.6	80%	0.804	83%	0.828	S	S	*	*			trans	152.2	139.1	155	0	0	0	0	0	116.4
19	P	35.7	Very low	30.6	Very low	136 Å²	136	129.8 Å²	129.8	88%	0.883	83%	0.829	S	S	*	*			trans	-103.3	166.7	-145.7	39.7	-33.7	0	0	0	116.4
20	G	31.8	Very low	30.5	Very low	71 Å²	71	129.1 Å²	129.1	73%	0.732	83%	0.83	S	S	*	*			trans	-112.1	178.8	168.9	0	0	0	0	0	113.8
21	P	36.9	Very low	30.4	Very low	139 Å²	139	127.7 Å²	127.7	90%	0.903	83%	0.832	S	S	*	*			trans	-130	167.7	152.5	31.1	-13.2	0	0	0	114.1
22	R	31.8	Very low	30.3	Very low	241 Å²	241	127.4 Å²	127.4	91%	0.909	83%	0.83	S	S	*	*			trans	-105.1	151	-163.8	-65.3	175.5	175.8	174.4	-2.2	114.6
23	A	29.5	Very low	30.4	Very low	107 Å²	107	134.4 Å²	134.4	88%	0.884	84%	0.837	S	S	*	*			trans	49	139.9	130.6	0	0	0	0	0	125.5
24	G	28.9	Very low	30.3	Very low	68 Å²	68	133.2 Å²	133.2	70%	0.701	84%	0.839	S	S	*	*			trans	108.2	137.9	151	0	0	0	0	0	114.7
25	D	26.6	Very low	30.4	Very low	156 Å²	156	134.2 Å²	134.2	83%	0.834	84%	0.844	S	S	*	*			cis	-169.9	173.9	-2.4	-90.5	-39.3	0	0	0	107.9
26	V	29.6	Very low	30.4	Very low	134 Å²	134	131.7 Å²	131.7	81%	0.812	84%	0.84	S	S	*	*			trans	96	108.2	147.5	-152.6	0	0	0	0	121.4
27	A	28.9	Very low	30.4	Very low	89 Å²	89	133.3 Å²	133.3	74%	0.736	84%	0.84	S	S	*	*			trans	61.2	124.5	135	0	0	0	0	0	125.2
28	A	29.6	Very low	30.7	Very low	104 Å²	104	136.5 Å²	136.5	86%	0.86	84%	0.837	S	S	*	*			trans	-2	131.6	144.5	0	0	0	0	0	121.4
29	A	29.4	Very low	31.2	Very low	107 Å²	107	140.2 Å²	140.2	88%	0.884	84%	0.838	S	S	*	*			trans	-163.2	146.9	132.4	0	0	0	0	0	111.2
30	A	28	Very low	31.2	Very low	100 Å²	100	142.9 Å²	142.9	83%	0.826	84%	0.839	S	S	*	*			trans	-80	160.7	-168	0	0	0	0	0	115.5
31	A	28.9	Very low	31.5	Very low	102 Å²	102	142.5 Å²	142.5	84%	0.843	84%	0.835	S	S	*	*			trans	128.6	147.1	130.7	0	0	0	0	0	116.3
32	A	29.7	Very low	31.6	Very low	94 Å²	94	141.9 Å²	141.9	78%	0.777	83%	0.834	S	S	*	*			trans	88.4	94.1	163.9	0	0	0	0	0	118.4
33	R	31.6	Very low	32.1	Very low	236 Å²	236	140.5 Å²	140.5	89%	0.891	83%	0.829	S	S	*	*			trans	-23.6	122.5	151.7	-67.1	170.5	173.3	163.6	-2.4	114.4
34	F	30.1	Very low	32.4	Very low	203 Å²	203	142 Å²	142	89%	0.89	82%	0.816	S	S	*	*			trans	-135.8	119.5	141	-92.5	-85.1	0	0	0	109.2	S36	F34-S36 PolarHBondContact O-N 3.48Å
35	Y	32.5	Very low	32.8	Very low	233 Å²	233	150.4 Å²	150.4	91%	0.914	83%	0.826	S	S	*	*			trans	-62.7	120.2	169.9	-105.5	-100.6	0	0	0	109.1
36	S	33.2	Very low	33.7	Very low	112 Å²	112	147.9 Å²	147.9	78%	0.783	82%	0.821	S	S	*	*			trans	-155.2	88.8	153.9	-158.1	0	0	0	0	111.1	F34	F34-S36 PolarHBondContact O-N 3.48Å
37	K	30.5	Very low	34.2	Very low	201 Å²	201	147.9 Å²	147.9	87%	0.874	82%	0.815	S	S	*	*			trans	24.7	94.5	143.6	-137.4	171	-173.7	175.1	0	116.7
38	D	34.1	Very low	34.7	Very low	156 Å²	156	152.8 Å²	152.8	83%	0.834	82%	0.82	S	S	*	*			trans	-59.5	140.6	163.7	-83.3	-45.6	0	0	0	111.8	E40	D38-E40 VanDerWaalsContact C-N 3.31Å; D38-E40 PolarHBondContact O-N 3.41Å
39	N	38.2	Very low	35.3	Very low	156 Å²	156	153.2 Å²	153.2	83%	0.834	81%	0.812	S	S	*	*			trans	-79	68.7	-177	-169.7	23.2	0	0	0	111	G41	N39-G41 PolarHBondContact O-N 3.04Å; N39-G41 VanDerWaalsContact O-N 3.13Å
40	E	35.8	Very low	35.6	Very low	191 Å²	191	156.1 Å²	156.1	89%	0.893	81%	0.807	S	S	*	*			trans	-83.3	58.4	165.3	-76.9	-159.2	149.2	0	0	111.2	D38	D38-E40 VanDerWaalsContact C-N 3.31Å; D38-E40 PolarHBondContact O-N 3.41Å
41	G	37	Very low	36	Very low	63 Å²	63	160.6 Å²	160.6	65%	0.649	81%	0.808	S	S	*	*			trans	-100.6	6	-175.7	0	0	0	0	0	116.1	N39	N39-G41 PolarHBondContact O-N 3.04Å; N39-G41 VanDerWaalsContact O-N 3.13Å
42	S	39.9	Very low	36.9	Very low	126 Å²	126	160.8 Å²	160.8	88%	0.881	80%	0.799	S	S	*	*	S	Bend	trans	-119.8	13.1	-165.5	-162.5	0	0	0	0	116.7
43	W	41.7	Very low	37.2	Very low	212 Å²	212	162.5 Å²	162.5	80%	0.803	80%	0.795	S	S	*	*	S	Bend	trans	-118.4	-11.5	-179.8	-170.2	37.4	0	0	0	115.9
44	F	36.8	Very low	38.2	Very low	139 Å²	139	156.8 Å²	156.8	61%	0.61	79%	0.788	S	S	*	*	S	Bend	trans	-119.9	24.9	-167.4	-73.1	-70.1	0	0	0	118.4
45	R	37.2	Very low	39.4	Very low	245 Å²	245	155 Å²	155	93%	0.925	78%	0.775	S	S	*	*			trans	-107.2	13	173.4	-73.3	-170	-179.8	-169.7	1.7	116.6	L47	R45-L47 PolarHBondContact O-N 3.3Å
46	S	43.8	Very low	40.3	Very low	102 Å²	102	153.9 Å²	153.9	71%	0.713	78%	0.775	S	S	*	*			trans	-85.9	53.9	164.3	178.1	0	0	0	0	111.8
47	L	40.2	Very low	41.2	Very low	134 Å²	134	153.6 Å²	153.6	70%	0.702	77%	0.765	S	S	*	*			trans	-120.5	24.3	179.5	-81	173.1	0	0	0	114.6	R45	R45-L47 PolarHBondContact O-N 3.3Å
48	F	40.7	Very low	42.5	Very low	192 Å²	192	146.7 Å²	146.7	84%	0.842	75%	0.745	S	S	*	*			trans	-122	57.5	158.9	-61.4	-72.6	0	0	0	110.4	H50	F48-H50 VanDerWaalsContact C-N 3.3Å; F48-H50 PolarHBondContact O-N 2.63Å
49	V	41.7	Very low	43.5	Very low	114 Å²	114	144.2 Å²	144.2	69%	0.691	73%	0.729	S	S	*	*			trans	-60.9	105.9	148.3	178.1	0	0	0	0	104.4	K51	V49-K51 VanDerWaalsContact C-N 3.34Å; V49-K51 PolarHBondContact O-N 3.49Å
50	H	36.6	Very low	44.6	Very low	167 Å²	167	138 Å²	138	77%	0.773	70%	0.697	S	S	*	*			trans	-50.2	108.4	164.5	-95.3	45.7	0	0	0	105.9	F48 V52	F48-H50 VanDerWaalsContact C-N 3.3Å; F48-H50 PolarHBondContact O-N 2.63Å; H50-V52 PolarHBondContact O-N 2.92Å
51	K	36.1	Very low	45.9	Very low	195 Å²	195	131.5 Å²	131.5	85%	0.848	67%	0.671	S	S	*	*			trans	-64.3	89	168.7	-79.8	-176.8	176.8	178.8	0	105.4	V49 D53	V49-K51 VanDerWaalsContact C-N 3.34Å; V49-K51 PolarHBondContact O-N 3.49Å; K51-D53 PolarHBondContact O-N 3.08Å
52	V	46.9	Very low	47.3	Very low	106 Å²	106	132.4 Å²	132.4	64%	0.642	66%	0.66	S	S	*	*			trans	-67.4	110.9	162.6	179.3	0	0	0	0	103.9	H50	H50-V52 PolarHBondContact O-N 2.92Å
53	D	35.7	Very low	48.9	Very low	130 Å²	130	126.6 Å²	126.6	70%	0.695	62%	0.619	S	S	*	*			trans	-51.3	132.6	175.2	-78.8	-41.4	0	0	0	109.1	K51 R55	K51-D53 PolarHBondContact O-N 3.08Å; D53-R55 PolarHBondContact O-N 3.24Å
54	P	52.8	Low	50.6	Low	116 Å²	116	117.5 Å²	117.5	75%	0.753	59%	0.588	S	S	*	*			trans	-57.5	115.3	175.6	22	-30.9	0	0	0	108.5	K56	P54-K56 PolarHBondContact O-N 2.94Å
55	R	55.3	Low	52.1	Low	165 Å²	165	113.6 Å²	113.6	62%	0.623	57%	0.571	S	S	*	*			trans	-63.5	133.7	-176	-65.3	178.8	-177	168.8	1.5	109.4	D53	D53-R55 PolarHBondContact O-N 3.24Å
56	K	52.8	Low	53.3	Low	209 Å²	209	109.7 Å²	109.7	91%	0.909	56%	0.56	S	S	*	*			trans	-86	-15.8	-176.4	-64.3	-175.9	-179.9	179.4	0	113.8	P54	P54-K56 PolarHBondContact O-N 2.94Å
57	D	50.8	Low	53.8	Low	106 Å²	106	113.9 Å²	113.9	57%	0.567	57%	0.569	S	S	*	*	S	Bend	trans	-91.1	141.2	-178.7	-63.7	-38.7	0	0	0	112.4
58	A	57.8	Low	54.7	Low	56 Å²	56	109.9 Å²	109.9	46%	0.463	55%	0.55	S	S	.	*			trans	-60.2	137.3	173.9	0	0	0	0	0	111.2	S60 T61	A58-S60 PolarHBondContact O-N 3.36Å; A58-T61 WeakPolarHBondContact O-CB 3.19Å; A58-T61 PolarHBondContact O-N 3.3Å
59	H	56.4	Low	56.2	Low	105 Å²	105	104.2 Å²	104.2	49%	0.486	53%	0.534	S	S	.	.	H	α-helix	trans	-53.2	-32.1	-177.7	-78.7	-79.7	0	0	0	114.1	I198	H59-I198 WeakPolarHBondContact ND1-CD1 3.47Å
60	S	59.8	Low	58.6	Low	25 Å²	25	99.4 Å²	99.4	18%	0.175	51%	0.505	C	S	.	.	H	α-helix	trans	-68.8	-42.3	178.4	42.1	0	0	0	0	112.9	A58 L62 L63 S64	A58-S60 PolarHBondContact O-N 3.36Å; S60-L62 PolarHBondContact O-N 2.83Å; S60-L62 VanDerWaalsContact O-N 3.15Å; S60-L63 PolarHBondContact O-N 2.89Å; S60-S64 WeakPolarHBondContact O-CB 3.33Å; S60-S64 PolarHBondContact O-N 3.42Å; S60-S64 PolarHBondContact O-OG 2.95Å
61	T	63.5	Low	61.3	Low	55 Å²	55	91.5 Å²	91.5	34%	0.337	47%	0.468	S	S	.	.	H	α-helix	trans	-62.2	-24.5	-175.3	-53.5	0	0	0	0	114	A58 K66	A58-T61 WeakPolarHBondContact O-CB 3.19Å; A58-T61 PolarHBondContact O-N 3.3Å; T61-K66 HydrophobicContact CG2-CD 4.45Å; T61-K66 VanDerWaalsContact CG2-CE 3.49Å; T61-K66 VanDerWaalsContact O-CE 3.25Å; T61-K66 WeakPolarHBondContact O-CE 3.41Å
62	L	66.4	Low	64.2	Low	81 Å²	81	82.2 Å²	82.2	42%	0.424	43%	0.428	S	S	.	.	H	α-helix	trans	-84.6	-25.1	178.4	-66.9	173.7	0	0	0	113.1	S60 I198	S60-L62 PolarHBondContact O-N 2.83Å; S60-L62 VanDerWaalsContact O-N 3.15Å; L62-I198 HydrophobicContact CD1-CD1 3.99Å
63	L	74.3	Confident	66.7	Low	5 Å²	5	78.2 Å²	78.2	3%	0.026	40%	0.402	C	S	.	.	H	α-helix	trans	-109.6	-22.4	-171	-67.5	172.7	0	0	0	112.9	S60 F170 S171 M197 I198 F222	S60-L63 PolarHBondContact O-N 2.89Å; L63-F170 HydrophobicContact CB-CD1 4.13Å; L63-F170 HydrophobicContact CB-CE1 4.28Å; L63-F170 HydrophobicContact CD1-CE1 4.23Å; L63-F170 HydrophobicContact CD2-CE1 4.45Å; L63-F170 CarbonylContact O-C 3.6Å; L63-F170 WeakPolarHBondContact O-CA 3.37Å; L63-S171 PolarHBondContact O-N 3.35Å; L63-S171 PolarHBondContact O-OG 3.45Å; L63-M197 HydrophobicContact CD1-CG 3.82Å; L63-I198 HydrophobicContact CD1-CG1 4.12Å; L63-F222 HydrophobicContact CB-CE1 3.94Å; L63-F222 HydrophobicContact CB-CZ 3.86Å
64	S	77.1	Confident	69.7	Low	21 Å²	21	72.2 Å²	72.2	15%	0.147	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-92.9	156	179.8	68.2	0	0	0	0	113.2	S60 K66 E169	S60-S64 WeakPolarHBondContact O-CB 3.33Å; S60-S64 PolarHBondContact O-N 3.42Å; S60-S64 PolarHBondContact O-OG 2.95Å; S64-K66 PolarHBondContact O-N 2.8Å; S64-E169 WeakPolarHBondContact CA-O 3.46Å
65	K	68.5	Low	71.9	Confident	57 Å²	57	67.8 Å²	67.8	25%	0.248	34%	0.339	C	S	.	.			trans	-62.1	124.3	166.3	-61.4	-173.5	-173.8	165.5	0	107.7	E67 T68 E169 S171 W173	K65-E67 VanDerWaalsContact C-N 3.31Å; K65-T68 VanDerWaalsContact CB-OG1 3.28Å; K65-T68 WeakPolarHBondContact CB-OG1 3.31Å; K65-E169 HydrophobicContact CG-CG 4.47Å; K65-S171 WeakPolarHBondContact CE-O 3.19Å; K65-W173 PolarHBondContact NZ-O 2.9Å
66	K	63	Low	73.9	Confident	162 Å²	162	60 Å²	60	70%	0.704	31%	0.309	S	S	*	.	S	Bend	trans	-77.1	-22.3	177.4	-67.5	-172.6	-176.9	-174.1	0	112.3	T61 S64	T61-K66 HydrophobicContact CG2-CD 4.45Å; T61-K66 VanDerWaalsContact CG2-CE 3.49Å; T61-K66 VanDerWaalsContact O-CE 3.25Å; T61-K66 WeakPolarHBondContact O-CE 3.41Å; S64-K66 PolarHBondContact O-N 2.8Å
67	E	54.3	Low	76.1	Confident	190 Å²	190	50.2 Å²	50.2	89%	0.888	27%	0.267	S	S	*	.	S	Bend	trans	-88.1	-35	-170.2	-65.4	173.7	-176.4	0	0	112.7	K65	K65-E67 VanDerWaalsContact C-N 3.31Å
68	T	58.9	Low	78.4	Confident	51 Å²	51	46.4 Å²	46.4	31%	0.313	25%	0.247	S	C	.	.			trans	-97.8	104.4	176	50.9	0	0	0	0	108.4	K65 N70 E169	K65-T68 VanDerWaalsContact CB-OG1 3.28Å; K65-T68 WeakPolarHBondContact CB-OG1 3.31Å; T68-N70 PolarHBondContact O-N 2.93Å; T68-E169 PolarHBondContact OG1-OE1 3.1Å
69	S	72.4	Confident	80.3	Confident	73 Å²	73	43.9 Å²	43.9	51%	0.51	23%	0.225	S	C	.	.			trans	-69.7	38.3	173.8	56.2	0	0	0	0	112.3	L71 G130 G131	S69-L71 PolarHBondContact O-N 3.42Å; S69-G130 CarbonylContact O-C 3.52Å; S69-G130 PolarHBondContact O-N 3.21Å; S69-G130 WeakPolarHBondContact OG-CA 3.44Å; S69-G130 PolarHBondContact OG-N 3.34Å; S69-G131 WeakPolarHBondContact O-CA 3.43Å; S69-G131 PolarHBondContact O-N 3.32Å
70	N	90.4	Very high	82.3	Confident	12 Å²	12	41.7 Å²	41.7	6%	0.064	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	115.3	-178	-73.7	-27.7	0	0	0	109.6	T68 Y72 R127 S129 E175	T68-N70 PolarHBondContact O-N 2.93Å; N70-Y72 HydrophobicContact CB-CD2 4.45Å; N70-Y72 HydrophobicContact CB-CE2 3.74Å; N70-R127 HydrophobicContact CB-CG 4.23Å; N70-S129 PolarHBondContact OD1-OG 3.38Å; N70-E175 PolarHBondContact ND2-OE1 3.48Å
71	L	94.9	Very high	84.1	Confident	2 Å²	2	44 Å²	44	1%	0.01	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	130.9	166.4	-175.9	70.2	0	0	0	108.4	S69 F128 Y132 L135 L166 L168	S69-L71 PolarHBondContact O-N 3.42Å; L71-F128 HydrophobicContact CB-CB 4.49Å; L71-F128 PolarHBondContact N-O 2.8Å; L71-F128 VanDerWaalsContact N-O 3.08Å; L71-F128 PolarHBondContact O-N 2.74Å; L71-Y132 HydrophobicContact CD1-CE1 4.29Å; L71-Y132 HydrophobicContact CD1-CE2 4.49Å; L71-Y132 HydrophobicContact CD2-CD1 3.61Å; L71-Y132 HydrophobicContact CD2-CE1 3.78Å; L71-Y132 HydrophobicContact CD2-CG 4.05Å; L71-L135 HydrophobicContact CD2-CB 4.11Å; L71-L135 HydrophobicContact CD2-CD2 3.63Å; L71-L135 HydrophobicContact CD2-CG 4.49Å; L71-L166 HydrophobicContact CD1-CB 4.3Å; L71-L166 HydrophobicContact CD2-CD1 4.36Å; L71-L166 HydrophobicContact CD2-CD2 4.32Å; L71-L166 HydrophobicContact CG-CD2 4.49Å; L71-L168 HydrophobicContact CD1-CD2 4.25Å
72	Y	97.3	Very high	85.8	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	148	177.2	-66.6	-95.7	0	0	0	110.6	N70 V109 L125 W126 R127 L166 L167 E169 F221	N70-Y72 HydrophobicContact CB-CD2 4.45Å; N70-Y72 HydrophobicContact CB-CE2 3.74Å; Y72-V109 HydrophobicContact CD1-CG2 4.28Å; Y72-V109 HydrophobicContact CE1-CG2 4.06Å; Y72-L125 HydrophobicContact CD1-CD1 4.29Å; Y72-L125 HydrophobicContact CD1-CG 4.42Å; Y72-W126 CarbonylContact C-O 3.52Å; Y72-W126 WeakPolarHBondContact CA-O 3.26Å; Y72-R127 HydrophobicContact CD1-CB 3.97Å; Y72-R127 HydrophobicContact CD1-CG 4.3Å; Y72-R127 HydrophobicContact CE1-CB 3.79Å; Y72-R127 HydrophobicContact CE1-CG 3.84Å; Y72-L166 CarbonylContact O-C 3.6Å; Y72-L166 VanDerWaalsContact O-CA 3.3Å; Y72-L166 WeakPolarHBondContact O-CA 3.45Å; Y72-L167 PolarHBondContact N-O 3.06Å; Y72-L167 PolarHBondContact O-N 3.36Å; Y72-E169 HydrophobicContact CD2-CB 4.44Å; Y72-E169 HydrophobicContact CE2-CB 3.86Å; Y72-E169 HydrophobicContact CE2-CG 4.07Å; Y72-E169 WeakPolarHBondContact CE2-OE2 3.46Å; Y72-E169 PolarHBondContact OH-OE2 2.92Å; Y72-F221 AromaticContact CD1-CE1 3.77Å; Y72-F221 HydrophobicContact CD1-CE1 3.77Å; Y72-F221 HydrophobicContact CD1-CZ 4.42Å; Y72-F221 HydrophobicContact CD2-CD1 4.02Å; Y72-F221 AromaticContact CD2-CE1 3.84Å; Y72-F221 HydrophobicContact CD2-CE1 3.84Å; Y72-F221 AromaticContact CE1-CE1 3.85Å; Y72-F221 HydrophobicContact CE1-CE1 3.85Å; Y72-F221 HydrophobicContact CE1-CZ 4.42Å; Y72-F221 HydrophobicContact CE2-CD1 4.41Å; Y72-F221 AromaticContact CE2-CE1 3.92Å; Y72-F221 HydrophobicContact CE2-CE1 3.92Å; Y72-F221 HydrophobicContact CG-CD1 4.06Å; Y72-F221 AromaticContact CG-CE1 3.75Å; Y72-F221 HydrophobicContact CG-CE1 3.75Å; Y72-F221 AromaticContact CZ-CE1 3.9Å
73	K	98.1	Very high	87.3	Confident	21 Å²	21	48.4 Å²	48.4	9%	0.091	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	114.5	169.6	-175.7	-178.7	63.5	174.8	0	108.8	Q75 W126 F128 N164 Q165 L166	K73-Q75 HydrophobicContact CD-CG 4.25Å; K73-Q75 VanDerWaalsContact CE-OE1 3.25Å; K73-Q75 HydrophobicContact CG-CG 4.08Å; K73-W126 HydrophobicContact CB-CB 4.42Å; K73-W126 PolarHBondContact N-O 3.44Å; K73-W126 PolarHBondContact O-N 3.27Å; K73-F128 HydrophobicContact CB-CE2 3.8Å; K73-N164 HydrophobicContact CG-CB 4.42Å; K73-Q165 WeakPolarHBondContact CA-O 3.24Å; K73-L166 HydrophobicContact CB-CD2 3.77Å; K73-L166 HydrophobicContact CD-CD2 4.35Å; K73-L166 HydrophobicContact CG-CD2 3.93Å
74	I	98.6	Very high	88.5	Confident	5 Å²	5	49.8 Å²	49.8	3%	0.026	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	137.1	169	-163.8	166.2	0	0	0	109.2	F76 V123 H124 L125 N164 Q165 L167 L187	I74-F76 HydrophobicContact CB-CE2 4.45Å; I74-F76 HydrophobicContact CD1-CE1 4.4Å; I74-F76 HydrophobicContact CD1-CE2 3.99Å; I74-F76 HydrophobicContact CD1-CZ 3.61Å; I74-F76 HydrophobicContact CG1-CE2 3.86Å; I74-F76 HydrophobicContact CG1-CZ 3.95Å; I74-F76 HydrophobicContact CG2-CE2 3.85Å; I74-V123 HydrophobicContact CD1-CG1 4.23Å; I74-V123 HydrophobicContact CG1-CG1 4.14Å; I74-H124 CarbonylContact C-O 3.51Å; I74-H124 WeakPolarHBondContact CA-O 3.46Å; I74-L125 HydrophobicContact CB-CD1 4.06Å; I74-L125 HydrophobicContact CG1-CD1 4.42Å; I74-N164 CarbonylContact O-C 3.5Å; I74-N164 WeakPolarHBondContact O-CA 3.49Å; I74-N164 VanDerWaalsContact O-CB 3.29Å; I74-N164 WeakPolarHBondContact O-CB 3.46Å; I74-Q165 HydrophobicContact CG2-CB 3.94Å; I74-Q165 PolarHBondContact N-O 2.86Å; I74-Q165 PolarHBondContact O-N 3.14Å; I74-L167 HydrophobicContact CB-CD1 3.89Å; I74-L167 HydrophobicContact CG2-CD1 3.65Å; I74-L167 HydrophobicContact CG2-CD2 4.29Å; I74-L167 HydrophobicContact CG2-CG 4.12Å; I74-L187 HydrophobicContact CD1-CD1 4.33Å; I74-L187 HydrophobicContact CD1-CD2 3.88Å
75	Q	98.4	Very high	89.5	Confident	23 Å²	23	54.9 Å²	54.9	11%	0.107	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	137.3	178.9	-51.2	-174.7	-113.5	0	0	109.4	K73 H77 V123 H124 R163 N164	K73-Q75 HydrophobicContact CD-CG 4.25Å; K73-Q75 VanDerWaalsContact CE-OE1 3.25Å; K73-Q75 HydrophobicContact CG-CG 4.08Å; Q75-H77 PolarHBondContact NE2-NE2 2.93Å; Q75-V123 CarbonylContact O-C 3.55Å; Q75-V123 VanDerWaalsContact O-CA 3.32Å; Q75-V123 WeakPolarHBondContact O-CA 3.21Å; Q75-H124 HydrophobicContact CB-CB 4.24Å; Q75-H124 PolarHBondContact N-O 3.03Å; Q75-H124 PolarHBondContact O-N 3.37Å; Q75-R163 WeakPolarHBondContact CA-O 3.16Å; Q75-N164 HydrophobicContact CB-CB 4.32Å; Q75-N164 HydrophobicContact CG-CB 3.87Å
76	F	98.5	Very high	90.9	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	120.6	172.8	-54.2	-99	0	0	0	107.5	I74 Q121 V123 R162 R163 L187	I74-F76 HydrophobicContact CB-CE2 4.45Å; I74-F76 HydrophobicContact CD1-CE1 4.4Å; I74-F76 HydrophobicContact CD1-CE2 3.99Å; I74-F76 HydrophobicContact CD1-CZ 3.61Å; I74-F76 HydrophobicContact CG1-CE2 3.86Å; I74-F76 HydrophobicContact CG1-CZ 3.95Å; I74-F76 HydrophobicContact CG2-CE2 3.85Å; F76-Q121 HydrophobicContact CB-CG 4.44Å; F76-V123 HydrophobicContact CD1-CG1 4.2Å; F76-V123 HydrophobicContact CD1-CG2 3.77Å; F76-V123 HydrophobicContact CE1-CG1 4.05Å; F76-V123 HydrophobicContact CE1-CG2 4.1Å; F76-R162 WeakPolarHBondContact O-CA 3.38Å; F76-R163 HydrophobicContact CB-CG 3.7Å; F76-R163 VanDerWaalsContact CD1-NH2 3.34Å; F76-R163 HydrophobicContact CD2-CG 3.91Å; F76-R163 VanDerWaalsContact CE2-NH1 3.32Å; F76-R163 HydrophobicContact CG-CG 4.17Å; F76-R163 VanDerWaalsContact CG-CZ 3.48Å; F76-R163 PolarHBondContact N-O 2.8Å; F76-R163 PolarHBondContact O-N 3.45Å; F76-L187 HydrophobicContact CE1-CD2 3.65Å; F76-L187 HydrophobicContact CZ-CD2 3.83Å
77	H	98.7	Very high	92.6	Very high	4 Å²	4	46.7 Å²	46.7	2%	0.019	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	113.9	178.8	-67.8	174.4	0	0	0	108	Q75 V79 Y87 Q121 A122 L159 R162	Q75-H77 PolarHBondContact NE2-NE2 2.93Å; H77-V79 PolarHBondContact O-N 3.49Å; H77-Y87 HydrophobicContact CB-CE2 4.49Å; H77-Y87 AromaticContact ND1-CE2 4Å; H77-Y87 AromaticContact ND1-CZ 3.72Å; H77-Y87 PolarHBondContact ND1-OH 3.4Å; H77-Q121 WeakPolarHBondContact O-CA 3.23Å; H77-A122 PolarHBondContact N-O 2.63Å; H77-A122 PolarHBondContact O-N 3.39Å; H77-L159 HydrophobicContact CB-CD2 3.83Å; H77-R162 HydrophobicContact CB-CG 4.44Å; H77-R162 VanDerWaalsContact CD2-CG 3.45Å; H77-R162 WeakPolarHBondContact CD2-CG 3.32Å; H77-R162 WeakPolarHBondContact NE2-CD 3.35Å
78	N	98.6	Very high	94.7	Very high	27 Å²	27	38.4 Å²	38.4	14%	0.144	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	109.9	171.6	-68.2	0.3	0	0	0	106.8	E118 Q121 L160 S161	N78-E118 PolarHBondContact ND2-OE1 3.08Å; N78-Q121 WeakPolarHBondContact OD1-CG 3.41Å; N78-Q121 PolarHBondContact OD1-NE2 3.39Å; N78-L160 HydrophobicContact CB-CB 4.25Å; N78-L160 PolarHBondContact O-N 2.95Å; N78-S161 WeakPolarHBondContact CB-OG 3.34Å; N78-S161 PolarHBondContact N-O 3.12Å; N78-S161 PolarHBondContact ND2-OG 3.46Å; N78-S161 PolarHBondContact O-N 3.31Å
79	V	98.8	Very high	96.6	Very high	2 Å²	2	39.5 Å²	39.5	1%	0.012	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	146.9	-178.8	-163.8	0	0	0	0	108	H77 L84 Y87 D120 A122 M158 L159	H77-V79 PolarHBondContact O-N 3.49Å; V79-L84 HydrophobicContact CB-CD1 4.23Å; V79-L84 HydrophobicContact CG2-CD1 4.12Å; V79-Y87 HydrophobicContact CG1-CD2 4.16Å; V79-Y87 HydrophobicContact CG1-CG 3.95Å; V79-Y87 HydrophobicContact CG2-CD1 3.94Å; V79-Y87 HydrophobicContact CG2-CD2 3.96Å; V79-Y87 HydrophobicContact CG2-CE1 4.29Å; V79-Y87 HydrophobicContact CG2-CE2 4.25Å; V79-Y87 HydrophobicContact CG2-CG 3.82Å; V79-D120 WeakPolarHBondContact CA-O 3.48Å; V79-D120 WeakPolarHBondContact CB-O 3.05Å; V79-D120 PolarHBondContact N-O 3.01Å; V79-A122 HydrophobicContact CG2-CB 4.47Å; V79-M158 HydrophobicContact CG1-CB 4.38Å; V79-M158 VanDerWaalsContact CG1-O 3.25Å; V79-M158 WeakPolarHBondContact CG1-O 3.31Å; V79-L159 HydrophobicContact CB-CD2 4.38Å; V79-L159 HydrophobicContact CG2-CD2 3.93Å
80	K	98.6	Very high	97.8	Very high	60 Å²	60	37 Å²	37	26%	0.261	20%	0.198	S	C	.	.			trans	-62.9	130.1	166.3	-69.9	173.9	-175.8	172.2	0	108	E82 Y83 Q157 M158 L160	K80-E82 PolarHBondContact O-N 2.62Å; K80-E82 VanDerWaalsContact O-N 3.13Å; K80-Y83 HydrophobicContact CB-CD2 3.72Å; K80-Y83 HydrophobicContact CD-CD2 3.88Å; K80-Y83 HydrophobicContact CD-CE2 4.05Å; K80-Y83 HydrophobicContact CG-CD2 4.47Å; K80-Y83 PolarHBondContact O-N 2.95Å; K80-Q157 PolarHBondContact NZ-O 2.7Å; K80-M158 WeakPolarHBondContact CB-O 3.16Å; K80-M158 PolarHBondContact N-O 2.94Å; K80-L160 HydrophobicContact CG-CD2 3.76Å; K80-L160 HydrophobicContact CG-CG 3.83Å
81	P	98.1	Very high	98.2	Very high	72 Å²	72	36.5 Å²	36.5	47%	0.468	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-52.6	-40.5	-172.4	-27.1	33.3	0	0	0	113.5	Y83 L84 D120	P81-Y83 PolarHBondContact O-N 2.92Å; P81-Y83 VanDerWaalsContact O-N 3.14Å; P81-L84 PolarHBondContact O-N 2.9Å; P81-D120 HydrophobicContact CG-CB 4.41Å; P81-D120 WeakPolarHBondContact CG-OD2 3.49Å
82	E	98.3	Very high	98.3	Very high	134 Å²	134	39.4 Å²	39.4	63%	0.626	21%	0.209	S	C	*	.	G	3₁₀ helix	trans	-69.2	-8.8	-179.8	71.4	-80.2	-170.6	0	0	114.7	K80	K80-E82 PolarHBondContact O-N 2.62Å; K80-E82 VanDerWaalsContact O-N 3.13Å
83	Y	98.6	Very high	98.2	Very high	96 Å²	96	42 Å²	42	38%	0.376	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-113.9	3.5	179.6	-69.9	-80.2	0	0	0	113.9	K80 P81 D85 A86 Y87 M158	K80-Y83 HydrophobicContact CB-CD2 3.72Å; K80-Y83 HydrophobicContact CD-CD2 3.88Å; K80-Y83 HydrophobicContact CD-CE2 4.05Å; K80-Y83 HydrophobicContact CG-CD2 4.47Å; K80-Y83 PolarHBondContact O-N 2.95Å; P81-Y83 PolarHBondContact O-N 2.92Å; P81-Y83 VanDerWaalsContact O-N 3.14Å; Y83-D85 VanDerWaalsContact C-N 3.34Å; Y83-D85 PolarHBondContact O-N 3.36Å; Y83-A86 PolarHBondContact O-N 3Å; Y83-Y87 VanDerWaalsContact O-CB 3.24Å; Y83-Y87 WeakPolarHBondContact O-CB 3.27Å; Y83-Y87 PolarHBondContact O-N 2.97Å; Y83-M158 HydrophobicContact CD1-CG 3.88Å; Y83-M158 HydrophobicContact CG-CB 4.14Å; Y83-M158 HydrophobicContact CG-CG 4Å
84	L	98.3	Very high	98.1	Very high	34 Å²	34	41.5 Å²	41.5	18%	0.178	23%	0.229	C	C	.	.	H	α-helix	trans	-57.3	-44.4	-174	-175.2	60.7	0	0	0	112.6	V79 P81 Y87 N88	V79-L84 HydrophobicContact CB-CD1 4.23Å; V79-L84 HydrophobicContact CG2-CD1 4.12Å; P81-L84 PolarHBondContact O-N 2.9Å; L84-Y87 PolarHBondContact O-N 3.22Å; L84-N88 WeakPolarHBondContact O-CB 3.43Å; L84-N88 PolarHBondContact O-N 2.61Å; L84-N88 PolarHBondContact O-ND2 3.33Å; L84-N88 VanDerWaalsContact O-ND2 3.08Å
85	D	98.3	Very high	98	Very high	128 Å²	128	41.7 Å²	41.7	68%	0.684	23%	0.23	S	C	*	.	H	α-helix	trans	-68.5	-41.1	179.5	-69.4	-24.5	0	0	0	112.9	Y83 N88 S89	Y83-D85 VanDerWaalsContact C-N 3.34Å; Y83-D85 PolarHBondContact O-N 3.36Å; D85-N88 PolarHBondContact O-N 3.46Å; D85-S89 WeakPolarHBondContact O-CB 3.32Å; D85-S89 PolarHBondContact O-N 3.47Å; D85-S89 PolarHBondContact O-OG 3.18Å
86	A	98.6	Very high	97.9	Very high	45 Å²	45	42.2 Å²	42.2	37%	0.372	24%	0.235	S	C	.	.	H	α-helix	trans	-64.4	-42.7	175.4	0	0	0	0	0	111.1	Y83 S89 L90 M158	Y83-A86 PolarHBondContact O-N 3Å; A86-S89 PolarHBondContact O-N 3.5Å; A86-L90 VanDerWaalsContact O-CB 3.31Å; A86-L90 WeakPolarHBondContact O-CB 3.38Å; A86-L90 PolarHBondContact O-N 3.41Å; A86-M158 HydrophobicContact CB-CE 4.09Å; A86-M158 HydrophobicContact CB-SD 4.44Å
87	Y	98.6	Very high	97.7	Very high	2 Å²	2	47.3 Å²	47.3	1%	0.008	26%	0.258	C	S	.	.	H	α-helix	trans	-59	-48.4	174.1	175.3	-81.7	0	0	0	111	H77 V79 Y83 L84 L90 T91 A122 H124 R155 L159	H77-Y87 HydrophobicContact CB-CE2 4.49Å; H77-Y87 AromaticContact ND1-CE2 4Å; H77-Y87 AromaticContact ND1-CZ 3.72Å; H77-Y87 PolarHBondContact ND1-OH 3.4Å; V79-Y87 HydrophobicContact CG1-CD2 4.16Å; V79-Y87 HydrophobicContact CG1-CG 3.95Å; V79-Y87 HydrophobicContact CG2-CD1 3.94Å; V79-Y87 HydrophobicContact CG2-CD2 3.96Å; V79-Y87 HydrophobicContact CG2-CE1 4.29Å; V79-Y87 HydrophobicContact CG2-CE2 4.25Å; V79-Y87 HydrophobicContact CG2-CG 3.82Å; Y83-Y87 VanDerWaalsContact O-CB 3.24Å; Y83-Y87 WeakPolarHBondContact O-CB 3.27Å; Y83-Y87 PolarHBondContact O-N 2.97Å; L84-Y87 PolarHBondContact O-N 3.22Å; Y87-L90 PolarHBondContact O-N 3.26Å; Y87-T91 HydrophobicContact CD1-CG2 4.16Å; Y87-T91 HydrophobicContact CE1-CG2 3.54Å; Y87-T91 HydrophobicContact CE2-CG2 4.35Å; Y87-T91 WeakPolarHBondContact O-CG2 3.35Å; Y87-T91 PolarHBondContact O-N 2.99Å; Y87-T91 PolarHBondContact O-OG1 3.31Å; Y87-A122 HydrophobicContact CD1-CB 4.26Å; Y87-A122 HydrophobicContact CE1-CB 3.5Å; Y87-H124 AromaticContact CZ-NE2 3.97Å; Y87-H124 PolarHBondContact OH-NE2 3.35Å; Y87-R155 HydrophobicContact CD2-CG 3.83Å; Y87-R155 HydrophobicContact CE2-CG 3.42Å; Y87-R155 VanDerWaalsContact CE2-CG 3.42Å; Y87-L159 HydrophobicContact CD2-CD2 4.01Å; Y87-L159 HydrophobicContact CE2-CD2 3.76Å
88	N	98.4	Very high	97.5	Very high	15 Å²	15	47.8 Å²	47.8	8%	0.08	26%	0.26	C	S	.	.	H	α-helix	trans	-59.2	-51.2	178.6	-68.5	-29.8	0	0	0	110.6	L84 D85 L90 T91 E92 N113 L278	L84-N88 WeakPolarHBondContact O-CB 3.43Å; L84-N88 PolarHBondContact O-N 2.61Å; L84-N88 PolarHBondContact O-ND2 3.33Å; L84-N88 VanDerWaalsContact O-ND2 3.08Å; D85-N88 PolarHBondContact O-N 3.46Å; N88-L90 VanDerWaalsContact C-N 3.3Å; N88-L90 PolarHBondContact O-N 3.19Å; N88-T91 CarbonylContact O-C 3.58Å; N88-T91 PolarHBondContact O-N 3.22Å; N88-T91 PolarHBondContact O-OG1 3.33Å; N88-E92 WeakPolarHBondContact O-CG 3.47Å; N88-E92 PolarHBondContact O-N 2.98Å; N88-N113 VanDerWaalsContact CG-ND2 3.28Å; N88-N113 PolarHBondContact ND2-ND2 2.87Å; N88-N113 PolarHBondContact OD1-ND2 2.8Å; N88-N113 PolarHBondContact OD1-OD1 3.36Å; N88-L278 HydrophobicContact CB-CD1 4.3Å; N88-L278 HydrophobicContact CB-CD2 4.25Å
89	S	98.4	Very high	97.3	Very high	75 Å²	75	49.4 Å²	49.4	52%	0.524	27%	0.267	S	S	.	.	H	α-helix	trans	-55.9	-44.6	178.4	-56.4	0	0	0	0	112.2	D85 A86 T91 E92 A93	D85-S89 WeakPolarHBondContact O-CB 3.32Å; D85-S89 PolarHBondContact O-N 3.47Å; D85-S89 PolarHBondContact O-OG 3.18Å; A86-S89 PolarHBondContact O-N 3.5Å; S89-T91 PolarHBondContact O-N 3.37Å; S89-E92 PolarHBondContact O-N 2.98Å; S89-A93 PolarHBondContact O-N 2.86Å
90	L	98.2	Very high	97.1	Very high	20 Å²	20	55.7 Å²	55.7	11%	0.105	30%	0.299	C	S	.	.	H	α-helix	trans	-63.4	-41.7	177	-179.9	63.4	0	0	0	111.6	A86 Y87 N88 V94 F151 E154 R155 M158	A86-L90 VanDerWaalsContact O-CB 3.31Å; A86-L90 WeakPolarHBondContact O-CB 3.38Å; A86-L90 PolarHBondContact O-N 3.41Å; Y87-L90 PolarHBondContact O-N 3.26Å; N88-L90 VanDerWaalsContact C-N 3.3Å; N88-L90 PolarHBondContact O-N 3.19Å; L90-V94 PolarHBondContact O-N 3.43Å; L90-F151 HydrophobicContact CD1-CD2 3.89Å; L90-F151 HydrophobicContact CD2-CD2 4.01Å; L90-F151 HydrophobicContact CD2-CE2 4.24Å; L90-F151 HydrophobicContact CG-CD2 3.6Å; L90-F151 HydrophobicContact CG-CE2 3.82Å; L90-E154 HydrophobicContact CD2-CB 3.97Å; L90-E154 HydrophobicContact CD2-CG 3.87Å; L90-R155 HydrophobicContact CD2-CB 3.89Å; L90-M158 HydrophobicContact CD2-CE 4.19Å; L90-M158 HydrophobicContact CD2-SD 4.26Å
91	T	97.4	Very high	96.9	Very high	1 Å²	1	55.8 Å²	55.8	1%	0.006	30%	0.303	C	S	.	.	H	α-helix	trans	-68.1	-37.9	174.8	59.9	0	0	0	0	113.1	Y87 N88 S89 A93 V94 L95 F151	Y87-T91 HydrophobicContact CD1-CG2 4.16Å; Y87-T91 HydrophobicContact CE1-CG2 3.54Å; Y87-T91 HydrophobicContact CE2-CG2 4.35Å; Y87-T91 WeakPolarHBondContact O-CG2 3.35Å; Y87-T91 PolarHBondContact O-N 2.99Å; Y87-T91 PolarHBondContact O-OG1 3.31Å; N88-T91 CarbonylContact O-C 3.58Å; N88-T91 PolarHBondContact O-N 3.22Å; N88-T91 PolarHBondContact O-OG1 3.33Å; S89-T91 PolarHBondContact O-N 3.37Å; T91-A93 VanDerWaalsContact C-N 3.27Å; T91-A93 PolarHBondContact O-N 3.02Å; T91-V94 PolarHBondContact O-N 3.49Å; T91-L95 HydrophobicContact CG2-CD1 4.3Å; T91-L95 WeakPolarHBondContact O-CB 3.45Å; T91-L95 WeakPolarHBondContact O-CG 3.19Å; T91-L95 PolarHBondContact O-N 3.08Å; T91-F151 HydrophobicContact CG2-CE2 4.13Å; T91-F151 HydrophobicContact CG2-CZ 4.16Å
92	E	96.9	Very high	96.7	Very high	64 Å²	64	61.4 Å²	61.4	30%	0.299	32%	0.323	S	S	.	.	H	α-helix	trans	-63.2	-34.9	177.5	-72.3	-170.3	165.9	0	0	111.7	N88 S89 P96 I280	N88-E92 WeakPolarHBondContact O-CG 3.47Å; N88-E92 PolarHBondContact O-N 2.98Å; S89-E92 PolarHBondContact O-N 2.98Å; E92-P96 WeakPolarHBondContact O-CD 3.48Å; E92-P96 WeakPolarHBondContact O-CG 3.34Å; E92-I280 HydrophobicContact CB-CG2 3.95Å; E92-I280 HydrophobicContact CG-CD1 4.23Å; E92-I280 HydrophobicContact CG-CG1 4.04Å; E92-I280 HydrophobicContact CG-CG2 3.85Å
93	A	96.4	Very high	96.4	Very high	55 Å²	55	60.3 Å²	60.3	46%	0.455	32%	0.321	S	S	.	.	H	α-helix	trans	-72.5	-31.9	177.7	0	0	0	0	0	113.9	S89 T91 K97	S89-A93 PolarHBondContact O-N 2.86Å; T91-A93 VanDerWaalsContact C-N 3.27Å; T91-A93 PolarHBondContact O-N 3.02Å; A93-K97 WeakPolarHBondContact O-CE 3.45Å
94	V	96	Very high	96.2	Very high	10 Å²	10	57 Å²	57	6%	0.061	31%	0.309	C	S	.	.	H	α-helix	trans	-109.3	-41	-166.5	179.1	0	0	0	0	113.4	L90 T91 K97 L98 F151	L90-V94 PolarHBondContact O-N 3.43Å; T91-V94 PolarHBondContact O-N 3.49Å; V94-K97 WeakPolarHBondContact O-CB 3.45Å; V94-K97 PolarHBondContact O-N 3.42Å; V94-L98 PolarHBondContact O-N 3.26Å; V94-F151 HydrophobicContact CB-CB 4.49Å; V94-F151 HydrophobicContact CB-CD2 3.77Å; V94-F151 HydrophobicContact CB-CE2 4.15Å; V94-F151 HydrophobicContact CB-CG 4.1Å; V94-F151 HydrophobicContact CG1-CB 4.01Å; V94-F151 HydrophobicContact CG1-CD1 4.12Å; V94-F151 HydrophobicContact CG1-CD2 3.98Å; V94-F151 HydrophobicContact CG1-CG 3.77Å; V94-F151 HydrophobicContact CG2-CB 4.09Å; V94-F151 HydrophobicContact CG2-CD2 3.7Å; V94-F151 HydrophobicContact CG2-CE2 4.45Å; V94-F151 HydrophobicContact CG2-CG 4.1Å
95	L	96.2	Very high	95.9	Very high	8 Å²	8	57.3 Å²	57.3	4%	0.042	31%	0.312	C	S	.	.	H	α-helix	trans	-64.9	-37.9	-173.4	-59.2	-170.8	0	0	0	113.9	T91 K97 L98 H99 L108 N111 W126 F151 I280	T91-L95 HydrophobicContact CG2-CD1 4.3Å; T91-L95 WeakPolarHBondContact O-CB 3.45Å; T91-L95 WeakPolarHBondContact O-CG 3.19Å; T91-L95 PolarHBondContact O-N 3.08Å; L95-K97 VanDerWaalsContact C-N 3.28Å; L95-K97 PolarHBondContact O-N 3.38Å; L95-L98 PolarHBondContact O-N 2.99Å; L95-H99 WeakPolarHBondContact O-CB 3.5Å; L95-H99 PolarHBondContact O-N 2.98Å; L95-L108 HydrophobicContact CB-CD2 4.29Å; L95-N111 WeakPolarHBondContact CD1-ND2 3.46Å; L95-W126 HydrophobicContact CB-CH2 4.14Å; L95-W126 HydrophobicContact CB-CZ2 4.21Å; L95-W126 HydrophobicContact CD1-CZ2 4Å; L95-W126 HydrophobicContact CD2-CH2 4.14Å; L95-W126 HydrophobicContact CD2-CZ2 3.72Å; L95-W126 HydrophobicContact CG-CZ2 4.16Å; L95-F151 HydrophobicContact CD2-CE1 4.22Å; L95-F151 HydrophobicContact CD2-CZ 3.93Å; L95-I280 HydrophobicContact CB-CD1 4.1Å; L95-I280 HydrophobicContact CD1-CD1 4.41Å
96	P	96.1	Very high	95.7	Very high	34 Å²	34	51.7 Å²	51.7	22%	0.221	28%	0.283	C	S	.	.	H	α-helix	trans	-61.9	-35.6	175	-25.7	37	0	0	0	113	E92 L98 H99 L100 I280	E92-P96 WeakPolarHBondContact O-CD 3.48Å; E92-P96 WeakPolarHBondContact O-CG 3.34Å; P96-L98 PolarHBondContact O-N 3.15Å; P96-H99 PolarHBondContact O-N 2.9Å; P96-L100 WeakPolarHBondContact O-CB 3.25Å; P96-L100 VanDerWaalsContact O-CG 3.31Å; P96-L100 WeakPolarHBondContact O-CG 3.32Å; P96-L100 PolarHBondContact O-N 2.77Å; P96-I280 HydrophobicContact CG-CB 3.95Å; P96-I280 HydrophobicContact CG-CD1 4.32Å; P96-I280 HydrophobicContact CG-CG2 3.69Å
97	K	95.1	Very high	95.6	Very high	108 Å²	108	51 Å²	51	47%	0.47	28%	0.275	S	S	.	.	H	α-helix	trans	-61.1	-47.2	177.1	-59	-179.2	-178.2	179.4	0	110.7	A93 V94 L95 H99 L100 D101 E147	A93-K97 WeakPolarHBondContact O-CE 3.45Å; V94-K97 WeakPolarHBondContact O-CB 3.45Å; V94-K97 PolarHBondContact O-N 3.42Å; L95-K97 VanDerWaalsContact C-N 3.28Å; L95-K97 PolarHBondContact O-N 3.38Å; K97-H99 VanDerWaalsContact C-N 3.3Å; K97-H99 PolarHBondContact O-N 3.13Å; K97-L100 PolarHBondContact O-N 3.24Å; K97-D101 WeakPolarHBondContact O-CB 3.38Å; K97-D101 PolarHBondContact O-N 3.14Å; K97-D101 VanDerWaalsContact O-N 3.08Å; K97-E147 WeakPolarHBondContact CD-OE1 3.2Å; K97-E147 IonicContact NZ-OE1 2.74Å; K97-E147 PolarHBondContact NZ-OE1 3.33Å; K97-E147 IonicContact NZ-OE2 2.63Å
98	L	93.8	Very high	95.5	Very high	14 Å²	14	51.1 Å²	51.1	7%	0.073	28%	0.276	C	S	.	.	H	α-helix	trans	-65	-33.7	175.7	-66.5	178.2	0	0	0	113.1	V94 L95 P96 Y104 W126 L142 Y148	V94-L98 PolarHBondContact O-N 3.26Å; L95-L98 PolarHBondContact O-N 2.99Å; P96-L98 PolarHBondContact O-N 3.15Å; L98-Y104 HydrophobicContact CD2-CD2 4.33Å; L98-Y104 HydrophobicContact CD2-CE2 4.4Å; L98-Y104 HydrophobicContact CD2-CG 4.43Å; L98-W126 HydrophobicContact CB-CH2 4.4Å; L98-L142 HydrophobicContact CD1-CD2 4.3Å; L98-L142 HydrophobicContact CD2-CD2 3.68Å; L98-Y148 HydrophobicContact CD1-CD2 3.83Å; L98-Y148 HydrophobicContact CD1-CE2 4.18Å
99	H	94.6	Very high	95.4	Very high	61 Å²	61	50.9 Å²	50.9	28%	0.282	28%	0.275	S	S	.	.	H	α-helix	trans	-70.8	-35.5	179.5	173.8	35.3	0	0	0	112.9	L95 P96 K97 L108	L95-H99 WeakPolarHBondContact O-CB 3.5Å; L95-H99 PolarHBondContact O-N 2.98Å; P96-H99 PolarHBondContact O-N 2.9Å; K97-H99 VanDerWaalsContact C-N 3.3Å; K97-H99 PolarHBondContact O-N 3.13Å; H99-L108 HydrophobicContact CB-CB 4.02Å; H99-L108 PolarHBondContact ND1-N 3.34Å
100	L	94.6	Very high	95.3	Very high	133 Å²	133	47.3 Å²	47.3	70%	0.696	25%	0.25	S	S	*	.	H	α-helix	trans	-92	-15.1	-175.7	-66.4	171.5	0	0	0	113.4	P96 K97 E102	P96-L100 WeakPolarHBondContact O-CB 3.25Å; P96-L100 VanDerWaalsContact O-CG 3.31Å; P96-L100 WeakPolarHBondContact O-CG 3.32Å; P96-L100 PolarHBondContact O-N 2.77Å; K97-L100 PolarHBondContact O-N 3.24Å; L100-E102 PolarHBondContact O-N 3.46Å
101	D	94.6	Very high	95.3	Very high	62 Å²	62	46.3 Å²	46.3	33%	0.332	25%	0.245	S	C	.	.			trans	-81.2	109.1	-179.1	-173.6	-15.6	0	0	0	110.8	K97 D103 Y104	K97-D101 WeakPolarHBondContact O-CB 3.38Å; K97-D101 PolarHBondContact O-N 3.14Å; K97-D101 VanDerWaalsContact O-N 3.08Å; D101-D103 PolarHBondContact O-N 2.73Å; D101-D103 VanDerWaalsContact O-N 3.15Å; D101-D103 VanDerWaalsContact OD1-CB 3.32Å; D101-D103 WeakPolarHBondContact OD1-CB 3.42Å; D101-D103 PolarHBondContact OD1-N 2.95Å; D101-Y104 HydrophobicContact CB-CD2 3.87Å; D101-Y104 HydrophobicContact CB-CE2 4.46Å; D101-Y104 PolarHBondContact O-N 3.1Å; D101-Y104 WeakPolarHBondContact OD2-CD2 3.44Å; D101-Y104 VanDerWaalsContact OD2-CE2 3.25Å; D101-Y104 WeakPolarHBondContact OD2-CE2 3.33Å
102	E	92.6	Very high	95.3	Very high	190 Å²	190	46.5 Å²	46.5	89%	0.888	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	-20.5	-178.9	-62.7	-174.8	171.5	0	0	113.2	L100 Y104	L100-E102 PolarHBondContact O-N 3.46Å; E102-Y104 PolarHBondContact O-N 3.16Å
103	D	93.2	Very high	95.4	Very high	112 Å²	112	44.5 Å²	44.5	60%	0.599	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68	-21.6	174.5	-76.4	-20.7	0	0	0	111.9	D101 P105 K141	D101-D103 PolarHBondContact O-N 2.73Å; D101-D103 VanDerWaalsContact O-N 3.15Å; D101-D103 VanDerWaalsContact OD1-CB 3.32Å; D101-D103 WeakPolarHBondContact OD1-CB 3.42Å; D101-D103 PolarHBondContact OD1-N 2.95Å; D103-P105 WeakPolarHBondContact O-CD 3.34Å; D103-K141 WeakPolarHBondContact O-CD 3.45Å; D103-K141 WeakPolarHBondContact O-CE 3.25Å; D103-K141 PolarHBondContact O-NZ 2.83Å
104	Y	93.9	Very high	95.5	Very high	27 Å²	27	42.5 Å²	42.5	11%	0.106	22%	0.219	C	C	.	.	S	Bend	trans	-101.9	111.7	175.5	-62.9	-87.2	0	0	0	109.6	L98 D101 E102 C106 K141 L142 N145	L98-Y104 HydrophobicContact CD2-CD2 4.33Å; L98-Y104 HydrophobicContact CD2-CE2 4.4Å; L98-Y104 HydrophobicContact CD2-CG 4.43Å; D101-Y104 HydrophobicContact CB-CD2 3.87Å; D101-Y104 HydrophobicContact CB-CE2 4.46Å; D101-Y104 PolarHBondContact O-N 3.1Å; D101-Y104 WeakPolarHBondContact OD2-CD2 3.44Å; D101-Y104 VanDerWaalsContact OD2-CE2 3.25Å; D101-Y104 WeakPolarHBondContact OD2-CE2 3.33Å; E102-Y104 PolarHBondContact O-N 3.16Å; Y104-C106 PolarHBondContact O-N 3.49Å; Y104-K141 HydrophobicContact CD1-CB 4.14Å; Y104-K141 HydrophobicContact CE1-CB 3.61Å; Y104-L142 HydrophobicContact CD1-CD2 3.85Å; Y104-L142 HydrophobicContact CD1-CG 3.91Å; Y104-L142 HydrophobicContact CE1-CD2 3.49Å; Y104-L142 VanDerWaalsContact CE1-CD2 3.49Å; Y104-L142 HydrophobicContact CE1-CG 3.72Å; Y104-N145 WeakPolarHBondContact OH-CB 3.15Å; Y104-N145 PolarHBondContact OH-ND2 3.46Å
105	P	92.2	Very high	95.5	Very high	40 Å²	40	47 Å²	47	26%	0.26	24%	0.235	S	C	.	.			trans	-77.9	58	-179.7	33.7	-38.5	0	0	0	111.3	D103 F128 A134 D137 C138	D103-P105 WeakPolarHBondContact O-CD 3.34Å; P105-F128 WeakPolarHBondContact O-CD1 3.38Å; P105-A134 HydrophobicContact CB-CB 4.08Å; P105-A134 HydrophobicContact CG-CB 4.18Å; P105-A134 WeakPolarHBondContact CG-O 3.41Å; P105-D137 HydrophobicContact CG-CB 4.32Å; P105-C138 HydrophobicContact CG-CB 4.1Å
106	C	94.4	Very high	95.6	Very high	10 Å²	10	52.3 Å²	52.3	7%	0.068	26%	0.256	C	S	.	.			trans	-140.7	146.5	177.5	74.9	0	0	0	0	111.1	Y104 W126 R127 F128 C138	Y104-C106 PolarHBondContact O-N 3.49Å; C106-W126 HydrophobicContact CB-CE3 4.39Å; C106-R127 CarbonylContact C-O 3.51Å; C106-R127 VanDerWaalsContact CA-O 3.28Å; C106-R127 WeakPolarHBondContact CA-O 3.25Å; C106-F128 HydrophobicContact CB-CD1 3.55Å; C106-F128 HydrophobicContact CB-CE1 3.31Å; C106-F128 HydrophobicContact CB-CG 4.45Å; C106-F128 HydrophobicContact CB-CZ 4.03Å; C106-C138 VanDerWaalsContact SG-SG 3.67Å
107	S	95.4	Very high	95.6	Very high	30 Å²	30	53 Å²	53	21%	0.21	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	132.2	175.6	-48.3	0	0	0	0	109.3	V109 W126 R127	S107-V109 PolarHBondContact O-N 3.47Å; S107-W126 CarbonylContact O-C 3.54Å; S107-W126 WeakPolarHBondContact O-CA 3.41Å; S107-R127 PolarHBondContact N-O 2.82Å; S107-R127 PolarHBondContact O-N 3.02Å
108	L	96.8	Very high	95.6	Very high	4 Å²	4	51.6 Å²	51.6	2%	0.021	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	122.7	167	-177.1	62.4	0	0	0	107.2	L95 H99 N111 W126 I280 P282	L95-L108 HydrophobicContact CB-CD2 4.29Å; H99-L108 HydrophobicContact CB-CB 4.02Å; H99-L108 PolarHBondContact ND1-N 3.34Å; L108-N111 HydrophobicContact CD1-CB 4.49Å; L108-N111 HydrophobicContact CD2-CB 4.33Å; L108-W126 HydrophobicContact CB-CE3 4.12Å; L108-W126 HydrophobicContact CB-CH2 3.96Å; L108-W126 HydrophobicContact CB-CZ2 4.46Å; L108-W126 HydrophobicContact CB-CZ3 3.78Å; L108-W126 HydrophobicContact CD1-CD2 4.09Å; L108-W126 HydrophobicContact CD1-CE3 4.43Å; L108-W126 HydrophobicContact CD1-CH2 4.08Å; L108-W126 HydrophobicContact CD1-CZ2 3.7Å; L108-W126 HydrophobicContact CD1-CZ3 4.43Å; L108-W126 HydrophobicContact CG-CH2 4.47Å; L108-I280 HydrophobicContact CD2-CD1 4.36Å; L108-P282 HydrophobicContact CB-CG 4.29Å; L108-P282 HydrophobicContact CD2-CG 4.41Å; L108-P282 HydrophobicContact CG-CG 4.26Å; L108-P282 WeakPolarHBondContact O-CG 3.3Å
109	V	96.4	Very high	95.7	Very high	10 Å²	10	57.4 Å²	57.4	6%	0.061	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	-44.5	175.3	179.9	0	0	0	0	108.8	Y72 S107 L125 R127 P176 L283	Y72-V109 HydrophobicContact CD1-CG2 4.28Å; Y72-V109 HydrophobicContact CE1-CG2 4.06Å; S107-V109 PolarHBondContact O-N 3.47Å; V109-L125 WeakPolarHBondContact CA-O 3.27Å; V109-L125 HydrophobicContact CB-CB 4.16Å; V109-L125 HydrophobicContact CB-CD2 4Å; V109-L125 HydrophobicContact CB-CG 3.9Å; V109-L125 WeakPolarHBondContact CB-O 3.45Å; V109-L125 HydrophobicContact CG1-CD2 3.73Å; V109-L125 HydrophobicContact CG1-CG 4.21Å; V109-L125 HydrophobicContact CG2-CG 4.34Å; V109-L125 PolarHBondContact N-O 2.79Å; V109-R127 HydrophobicContact CG2-CB 3.58Å; V109-P176 HydrophobicContact CG1-CB 3.58Å; V109-P176 HydrophobicContact CG1-CG 4.06Å; V109-L283 HydrophobicContact CG1-CD1 3.95Å; V109-L283 HydrophobicContact CG1-CG 4.46Å; V109-L283 WeakPolarHBondContact O-CD1 3.14Å; V109-L283 WeakPolarHBondContact O-CG 3.44Å
110	G	96.8	Very high	95.9	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.3	162.9	171.4	0	0	0	0	0	113.8	W112 L125 S281	G110-W112 WeakPolarHBondContact O-CZ3 3.2Å; G110-L125 PolarHBondContact N-O 2.9Å; G110-L125 PolarHBondContact O-N 2.9Å; G110-S281 WeakPolarHBondContact CA-OG 3.48Å
111	N	97.3	Very high	96.1	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	122.4	-175.6	-176.4	-25.5	0	0	0	108.8	L95 L108 V123 H124 P277 L278 I280 S281	L95-N111 WeakPolarHBondContact CD1-ND2 3.46Å; L108-N111 HydrophobicContact CD1-CB 4.49Å; L108-N111 HydrophobicContact CD2-CB 4.33Å; N111-V123 WeakPolarHBondContact CA-O 3.4Å; N111-H124 VanDerWaalsContact CG-CE1 3.48Å; N111-H124 PolarHBondContact ND2-CE1 3.34Å; N111-H124 VanDerWaalsContact ND2-CE1 3.31Å; N111-H124 PolarHBondContact ND2-ND1 2.94Å; N111-H124 PolarHBondContact OD1-CE1 3.31Å; N111-P277 WeakPolarHBondContact O-CA 3.49Å; N111-L278 PolarHBondContact O-N 3.47Å; N111-L278 WeakPolarHBondContact OD1-CD1 3.44Å; N111-I280 WeakPolarHBondContact ND2-CD1 3.39Å; N111-S281 PolarHBondContact N-OG 2.84Å; N111-S281 VanDerWaalsContact O-CB 3.27Å; N111-S281 WeakPolarHBondContact O-CB 3.36Å; N111-S281 PolarHBondContact O-OG 3.19Å
112	W	98.1	Very high	96.2	Very high	4 Å²	4	47.7 Å²	47.7	2%	0.015	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	156	-175.5	-52.2	-101	0	0	0	112.1	G110 A122 V123 L125 Y185 L234 M275 I276 P277 L283	G110-W112 WeakPolarHBondContact O-CZ3 3.2Å; W112-A122 CarbonylContact O-C 3.58Å; W112-A122 WeakPolarHBondContact O-CA 3.27Å; W112-V123 PolarHBondContact N-O 2.83Å; W112-V123 PolarHBondContact O-N 2.89Å; W112-L125 HydrophobicContact CH2-CB 4.32Å; W112-L125 HydrophobicContact CZ3-CB 3.94Å; W112-Y185 AromaticContact CD1-CD2 3.58Å; W112-Y185 AromaticContact CD1-CG 3.83Å; W112-Y185 AromaticContact CE2-CG 3.96Å; W112-Y185 HydrophobicContact CZ2-CD1 4Å; W112-Y185 HydrophobicContact CZ2-CE1 4.19Å; W112-Y185 HydrophobicContact CZ2-CG 4.37Å; W112-Y185 AromaticContact NE1-CD1 3.64Å; W112-Y185 AromaticContact NE1-CD2 3.07Å; W112-Y185 AromaticContact NE1-CE2 3.54Å; W112-Y185 AromaticContact NE1-CG 3.16Å; W112-L234 HydrophobicContact CH2-CD2 3.86Å; W112-L234 HydrophobicContact CZ2-CD2 4.04Å; W112-M275 HydrophobicContact CB-CB 3.63Å; W112-M275 HydrophobicContact CB-CE 4.36Å; W112-M275 HydrophobicContact CB-CG 4.48Å; W112-M275 HydrophobicContact CB-SD 4.3Å; W112-M275 HydrophobicContact CD2-CE 3.94Å; W112-M275 HydrophobicContact CE3-CE 4.2Å; W112-M275 HydrophobicContact CG-CB 4.02Å; W112-M275 HydrophobicContact CG-CE 4.01Å; W112-I276 CarbonylContact C-O 3.49Å; W112-I276 VanDerWaalsContact CA-O 3.27Å; W112-I276 WeakPolarHBondContact CA-O 3.36Å; W112-I276 WeakPolarHBondContact CB-O 3.42Å; W112-P277 HydrophobicContact CG-CB 4.42Å; W112-L283 HydrophobicContact CH2-CD1 3.81Å; W112-L283 HydrophobicContact CZ2-CB 4.48Å; W112-L283 HydrophobicContact CZ2-CD1 3.58Å
113	N	98.3	Very high	96.5	Very high	22 Å²	22	38.7 Å²	38.7	12%	0.118	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	143.3	160.4	-73.2	-31.4	0	0	0	110.7	N88 W115 M275 I276	N88-N113 VanDerWaalsContact CG-ND2 3.28Å; N88-N113 PolarHBondContact ND2-ND2 2.87Å; N88-N113 PolarHBondContact OD1-ND2 2.8Å; N88-N113 PolarHBondContact OD1-OD1 3.36Å; N113-W115 PolarHBondContact O-N 3.19Å; N113-M275 CarbonylContact O-C 3.39Å; N113-M275 WeakPolarHBondContact O-CA 3.35Å; N113-I276 PolarHBondContact N-O 3.38Å; N113-I276 PolarHBondContact O-N 3.05Å
114	T	98.4	Very high	96.8	Very high	13 Å²	13	33.5 Å²	33.5	8%	0.08	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	125.3	174.7	-57.3	0	0	0	0	110.2	E118 Q121 R273	T114-E118 WeakPolarHBondContact CB-O 3.5Å; T114-E118 WeakPolarHBondContact CG2-O 3.36Å; T114-Q121 WeakPolarHBondContact CB-O 3.31Å; T114-Q121 PolarHBondContact N-O 2.97Å; T114-Q121 PolarHBondContact OG1-O 2.77Å; T114-R273 HydrophobicContact CG2-CG 3.42Å; T114-R273 VanDerWaalsContact CG2-CG 3.42Å; T114-R273 WeakPolarHBondContact OG1-CD 3.45Å; T114-R273 PolarHBondContact OG1-NE 3Å
115	W	97.4	Very high	97	Very high	106 Å²	106	32.4 Å²	32.4	40%	0.402	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	-51.3	174	-173.6	26.6	0	0	0	111.9	N113 L240 I274 I276	N113-W115 PolarHBondContact O-N 3.19Å; W115-L240 HydrophobicContact CH2-CD1 4.07Å; W115-L240 HydrophobicContact CZ3-CD1 3.92Å; W115-L240 HydrophobicContact CZ3-CG 4.22Å; W115-I274 HydrophobicContact CE3-CG2 4.04Å; W115-I274 PolarHBondContact N-O 3.07Å; W115-I276 HydrophobicContact CB-CD1 3.82Å; W115-I276 HydrophobicContact CB-CG1 3.96Å; W115-I276 HydrophobicContact CD2-CD1 3.79Å; W115-I276 HydrophobicContact CD2-CG1 4.39Å; W115-I276 HydrophobicContact CE3-CD1 4Å; W115-I276 HydrophobicContact CE3-CG1 4.24Å; W115-I276 HydrophobicContact CG-CD1 3.72Å; W115-I276 HydrophobicContact CG-CG1 4.31Å
116	Y	97.8	Very high	97.3	Very high	119 Å²	119	31.1 Å²	31.1	47%	0.467	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	128.5	173.2	-64.1	-79.4	0	0	0	110.2	L240 R273 I274	Y116-L240 HydrophobicContact CE2-CD1 3.91Å; Y116-R273 WeakPolarHBondContact O-CA 3.1Å; Y116-I274 HydrophobicContact CD2-CB 4.01Å; Y116-I274 HydrophobicContact CD2-CG1 4.23Å; Y116-I274 HydrophobicContact CD2-CG2 4.3Å; Y116-I274 PolarHBondContact N-O 2.69Å; Y116-I274 PolarHBondContact O-N 2.86Å
117	G	96.1	Very high	97.3	Very high	48 Å²	48	33.1 Å²	33.1	50%	0.495	16%	0.163	S	C	.	.	S	Bend	trans	127	-139.5	-170.9	0	0	0	0	0	110.3	Q119	G117-Q119 PolarHBondContact O-N 3.32Å
118	E	94.9	Very high	97.4	Very high	79 Å²	79	31.7 Å²	31.7	37%	0.369	15%	0.154	S	C	.	.	S	Bend	trans	-72.4	102.5	172.8	-165.4	169.8	-173.5	0	0	109.9	N78 T114 Q121 R273	N78-E118 PolarHBondContact ND2-OE1 3.08Å; T114-E118 WeakPolarHBondContact CB-O 3.5Å; T114-E118 WeakPolarHBondContact CG2-O 3.36Å; E118-Q121 VanDerWaalsContact O-CB 3.27Å; E118-Q121 WeakPolarHBondContact O-CB 3.01Å; E118-Q121 PolarHBondContact OE2-NE2 3.21Å; E118-R273 IonicContact OE2-NH2 3.62Å; E118-R273 PolarHBondContact OE2-NH2 3.25Å
119	Q	96.1	Very high	97.1	Very high	135 Å²	135	34.5 Å²	34.5	63%	0.631	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68	162.9	-178.6	-65.6	-174.7	-46.7	0	0	111.8	G117 Q121	G117-Q119 PolarHBondContact O-N 3.32Å; Q119-Q121 PolarHBondContact O-N 2.9Å; Q119-Q121 VanDerWaalsContact O-N 3.11Å
120	D	97.9	Very high	96.8	Very high	52 Å²	52	35.5 Å²	35.5	28%	0.278	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.6	25.1	-176.6	-48	-60.3	0	0	0	113.4	V79 P81	V79-D120 WeakPolarHBondContact CA-O 3.48Å; V79-D120 WeakPolarHBondContact CB-O 3.05Å; V79-D120 PolarHBondContact N-O 3.01Å; P81-D120 HydrophobicContact CG-CB 4.41Å; P81-D120 WeakPolarHBondContact CG-OD2 3.49Å
121	Q	98.5	Very high	96.6	Very high	1 Å²	1	36 Å²	36	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	121.7	179.8	-175.6	-179.2	81.7	0	0	111.5	F76 H77 N78 T114 E118 Q119	F76-Q121 HydrophobicContact CB-CG 4.44Å; H77-Q121 WeakPolarHBondContact O-CA 3.23Å; N78-Q121 WeakPolarHBondContact OD1-CG 3.41Å; N78-Q121 PolarHBondContact OD1-NE2 3.39Å; T114-Q121 WeakPolarHBondContact CB-O 3.31Å; T114-Q121 PolarHBondContact N-O 2.97Å; T114-Q121 PolarHBondContact OG1-O 2.77Å; E118-Q121 VanDerWaalsContact O-CB 3.27Å; E118-Q121 WeakPolarHBondContact O-CB 3.01Å; E118-Q121 PolarHBondContact OE2-NE2 3.21Å; Q119-Q121 PolarHBondContact O-N 2.9Å; Q119-Q121 VanDerWaalsContact O-N 3.11Å
122	A	98.6	Very high	96.4	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	136.9	169.5	0	0	0	0	0	110.9	H77 V79 Y87 W112 H124	H77-A122 PolarHBondContact N-O 2.63Å; H77-A122 PolarHBondContact O-N 3.39Å; V79-A122 HydrophobicContact CG2-CB 4.47Å; Y87-A122 HydrophobicContact CD1-CB 4.26Å; Y87-A122 HydrophobicContact CE1-CB 3.5Å; W112-A122 CarbonylContact O-C 3.58Å; W112-A122 WeakPolarHBondContact O-CA 3.27Å; A122-H124 WeakPolarHBondContact CB-NE2 3.45Å
123	V	98.6	Very high	96.2	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.006	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	127.4	179.1	-173.4	0	0	0	0	109.5	I74 Q75 F76 N111 W112 L187 M275	I74-V123 HydrophobicContact CD1-CG1 4.23Å; I74-V123 HydrophobicContact CG1-CG1 4.14Å; Q75-V123 CarbonylContact O-C 3.55Å; Q75-V123 VanDerWaalsContact O-CA 3.32Å; Q75-V123 WeakPolarHBondContact O-CA 3.21Å; F76-V123 HydrophobicContact CD1-CG1 4.2Å; F76-V123 HydrophobicContact CD1-CG2 3.77Å; F76-V123 HydrophobicContact CE1-CG1 4.05Å; F76-V123 HydrophobicContact CE1-CG2 4.1Å; N111-V123 WeakPolarHBondContact CA-O 3.4Å; W112-V123 PolarHBondContact N-O 2.83Å; W112-V123 PolarHBondContact O-N 2.89Å; V123-L187 HydrophobicContact CG1-CD2 4.32Å; V123-M275 HydrophobicContact CB-SD 3.95Å; V123-M275 HydrophobicContact CG1-SD 4.22Å; V123-M275 HydrophobicContact CG2-SD 3.78Å
124	H	98.4	Very high	96.1	Very high	2 Å²	2	44.6 Å²	44.6	1%	0.009	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	130.9	179.9	-51.5	-83.5	0	0	0	109.5	I74 Q75 Y87 N111 A122	I74-H124 CarbonylContact C-O 3.51Å; I74-H124 WeakPolarHBondContact CA-O 3.46Å; Q75-H124 HydrophobicContact CB-CB 4.24Å; Q75-H124 PolarHBondContact N-O 3.03Å; Q75-H124 PolarHBondContact O-N 3.37Å; Y87-H124 AromaticContact CZ-NE2 3.97Å; Y87-H124 PolarHBondContact OH-NE2 3.35Å; N111-H124 VanDerWaalsContact CG-CE1 3.48Å; N111-H124 PolarHBondContact ND2-CE1 3.34Å; N111-H124 VanDerWaalsContact ND2-CE1 3.31Å; N111-H124 PolarHBondContact ND2-ND1 2.94Å; N111-H124 PolarHBondContact OD1-CE1 3.31Å; A122-H124 WeakPolarHBondContact CB-NE2 3.45Å
125	L	98.3	Very high	96	Very high	4 Å²	4	44.7 Å²	44.7	2%	0.021	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	122.6	172.7	-176.2	63.7	0	0	0	109.3	Y72 I74 V109 G110 W112 F221 L234	Y72-L125 HydrophobicContact CD1-CD1 4.29Å; Y72-L125 HydrophobicContact CD1-CG 4.42Å; I74-L125 HydrophobicContact CB-CD1 4.06Å; I74-L125 HydrophobicContact CG1-CD1 4.42Å; V109-L125 WeakPolarHBondContact CA-O 3.27Å; V109-L125 HydrophobicContact CB-CB 4.16Å; V109-L125 HydrophobicContact CB-CD2 4Å; V109-L125 HydrophobicContact CB-CG 3.9Å; V109-L125 WeakPolarHBondContact CB-O 3.45Å; V109-L125 HydrophobicContact CG1-CD2 3.73Å; V109-L125 HydrophobicContact CG1-CG 4.21Å; V109-L125 HydrophobicContact CG2-CG 4.34Å; V109-L125 PolarHBondContact N-O 2.79Å; G110-L125 PolarHBondContact N-O 2.9Å; G110-L125 PolarHBondContact O-N 2.9Å; W112-L125 HydrophobicContact CH2-CB 4.32Å; W112-L125 HydrophobicContact CZ3-CB 3.94Å; L125-F221 HydrophobicContact CD2-CE2 4.02Å; L125-F221 HydrophobicContact CD2-CZ 3.81Å; L125-L234 HydrophobicContact CD2-CD2 4.47Å
126	W	97.9	Very high	95.9	Very high	13 Å²	13	44.7 Å²	44.7	5%	0.049	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	146.4	177.6	-65.6	84.3	0	0	0	110.6	Y72 K73 L95 L98 C106 S107 L108 F128	Y72-W126 CarbonylContact C-O 3.52Å; Y72-W126 WeakPolarHBondContact CA-O 3.26Å; K73-W126 HydrophobicContact CB-CB 4.42Å; K73-W126 PolarHBondContact N-O 3.44Å; K73-W126 PolarHBondContact O-N 3.27Å; L95-W126 HydrophobicContact CB-CH2 4.14Å; L95-W126 HydrophobicContact CB-CZ2 4.21Å; L95-W126 HydrophobicContact CD1-CZ2 4Å; L95-W126 HydrophobicContact CD2-CH2 4.14Å; L95-W126 HydrophobicContact CD2-CZ2 3.72Å; L95-W126 HydrophobicContact CG-CZ2 4.16Å; L98-W126 HydrophobicContact CB-CH2 4.4Å; C106-W126 HydrophobicContact CB-CE3 4.39Å; S107-W126 CarbonylContact O-C 3.54Å; S107-W126 WeakPolarHBondContact O-CA 3.41Å; L108-W126 HydrophobicContact CB-CE3 4.12Å; L108-W126 HydrophobicContact CB-CH2 3.96Å; L108-W126 HydrophobicContact CB-CZ2 4.46Å; L108-W126 HydrophobicContact CB-CZ3 3.78Å; L108-W126 HydrophobicContact CD1-CD2 4.09Å; L108-W126 HydrophobicContact CD1-CE3 4.43Å; L108-W126 HydrophobicContact CD1-CH2 4.08Å; L108-W126 HydrophobicContact CD1-CZ2 3.7Å; L108-W126 HydrophobicContact CD1-CZ3 4.43Å; L108-W126 HydrophobicContact CG-CH2 4.47Å; W126-F128 HydrophobicContact CB-CE2 3.87Å; W126-F128 HydrophobicContact CB-CZ 4.2Å
127	R	96.4	Very high	95.8	Very high	52 Å²	52	42.1 Å²	42.1	20%	0.196	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	139.7	172.8	-178	174.3	66.5	-161.8	-7.4	109.6	N70 Y72 C106 S107 V109 E175	N70-R127 HydrophobicContact CB-CG 4.23Å; Y72-R127 HydrophobicContact CD1-CB 3.97Å; Y72-R127 HydrophobicContact CD1-CG 4.3Å; Y72-R127 HydrophobicContact CE1-CB 3.79Å; Y72-R127 HydrophobicContact CE1-CG 3.84Å; C106-R127 CarbonylContact C-O 3.51Å; C106-R127 VanDerWaalsContact CA-O 3.28Å; C106-R127 WeakPolarHBondContact CA-O 3.25Å; S107-R127 PolarHBondContact N-O 2.82Å; S107-R127 PolarHBondContact O-N 3.02Å; V109-R127 HydrophobicContact CG2-CB 3.58Å; R127-E175 IonicContact CZ-OE1 3.75Å; R127-E175 IonicContact NH1-OE1 3.94Å; R127-E175 PolarHBondContact NH1-OE1 2.9Å
128	F	95.6	Very high	95.9	Very high	1 Å²	1	39.9 Å²	39.9	0%	0.004	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	99.8	173.7	-58.6	-92	0	0	0	107.9	L71 K73 P105 C106 W126 G130 G131 A134 L135 C138 M139	L71-F128 HydrophobicContact CB-CB 4.49Å; L71-F128 PolarHBondContact N-O 2.8Å; L71-F128 VanDerWaalsContact N-O 3.08Å; L71-F128 PolarHBondContact O-N 2.74Å; K73-F128 HydrophobicContact CB-CE2 3.8Å; P105-F128 WeakPolarHBondContact O-CD1 3.38Å; C106-F128 HydrophobicContact CB-CD1 3.55Å; C106-F128 HydrophobicContact CB-CE1 3.31Å; C106-F128 HydrophobicContact CB-CG 4.45Å; C106-F128 HydrophobicContact CB-CZ 4.03Å; W126-F128 HydrophobicContact CB-CE2 3.87Å; W126-F128 HydrophobicContact CB-CZ 4.2Å; F128-G130 PolarHBondContact O-N 3Å; F128-G131 PolarHBondContact O-N 2.64Å; F128-A134 HydrophobicContact CB-CB 4.22Å; F128-L135 HydrophobicContact CB-CB 4.36Å; F128-L135 HydrophobicContact CD1-CB 4.09Å; F128-L135 HydrophobicContact CD1-CD1 4.03Å; F128-L135 HydrophobicContact CD2-CB 4.46Å; F128-L135 HydrophobicContact CD2-CD1 4.07Å; F128-L135 HydrophobicContact CE1-CD1 3.66Å; F128-L135 HydrophobicContact CE2-CD1 3.74Å; F128-L135 HydrophobicContact CG-CB 4.04Å; F128-L135 HydrophobicContact CG-CD1 4.23Å; F128-L135 HydrophobicContact CZ-CD1 3.53Å; F128-C138 HydrophobicContact CD1-CB 4.27Å; F128-C138 HydrophobicContact CE1-CB 3.99Å; F128-M139 HydrophobicContact CE1-CE 4.02Å; F128-M139 HydrophobicContact CZ-CE 3.89Å
129	S	90.8	Very high	95.9	Very high	62 Å²	62	38.6 Å²	38.6	43%	0.434	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	120.7	177.5	-62.4	0	0	0	0	108.9	N70 A134	N70-S129 PolarHBondContact OD1-OG 3.38Å; S129-A134 VanDerWaalsContact O-CB 3.25Å; S129-A134 WeakPolarHBondContact O-CB 3.47Å
130	G	90.5	Very high	96	Very high	32 Å²	32	35.5 Å²	35.5	33%	0.33	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	103.3	3.1	-165	0	0	0	0	0	113.7	S69 F128 P133	S69-G130 CarbonylContact O-C 3.52Å; S69-G130 PolarHBondContact O-N 3.21Å; S69-G130 WeakPolarHBondContact OG-CA 3.44Å; S69-G130 PolarHBondContact OG-N 3.34Å; F128-G130 PolarHBondContact O-N 3Å; G130-P133 VanDerWaalsContact O-CD 3.3Å; G130-P133 WeakPolarHBondContact O-CD 3.22Å
131	G	92.4	Very high	95.9	Very high	11 Å²	11	36.6 Å²	36.6	11%	0.113	20%	0.199	C	C	.	.	H	α-helix	trans	73.3	-140.9	162.8	0	0	0	0	0	114.1	S69 F128 A134 L135	S69-G131 WeakPolarHBondContact O-CA 3.43Å; S69-G131 PolarHBondContact O-N 3.32Å; F128-G131 PolarHBondContact O-N 2.64Å; G131-A134 PolarHBondContact O-N 2.85Å; G131-L135 PolarHBondContact O-N 2.58Å
132	Y	93.6	Very high	95.8	Very high	99 Å²	99	37 Å²	37	39%	0.388	20%	0.201	S	C	.	.	H	α-helix	trans	-59	-42.8	177.6	-69.4	-74.7	0	0	0	113.5	L71 A134 L135 M136 L166 I225	L71-Y132 HydrophobicContact CD1-CE1 4.29Å; L71-Y132 HydrophobicContact CD1-CE2 4.49Å; L71-Y132 HydrophobicContact CD2-CD1 3.61Å; L71-Y132 HydrophobicContact CD2-CE1 3.78Å; L71-Y132 HydrophobicContact CD2-CG 4.05Å; Y132-A134 PolarHBondContact O-N 2.9Å; Y132-L135 PolarHBondContact O-N 3.33Å; Y132-M136 WeakPolarHBondContact O-CB 3.49Å; Y132-M136 VanDerWaalsContact O-CG 3.31Å; Y132-M136 WeakPolarHBondContact O-CG 3.44Å; Y132-M136 PolarHBondContact O-N 3.18Å; Y132-L166 HydrophobicContact CE1-CD1 4Å; Y132-I225 HydrophobicContact CE1-CD1 3.9Å
133	P	94.8	Very high	95.7	Very high	98 Å²	98	43.2 Å²	43.2	64%	0.636	23%	0.228	S	C	*	.	H	α-helix	trans	-54	-49	173.4	-29.5	34.8	0	0	0	113.8	G130 L135 M136 D137	G130-P133 VanDerWaalsContact O-CD 3.3Å; G130-P133 WeakPolarHBondContact O-CD 3.22Å; P133-L135 PolarHBondContact O-N 2.95Å; P133-M136 PolarHBondContact O-N 2.85Å; P133-D137 WeakPolarHBondContact O-CB 3.17Å; P133-D137 PolarHBondContact O-N 2.83Å
134	A	95.2	Very high	95.6	Very high	9 Å²	9	49.7 Å²	49.7	7%	0.074	26%	0.262	C	S	.	.	H	α-helix	trans	-61.8	-44.1	177.7	0	0	0	0	0	111.8	P105 F128 S129 G131 Y132 M136 D137 C138	P105-A134 HydrophobicContact CB-CB 4.08Å; P105-A134 HydrophobicContact CG-CB 4.18Å; P105-A134 WeakPolarHBondContact CG-O 3.41Å; F128-A134 HydrophobicContact CB-CB 4.22Å; S129-A134 VanDerWaalsContact O-CB 3.25Å; S129-A134 WeakPolarHBondContact O-CB 3.47Å; G131-A134 PolarHBondContact O-N 2.85Å; Y132-A134 PolarHBondContact O-N 2.9Å; A134-M136 VanDerWaalsContact C-N 3.35Å; A134-M136 PolarHBondContact O-N 3.24Å; A134-D137 PolarHBondContact O-N 2.78Å; A134-C138 VanDerWaalsContact O-CB 3.3Å; A134-C138 WeakPolarHBondContact O-CB 3.2Å; A134-C138 PolarHBondContact O-N 3.35Å
135	L	95.9	Very high	95.5	Very high	15 Å²	15	51 Å²	51	8%	0.079	27%	0.27	C	S	.	.	H	α-helix	trans	-57.4	-47.7	173.6	172.3	65.4	0	0	0	111.7	L71 F128 G131 Y132 P133 C138 M139 L166	L71-L135 HydrophobicContact CD2-CB 4.11Å; L71-L135 HydrophobicContact CD2-CD2 3.63Å; L71-L135 HydrophobicContact CD2-CG 4.49Å; F128-L135 HydrophobicContact CB-CB 4.36Å; F128-L135 HydrophobicContact CD1-CB 4.09Å; F128-L135 HydrophobicContact CD1-CD1 4.03Å; F128-L135 HydrophobicContact CD2-CB 4.46Å; F128-L135 HydrophobicContact CD2-CD1 4.07Å; F128-L135 HydrophobicContact CE1-CD1 3.66Å; F128-L135 HydrophobicContact CE2-CD1 3.74Å; F128-L135 HydrophobicContact CG-CB 4.04Å; F128-L135 HydrophobicContact CG-CD1 4.23Å; F128-L135 HydrophobicContact CZ-CD1 3.53Å; G131-L135 PolarHBondContact O-N 2.58Å; Y132-L135 PolarHBondContact O-N 3.33Å; P133-L135 PolarHBondContact O-N 2.95Å; L135-C138 PolarHBondContact O-N 3.36Å; L135-M139 HydrophobicContact CD1-CE 3.71Å; L135-M139 HydrophobicContact CD1-CG 3.84Å; L135-M139 HydrophobicContact CD1-SD 4.47Å; L135-M139 HydrophobicContact CG-CG 4.36Å; L135-M139 WeakPolarHBondContact O-CB 3.34Å; L135-M139 WeakPolarHBondContact O-CG 3.48Å; L135-M139 PolarHBondContact O-N 3.03Å; L135-L166 HydrophobicContact CD2-CD1 3.69Å; L135-L166 HydrophobicContact CD2-CD2 3.77Å; L135-L166 HydrophobicContact CD2-CG 4.41Å
136	M	96.3	Very high	95.4	Very high	106 Å²	106	59.6 Å²	59.6	52%	0.522	31%	0.307	S	S	.	.	H	α-helix	trans	-66.3	-41.6	-177.6	-72.1	-57.7	-63	0	0	112	Y132 P133 A134 M139 N140	Y132-M136 WeakPolarHBondContact O-CB 3.49Å; Y132-M136 VanDerWaalsContact O-CG 3.31Å; Y132-M136 WeakPolarHBondContact O-CG 3.44Å; Y132-M136 PolarHBondContact O-N 3.18Å; P133-M136 PolarHBondContact O-N 2.85Å; A134-M136 VanDerWaalsContact C-N 3.35Å; A134-M136 PolarHBondContact O-N 3.24Å; M136-M139 PolarHBondContact O-N 3.27Å; M136-N140 VanDerWaalsContact O-CB 3.31Å; M136-N140 WeakPolarHBondContact O-CB 3.43Å; M136-N140 PolarHBondContact O-N 2.98Å; M136-N140 PolarHBondContact O-ND2 2.74Å
137	D	96.1	Very high	95.3	Very high	64 Å²	64	63.3 Å²	63.3	34%	0.342	33%	0.325	S	S	.	.	H	α-helix	trans	-60	-52.6	174	-179.2	43.1	0	0	0	111.2	P105 P133 A134 M139 N140 K141	P105-D137 HydrophobicContact CG-CB 4.32Å; P133-D137 WeakPolarHBondContact O-CB 3.17Å; P133-D137 PolarHBondContact O-N 2.83Å; A134-D137 PolarHBondContact O-N 2.78Å; D137-M139 PolarHBondContact O-N 2.73Å; D137-N140 PolarHBondContact O-N 3.46Å; D137-N140 VanDerWaalsContact O-N 3.1Å; D137-K141 WeakPolarHBondContact O-CG 3.46Å; D137-K141 PolarHBondContact O-N 2.84Å; D137-K141 WeakPolarHBondContact OD1-CE 3.42Å; D137-K141 IonicContact OD1-NZ 3.09Å; D137-K141 WeakPolarHBondContact OD2-CE 3.35Å; D137-K141 IonicContact OD2-NZ 2.61Å; D137-K141 PolarHBondContact OD2-NZ 3.17Å
138	C	96.8	Very high	95.2	Very high	1 Å²	1	62.3 Å²	62.3	1%	0.007	32%	0.321	C	S	.	.	H	α-helix	trans	-54.5	-49.7	176.2	-179.4	0	0	0	0	111.6	P105 C106 F128 A134 L135 N140 K141 L142	P105-C138 HydrophobicContact CG-CB 4.1Å; C106-C138 VanDerWaalsContact SG-SG 3.67Å; F128-C138 HydrophobicContact CD1-CB 4.27Å; F128-C138 HydrophobicContact CE1-CB 3.99Å; A134-C138 VanDerWaalsContact O-CB 3.3Å; A134-C138 WeakPolarHBondContact O-CB 3.2Å; A134-C138 PolarHBondContact O-N 3.35Å; L135-C138 PolarHBondContact O-N 3.36Å; C138-N140 VanDerWaalsContact C-N 3.31Å; C138-N140 PolarHBondContact O-N 2.72Å; C138-K141 PolarHBondContact O-N 3.11Å; C138-L142 WeakPolarHBondContact O-CB 3.15Å; C138-L142 WeakPolarHBondContact O-CG 3.08Å; C138-L142 PolarHBondContact O-N 2.92Å
139	M	96.1	Very high	95.3	Very high	52 Å²	52	66 Å²	66	26%	0.256	34%	0.34	S	S	.	.	H	α-helix	trans	-65.1	-33	179.9	-67.6	-59.5	126.2	0	0	112.7	F128 L135 M136 D137 L142 K143	F128-M139 HydrophobicContact CE1-CE 4.02Å; F128-M139 HydrophobicContact CZ-CE 3.89Å; L135-M139 HydrophobicContact CD1-CE 3.71Å; L135-M139 HydrophobicContact CD1-CG 3.84Å; L135-M139 HydrophobicContact CD1-SD 4.47Å; L135-M139 HydrophobicContact CG-CG 4.36Å; L135-M139 WeakPolarHBondContact O-CB 3.34Å; L135-M139 WeakPolarHBondContact O-CG 3.48Å; L135-M139 PolarHBondContact O-N 3.03Å; M136-M139 PolarHBondContact O-N 3.27Å; D137-M139 PolarHBondContact O-N 2.73Å; M139-L142 HydrophobicContact CE-CD1 4.12Å; M139-L142 HydrophobicContact SD-CD1 4.4Å; M139-K143 WeakPolarHBondContact O-CG 3.47Å; M139-K143 PolarHBondContact O-N 3.33Å
140	N	97.1	Very high	95.7	Very high	70 Å²	70	66.6 Å²	66.6	37%	0.374	34%	0.337	S	S	.	.	H	α-helix	trans	-71.4	-44.1	176.8	-76.7	-27.1	0	0	0	111.8	M136 D137 C138 L142 K143	M136-N140 VanDerWaalsContact O-CB 3.31Å; M136-N140 WeakPolarHBondContact O-CB 3.43Å; M136-N140 PolarHBondContact O-N 2.98Å; M136-N140 PolarHBondContact O-ND2 2.74Å; D137-N140 PolarHBondContact O-N 3.46Å; D137-N140 VanDerWaalsContact O-N 3.1Å; C138-N140 VanDerWaalsContact C-N 3.31Å; C138-N140 PolarHBondContact O-N 2.72Å; N140-L142 VanDerWaalsContact C-N 3.33Å; N140-L142 PolarHBondContact O-N 3.02Å; N140-K143 WeakPolarHBondContact O-CB 3.48Å; N140-K143 PolarHBondContact O-N 3.27Å; N140-K143 PolarHBondContact OD1-NZ 3.48Å
141	K	96.7	Very high	96	Very high	75 Å²	75	65.3 Å²	65.3	33%	0.326	32%	0.322	S	S	.	.	H	α-helix	trans	-59	-44.4	173.9	-71.2	171.3	172.2	166.8	0	111.5	D103 Y104 D137 C138 K143 N144 N145	D103-K141 WeakPolarHBondContact O-CD 3.45Å; D103-K141 WeakPolarHBondContact O-CE 3.25Å; D103-K141 PolarHBondContact O-NZ 2.83Å; Y104-K141 HydrophobicContact CD1-CB 4.14Å; Y104-K141 HydrophobicContact CE1-CB 3.61Å; D137-K141 WeakPolarHBondContact O-CG 3.46Å; D137-K141 PolarHBondContact O-N 2.84Å; D137-K141 WeakPolarHBondContact OD1-CE 3.42Å; D137-K141 IonicContact OD1-NZ 3.09Å; D137-K141 WeakPolarHBondContact OD2-CE 3.35Å; D137-K141 IonicContact OD2-NZ 2.61Å; D137-K141 PolarHBondContact OD2-NZ 3.17Å; C138-K141 PolarHBondContact O-N 3.11Å; K141-K143 PolarHBondContact O-N 3.02Å; K141-K143 VanDerWaalsContact O-N 3.13Å; K141-N144 PolarHBondContact O-N 3.18Å; K141-N145 PolarHBondContact O-N 2.94Å
142	L	96.2	Very high	96.3	Very high	9 Å²	9	70.7 Å²	70.7	5%	0.047	34%	0.339	C	S	.	.	H	α-helix	trans	-62.6	-20.7	178.7	-72.2	172.1	0	0	0	114.1	L98 Y104 C138 M139 N140 N144 Y148	L98-L142 HydrophobicContact CD1-CD2 4.3Å; L98-L142 HydrophobicContact CD2-CD2 3.68Å; Y104-L142 HydrophobicContact CD1-CD2 3.85Å; Y104-L142 HydrophobicContact CD1-CG 3.91Å; Y104-L142 HydrophobicContact CE1-CD2 3.49Å; Y104-L142 VanDerWaalsContact CE1-CD2 3.49Å; Y104-L142 HydrophobicContact CE1-CG 3.72Å; C138-L142 WeakPolarHBondContact O-CB 3.15Å; C138-L142 WeakPolarHBondContact O-CG 3.08Å; C138-L142 PolarHBondContact O-N 2.92Å; M139-L142 HydrophobicContact CE-CD1 4.12Å; M139-L142 HydrophobicContact SD-CD1 4.4Å; N140-L142 VanDerWaalsContact C-N 3.33Å; N140-L142 PolarHBondContact O-N 3.02Å; L142-N144 PolarHBondContact O-N 2.79Å; L142-Y148 HydrophobicContact CB-CD1 3.75Å; L142-Y148 HydrophobicContact CB-CE1 3.82Å; L142-Y148 HydrophobicContact CB-CG 4.45Å; L142-Y148 HydrophobicContact CD1-CE1 4.22Å; L142-Y148 HydrophobicContact CD2-CD1 3.79Å; L142-Y148 HydrophobicContact CD2-CD2 3.93Å; L142-Y148 HydrophobicContact CD2-CE1 4.23Å; L142-Y148 HydrophobicContact CD2-CE2 4.37Å; L142-Y148 HydrophobicContact CD2-CG 3.6Å; L142-Y148 HydrophobicContact CG-CD1 4.23Å; L142-Y148 HydrophobicContact CG-CE1 4.32Å; L142-Y148 WeakPolarHBondContact O-CD1 3.27Å
143	K	96.3	Very high	96.5	Very high	131 Å²	131	73.4 Å²	73.4	57%	0.57	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-24	174.2	-70.5	167.7	-173.9	167.8	0	112.8	M139 N140 K141	M139-K143 WeakPolarHBondContact O-CG 3.47Å; M139-K143 PolarHBondContact O-N 3.33Å; N140-K143 WeakPolarHBondContact O-CB 3.48Å; N140-K143 PolarHBondContact O-N 3.27Å; N140-K143 PolarHBondContact OD1-NZ 3.48Å; K141-K143 PolarHBondContact O-N 3.02Å; K141-K143 VanDerWaalsContact O-N 3.13Å
144	N	95.9	Very high	96.7	Very high	137 Å²	137	72.7 Å²	72.7	73%	0.733	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.6	-6.3	-177.3	-60.9	-40.6	0	0	0	112.9	K141 L142 K146	K141-N144 PolarHBondContact O-N 3.18Å; L142-N144 PolarHBondContact O-N 2.79Å; N144-K146 PolarHBondContact O-N 3.22Å
145	N	96.4	Very high	96.8	Very high	31 Å²	31	73 Å²	73	17%	0.166	34%	0.336	C	S	.	.			trans	-76.9	107.9	177.8	-177.8	-41.3	0	0	0	110.6	Y104 K141 E147 Y148 L149	Y104-N145 WeakPolarHBondContact OH-CB 3.15Å; Y104-N145 PolarHBondContact OH-ND2 3.46Å; K141-N145 PolarHBondContact O-N 2.94Å; N145-E147 PolarHBondContact O-N 2.87Å; N145-E147 PolarHBondContact OD1-N 2.81Å; N145-Y148 PolarHBondContact O-N 2.8Å; N145-Y148 PolarHBondContact OD1-N 2.7Å; N145-L149 VanDerWaalsContact O-CG 3.25Å; N145-L149 WeakPolarHBondContact O-CG 3.34Å; N145-L149 PolarHBondContact O-N 2.92Å
146	K	96.5	Very high	96.9	Very high	184 Å²	184	74.4 Å²	74.4	80%	0.8	35%	0.347	S	S	*	.	H	α-helix	trans	-60.4	-41.5	-177.7	-66	-177.5	-178.4	177.6	0	113.2	N144 L149 E150	N144-K146 PolarHBondContact O-N 3.22Å; K146-L149 PolarHBondContact O-N 3.02Å; K146-E150 PolarHBondContact O-N 2.86Å
147	E	95.3	Very high	97	Very high	90 Å²	90	75.6 Å²	75.6	42%	0.421	35%	0.351	S	S	.	.	H	α-helix	trans	-65.2	-43.8	179.3	-176.9	175.7	-171.7	0	0	111.1	K97 N145 L149 E150 F151	K97-E147 WeakPolarHBondContact CD-OE1 3.2Å; K97-E147 IonicContact NZ-OE1 2.74Å; K97-E147 PolarHBondContact NZ-OE1 3.33Å; K97-E147 IonicContact NZ-OE2 2.63Å; N145-E147 PolarHBondContact O-N 2.87Å; N145-E147 PolarHBondContact OD1-N 2.81Å; E147-L149 PolarHBondContact O-N 3.4Å; E147-E150 PolarHBondContact O-N 2.76Å; E147-F151 WeakPolarHBondContact O-CB 3.45Å; E147-F151 PolarHBondContact O-N 3.37Å
148	Y	96	Very high	97.1	Very high	31 Å²	31	73.1 Å²	73.1	12%	0.122	34%	0.338	C	S	.	.	H	α-helix	trans	-66.2	-38.1	176.2	177.2	-105.2	0	0	0	112.7	L98 L142 N145 E150 F151 R152	L98-Y148 HydrophobicContact CD1-CD2 3.83Å; L98-Y148 HydrophobicContact CD1-CE2 4.18Å; L142-Y148 HydrophobicContact CB-CD1 3.75Å; L142-Y148 HydrophobicContact CB-CE1 3.82Å; L142-Y148 HydrophobicContact CB-CG 4.45Å; L142-Y148 HydrophobicContact CD1-CE1 4.22Å; L142-Y148 HydrophobicContact CD2-CD1 3.79Å; L142-Y148 HydrophobicContact CD2-CD2 3.93Å; L142-Y148 HydrophobicContact CD2-CE1 4.23Å; L142-Y148 HydrophobicContact CD2-CE2 4.37Å; L142-Y148 HydrophobicContact CD2-CG 3.6Å; L142-Y148 HydrophobicContact CG-CD1 4.23Å; L142-Y148 HydrophobicContact CG-CE1 4.32Å; L142-Y148 WeakPolarHBondContact O-CD1 3.27Å; N145-Y148 PolarHBondContact O-N 2.8Å; N145-Y148 PolarHBondContact OD1-N 2.7Å; Y148-E150 VanDerWaalsContact C-N 3.33Å; Y148-F151 AromaticContact CD2-CD1 3.83Å; Y148-F151 HydrophobicContact CD2-CD1 3.83Å; Y148-F151 HydrophobicContact CD2-CE1 4.41Å; Y148-F151 AromaticContact CE2-CD1 3.93Å; Y148-F151 HydrophobicContact CE2-CD1 3.93Å; Y148-F151 HydrophobicContact CE2-CE1 4.12Å; Y148-F151 WeakPolarHBondContact O-CB 3.19Å; Y148-F151 PolarHBondContact O-N 2.93Å; Y148-R152 VanDerWaalsContact O-CB 3.26Å; Y148-R152 WeakPolarHBondContact O-CB 3.25Å; Y148-R152 PolarHBondContact O-N 2.91Å
149	L	97.6	Very high	97.2	Very high	78 Å²	78	74 Å²	74	41%	0.408	34%	0.342	S	S	.	.	H	α-helix	trans	-63.3	-41.4	175.7	-71.4	174.5	0	0	0	111.4	N145 K146 E147 R152 R153	N145-L149 VanDerWaalsContact O-CG 3.25Å; N145-L149 WeakPolarHBondContact O-CG 3.34Å; N145-L149 PolarHBondContact O-N 2.92Å; K146-L149 PolarHBondContact O-N 3.02Å; E147-L149 PolarHBondContact O-N 3.4Å; L149-R152 PolarHBondContact O-N 3.47Å; L149-R153 WeakPolarHBondContact O-CB 3.22Å; L149-R153 PolarHBondContact O-N 3.37Å
150	E	97.9	Very high	97.3	Very high	76 Å²	76	77.3 Å²	77.3	36%	0.355	36%	0.36	S	S	.	.	H	α-helix	trans	-62.7	-52.7	174.6	-174	55.9	-126.4	0	0	111.3	K146 E147 Y148 R152 R153 E154	K146-E150 PolarHBondContact O-N 2.86Å; E147-E150 PolarHBondContact O-N 2.76Å; Y148-E150 VanDerWaalsContact C-N 3.33Å; E150-R152 PolarHBondContact O-N 2.89Å; E150-R153 WeakPolarHBondContact O-CA 3.38Å; E150-R153 WeakPolarHBondContact O-CB 3.49Å; E150-R153 PolarHBondContact O-N 2.93Å; E150-R153 IonicContact OE1-CZ 3.44Å; E150-R153 IonicContact OE1-NE 3.02Å; E150-R153 PolarHBondContact OE1-NE 3.17Å; E150-R153 IonicContact OE1-NH2 3.52Å; E150-R153 PolarHBondContact OE1-NH2 3.09Å; E150-R153 IonicContact OE2-CZ 3.94Å; E150-R153 IonicContact OE2-NE 2.95Å; E150-R153 PolarHBondContact OE2-NE 2.95Å; E150-R153 IonicContact OE2-NH1 2.62Å; E150-R153 IonicContact OE2-NH2 3.14Å; E150-R153 PolarHBondContact OE2-NH2 3.35Å; E150-E154 PolarHBondContact O-N 2.95Å
151	F	97.7	Very high	97.3	Very high	5 Å²	5	76.7 Å²	76.7	2%	0.022	36%	0.361	C	S	.	.	H	α-helix	trans	-49.6	-47.1	173.2	164	-105.1	0	0	0	111.8	L90 T91 V94 L95 E147 Y148 R153 R155	L90-F151 HydrophobicContact CD1-CD2 3.89Å; L90-F151 HydrophobicContact CD2-CD2 4.01Å; L90-F151 HydrophobicContact CD2-CE2 4.24Å; L90-F151 HydrophobicContact CG-CD2 3.6Å; L90-F151 HydrophobicContact CG-CE2 3.82Å; T91-F151 HydrophobicContact CG2-CE2 4.13Å; T91-F151 HydrophobicContact CG2-CZ 4.16Å; V94-F151 HydrophobicContact CB-CB 4.49Å; V94-F151 HydrophobicContact CB-CD2 3.77Å; V94-F151 HydrophobicContact CB-CE2 4.15Å; V94-F151 HydrophobicContact CB-CG 4.1Å; V94-F151 HydrophobicContact CG1-CB 4.01Å; V94-F151 HydrophobicContact CG1-CD1 4.12Å; V94-F151 HydrophobicContact CG1-CD2 3.98Å; V94-F151 HydrophobicContact CG1-CG 3.77Å; V94-F151 HydrophobicContact CG2-CB 4.09Å; V94-F151 HydrophobicContact CG2-CD2 3.7Å; V94-F151 HydrophobicContact CG2-CE2 4.45Å; V94-F151 HydrophobicContact CG2-CG 4.1Å; L95-F151 HydrophobicContact CD2-CE1 4.22Å; L95-F151 HydrophobicContact CD2-CZ 3.93Å; E147-F151 WeakPolarHBondContact O-CB 3.45Å; E147-F151 PolarHBondContact O-N 3.37Å; Y148-F151 AromaticContact CD2-CD1 3.83Å; Y148-F151 HydrophobicContact CD2-CD1 3.83Å; Y148-F151 HydrophobicContact CD2-CE1 4.41Å; Y148-F151 AromaticContact CE2-CD1 3.93Å; Y148-F151 HydrophobicContact CE2-CD1 3.93Å; Y148-F151 HydrophobicContact CE2-CE1 4.12Å; Y148-F151 WeakPolarHBondContact O-CB 3.19Å; Y148-F151 PolarHBondContact O-N 2.93Å; F151-R153 VanDerWaalsContact C-N 3.32Å; F151-R153 PolarHBondContact O-N 2.79Å; F151-R155 WeakPolarHBondContact O-CB 3.36Å; F151-R155 PolarHBondContact O-N 3.07Å
152	R	97.4	Very high	97.4	Very high	123 Å²	123	78.2 Å²	78.2	46%	0.464	37%	0.365	S	S	.	.	H	α-helix	trans	-64.2	-38.2	179.9	-178.5	177	-174.8	178.7	2.1	111.8	Y148 L149 E150 S156	Y148-R152 VanDerWaalsContact O-CB 3.26Å; Y148-R152 WeakPolarHBondContact O-CB 3.25Å; Y148-R152 PolarHBondContact O-N 2.91Å; L149-R152 PolarHBondContact O-N 3.47Å; E150-R152 PolarHBondContact O-N 2.89Å; R152-S156 WeakPolarHBondContact O-CB 3.48Å; R152-S156 PolarHBondContact O-N 2.83Å; R152-S156 PolarHBondContact O-OG 2.97Å
153	R	98.2	Very high	97.4	Very high	156 Å²	156	82 Å²	82	59%	0.589	38%	0.379	S	S	*	.	H	α-helix	trans	-65.8	-54.2	178.2	-180	178.9	69.6	165.5	5	110.6	L149 E150 F151 S156	L149-R153 WeakPolarHBondContact O-CB 3.22Å; L149-R153 PolarHBondContact O-N 3.37Å; E150-R153 WeakPolarHBondContact O-CA 3.38Å; E150-R153 WeakPolarHBondContact O-CB 3.49Å; E150-R153 PolarHBondContact O-N 2.93Å; E150-R153 IonicContact OE1-CZ 3.44Å; E150-R153 IonicContact OE1-NE 3.02Å; E150-R153 PolarHBondContact OE1-NE 3.17Å; E150-R153 IonicContact OE1-NH2 3.52Å; E150-R153 PolarHBondContact OE1-NH2 3.09Å; E150-R153 IonicContact OE2-CZ 3.94Å; E150-R153 IonicContact OE2-NE 2.95Å; E150-R153 PolarHBondContact OE2-NE 2.95Å; E150-R153 IonicContact OE2-NH1 2.62Å; E150-R153 IonicContact OE2-NH2 3.14Å; E150-R153 PolarHBondContact OE2-NH2 3.35Å; F151-R153 VanDerWaalsContact C-N 3.32Å; F151-R153 PolarHBondContact O-N 2.79Å; R153-S156 PolarHBondContact O-N 3.42Å
154	E	98.3	Very high	97.5	Very high	84 Å²	84	80 Å²	80	39%	0.393	37%	0.374	S	S	.	.	H	α-helix	trans	-60.4	-52.6	-179.9	-172.5	-178.3	161	0	0	111.2	L90 E150 S156 Q157 M158	L90-E154 HydrophobicContact CD2-CB 3.97Å; L90-E154 HydrophobicContact CD2-CG 3.87Å; E150-E154 PolarHBondContact O-N 2.95Å; E154-S156 PolarHBondContact O-N 3.19Å; E154-S156 VanDerWaalsContact O-N 3.08Å; E154-Q157 WeakPolarHBondContact O-CB 3.19Å; E154-Q157 PolarHBondContact O-N 3.13Å; E154-M158 HydrophobicContact CG-CE 3.88Å
155	R	98	Very high	97.6	Very high	16 Å²	16	73.8 Å²	73.8	6%	0.06	34%	0.341	C	S	.	.	H	α-helix	trans	-53	-36.7	176.8	-174	-163.4	66.2	-162	-0.9	112.2	Y87 L90 F151 Q157 M158 L159	Y87-R155 HydrophobicContact CD2-CG 3.83Å; Y87-R155 HydrophobicContact CE2-CG 3.42Å; Y87-R155 VanDerWaalsContact CE2-CG 3.42Å; L90-R155 HydrophobicContact CD2-CB 3.89Å; F151-R155 WeakPolarHBondContact O-CB 3.36Å; F151-R155 PolarHBondContact O-N 3.07Å; R155-Q157 PolarHBondContact O-N 2.9Å; R155-M158 PolarHBondContact O-N 3.5Å; R155-M158 VanDerWaalsContact O-N 3.16Å; R155-L159 HydrophobicContact CG-CD1 4.1Å; R155-L159 VanDerWaalsContact O-CG 3.31Å; R155-L159 WeakPolarHBondContact O-CG 3.16Å
156	S	97.6	Very high	97.7	Very high	43 Å²	43	73.3 Å²	73.3	30%	0.301	34%	0.338	S	S	.	.	H	α-helix	trans	-69.1	-20.9	-176.4	-61.6	0	0	0	0	113.4	R152 R153 E154 M158 R162	R152-S156 WeakPolarHBondContact O-CB 3.48Å; R152-S156 PolarHBondContact O-N 2.83Å; R152-S156 PolarHBondContact O-OG 2.97Å; R153-S156 PolarHBondContact O-N 3.42Å; E154-S156 PolarHBondContact O-N 3.19Å; E154-S156 VanDerWaalsContact O-N 3.08Å; S156-M158 VanDerWaalsContact C-N 3.27Å; S156-M158 PolarHBondContact O-N 2.89Å; S156-R162 PolarHBondContact OG-NH1 3.44Å
157	Q	98.1	Very high	97.7	Very high	131 Å²	131	64.6 Å²	64.6	61%	0.612	30%	0.3	S	S	*	.	H	α-helix	trans	-72.7	-23.1	174	-57.5	-56.2	-31.8	0	0	112.7	K80 E154 R155	K80-Q157 PolarHBondContact NZ-O 2.7Å; E154-Q157 WeakPolarHBondContact O-CB 3.19Å; E154-Q157 PolarHBondContact O-N 3.13Å; R155-Q157 PolarHBondContact O-N 2.9Å
158	M	98.7	Very high	97.6	Very high	13 Å²	13	61.7 Å²	61.7	6%	0.064	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-3.7	-174.8	-57.8	170.9	-179	0	0	113.4	V79 K80 Y83 A86 L90 E154 R155 S156	V79-M158 HydrophobicContact CG1-CB 4.38Å; V79-M158 VanDerWaalsContact CG1-O 3.25Å; V79-M158 WeakPolarHBondContact CG1-O 3.31Å; K80-M158 WeakPolarHBondContact CB-O 3.16Å; K80-M158 PolarHBondContact N-O 2.94Å; Y83-M158 HydrophobicContact CD1-CG 3.88Å; Y83-M158 HydrophobicContact CG-CB 4.14Å; Y83-M158 HydrophobicContact CG-CG 4Å; A86-M158 HydrophobicContact CB-CE 4.09Å; A86-M158 HydrophobicContact CB-SD 4.44Å; L90-M158 HydrophobicContact CD2-CE 4.19Å; L90-M158 HydrophobicContact CD2-SD 4.26Å; E154-M158 HydrophobicContact CG-CE 3.88Å; R155-M158 PolarHBondContact O-N 3.5Å; R155-M158 VanDerWaalsContact O-N 3.16Å; S156-M158 VanDerWaalsContact C-N 3.27Å; S156-M158 PolarHBondContact O-N 2.89Å
159	L	98.4	Very high	97.5	Very high	20 Å²	20	60.6 Å²	60.6	11%	0.105	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	141.9	-168	-64.1	172.6	0	0	0	112.9	H77 V79 Y87 R155 R162	H77-L159 HydrophobicContact CB-CD2 3.83Å; V79-L159 HydrophobicContact CB-CD2 4.38Å; V79-L159 HydrophobicContact CG2-CD2 3.93Å; Y87-L159 HydrophobicContact CD2-CD2 4.01Å; Y87-L159 HydrophobicContact CE2-CD2 3.76Å; R155-L159 HydrophobicContact CG-CD1 4.1Å; R155-L159 VanDerWaalsContact O-CG 3.31Å; R155-L159 WeakPolarHBondContact O-CG 3.16Å; L159-R162 VanDerWaalsContact CD1-CD 3.42Å; L159-R162 HydrophobicContact CD1-CG 3.59Å
160	L	98.3	Very high	97.3	Very high	120 Å²	120	56.9 Å²	56.9	63%	0.628	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.7	-46.9	165.6	-67.2	172.3	0	0	0	110.5	N78 K80	N78-L160 HydrophobicContact CB-CB 4.25Å; N78-L160 PolarHBondContact O-N 2.95Å; K80-L160 HydrophobicContact CG-CD2 3.76Å; K80-L160 HydrophobicContact CG-CG 3.83Å
161	S	98.3	Very high	96.9	Very high	58 Å²	58	55.8 Å²	55.8	41%	0.406	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157	165.7	-179.9	77.8	0	0	0	0	111.9	N78	N78-S161 WeakPolarHBondContact CB-OG 3.34Å; N78-S161 PolarHBondContact N-O 3.12Å; N78-S161 PolarHBondContact ND2-OG 3.46Å; N78-S161 PolarHBondContact O-N 3.31Å
162	R	97.8	Very high	96.5	Very high	107 Å²	107	57.5 Å²	57.5	40%	0.404	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	143.5	173	-64.1	-172.2	-72.3	-131.4	1.3	110.6	F76 H77 S156 L159	F76-R162 WeakPolarHBondContact O-CA 3.38Å; H77-R162 HydrophobicContact CB-CG 4.44Å; H77-R162 VanDerWaalsContact CD2-CG 3.45Å; H77-R162 WeakPolarHBondContact CD2-CG 3.32Å; H77-R162 WeakPolarHBondContact NE2-CD 3.35Å; S156-R162 PolarHBondContact OG-NH1 3.44Å; L159-R162 VanDerWaalsContact CD1-CD 3.42Å; L159-R162 HydrophobicContact CD1-CG 3.59Å
163	R	97.5	Very high	96.2	Very high	87 Å²	87	52 Å²	52	33%	0.328	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	152	166	60.9	-179.4	-175.8	106.3	-2.1	110.4	Q75 F76	Q75-R163 WeakPolarHBondContact CA-O 3.16Å; F76-R163 HydrophobicContact CB-CG 3.7Å; F76-R163 VanDerWaalsContact CD1-NH2 3.34Å; F76-R163 HydrophobicContact CD2-CG 3.91Å; F76-R163 VanDerWaalsContact CE2-NH1 3.32Å; F76-R163 HydrophobicContact CG-CG 4.17Å; F76-R163 VanDerWaalsContact CG-CZ 3.48Å; F76-R163 PolarHBondContact N-O 2.8Å; F76-R163 PolarHBondContact O-N 3.45Å
164	N	97.3	Very high	95.4	Very high	90 Å²	90	47.6 Å²	47.6	48%	0.481	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	161.1	170.2	68	34.5	0	0	0	110.7	K73 I74 Q75	K73-N164 HydrophobicContact CG-CB 4.42Å; I74-N164 CarbonylContact O-C 3.5Å; I74-N164 WeakPolarHBondContact O-CA 3.49Å; I74-N164 VanDerWaalsContact O-CB 3.29Å; I74-N164 WeakPolarHBondContact O-CB 3.46Å; Q75-N164 HydrophobicContact CB-CB 4.32Å; Q75-N164 HydrophobicContact CG-CB 3.87Å
165	Q	97.8	Very high	94.9	Very high	7 Å²	7	46.4 Å²	46.4	3%	0.033	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	144.2	175.3	-67.2	168.9	-76.8	0	0	108.9	K73 I74 L167 I225 E227 H232	K73-Q165 WeakPolarHBondContact CA-O 3.24Å; I74-Q165 HydrophobicContact CG2-CB 3.94Å; I74-Q165 PolarHBondContact N-O 2.86Å; I74-Q165 PolarHBondContact O-N 3.14Å; Q165-L167 HydrophobicContact CB-CD2 3.76Å; Q165-I225 WeakPolarHBondContact CA-O 3.13Å; Q165-E227 PolarHBondContact NE2-O 3.38Å; Q165-H232 PolarHBondContact OE1-NE2 3.23Å
166	L	97.9	Very high	94.6	Very high	21 Å²	21	45.9 Å²	45.9	11%	0.11	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	131.8	167.5	-62.4	175.5	0	0	0	108.9	L71 Y72 K73 Y132 L135 Q224 I225	L71-L166 HydrophobicContact CD1-CB 4.3Å; L71-L166 HydrophobicContact CD2-CD1 4.36Å; L71-L166 HydrophobicContact CD2-CD2 4.32Å; L71-L166 HydrophobicContact CG-CD2 4.49Å; Y72-L166 CarbonylContact O-C 3.6Å; Y72-L166 VanDerWaalsContact O-CA 3.3Å; Y72-L166 WeakPolarHBondContact O-CA 3.45Å; K73-L166 HydrophobicContact CB-CD2 3.77Å; K73-L166 HydrophobicContact CD-CD2 4.35Å; K73-L166 HydrophobicContact CG-CD2 3.93Å; Y132-L166 HydrophobicContact CE1-CD1 4Å; L135-L166 HydrophobicContact CD2-CD1 3.69Å; L135-L166 HydrophobicContact CD2-CD2 3.77Å; L135-L166 HydrophobicContact CD2-CG 4.41Å; L166-Q224 PolarHBondContact O-N 2.92Å; L166-I225 HydrophobicContact CB-CB 4.09Å; L166-I225 HydrophobicContact CD1-CB 4.21Å; L166-I225 HydrophobicContact CD1-CD1 4.06Å; L166-I225 HydrophobicContact CD1-CG1 4.41Å; L166-I225 HydrophobicContact CG-CB 4.43Å; L166-I225 PolarHBondContact N-O 2.76Å; L166-I225 PolarHBondContact O-N 3.37Å
167	L	96.8	Very high	94.2	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	153.3	-170.4	-43.1	175.6	0	0	0	110.7	Y72 I74 Q165 F221 F222	Y72-L167 PolarHBondContact N-O 3.06Å; Y72-L167 PolarHBondContact O-N 3.36Å; I74-L167 HydrophobicContact CB-CD1 3.89Å; I74-L167 HydrophobicContact CG2-CD1 3.65Å; I74-L167 HydrophobicContact CG2-CD2 4.29Å; I74-L167 HydrophobicContact CG2-CG 4.12Å; Q165-L167 HydrophobicContact CB-CD2 3.76Å; L167-F221 HydrophobicContact CB-CB 3.97Å; L167-F221 HydrophobicContact CD1-CB 3.68Å; L167-F221 HydrophobicContact CD1-CG 4.12Å; L167-F221 HydrophobicContact CG-CB 4.42Å; L167-F222 VanDerWaalsContact CA-O 3.28Å; L167-F222 WeakPolarHBondContact CA-O 3.42Å
168	L	94.8	Very high	93.8	Very high	30 Å²	30	47 Å²	47	16%	0.157	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	151.5	161.3	-67.4	172.1	0	0	0	109.4	L71 F221 F222 Q224	L71-L168 HydrophobicContact CD1-CD2 4.25Å; L168-F221 CarbonylContact O-C 3.52Å; L168-F221 WeakPolarHBondContact O-CA 3.3Å; L168-F222 HydrophobicContact CB-CD1 4.38Å; L168-F222 HydrophobicContact CB-CE1 3.75Å; L168-F222 HydrophobicContact CB-CE2 4.14Å; L168-F222 HydrophobicContact CB-CZ 3.62Å; L168-F222 HydrophobicContact CD1-CE2 4.24Å; L168-F222 HydrophobicContact CD1-CZ 4.02Å; L168-F222 HydrophobicContact CG-CZ 4.46Å; L168-F222 PolarHBondContact N-O 3.26Å; L168-F222 WeakPolarHBondContact O-CD1 3.44Å; L168-F222 PolarHBondContact O-N 2.86Å; L168-Q224 HydrophobicContact CB-CG 4.36Å; L168-Q224 VanDerWaalsContact CD1-CD 3.49Å; L168-Q224 HydrophobicContact CD1-CG 3.6Å; L168-Q224 HydrophobicContact CG-CG 3.54Å
169	E	93.3	Very high	93.3	Very high	7 Å²	7	49 Å²	49	3%	0.033	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	145.8	172	64.8	-170.3	179.6	0	0	111.1	S64 K65 T68 Y72 G220 F221	S64-E169 WeakPolarHBondContact CA-O 3.46Å; K65-E169 HydrophobicContact CG-CG 4.47Å; T68-E169 PolarHBondContact OG1-OE1 3.1Å; Y72-E169 HydrophobicContact CD2-CB 4.44Å; Y72-E169 HydrophobicContact CE2-CB 3.86Å; Y72-E169 HydrophobicContact CE2-CG 4.07Å; Y72-E169 WeakPolarHBondContact CE2-OE2 3.46Å; Y72-E169 PolarHBondContact OH-OE2 2.92Å; E169-G220 WeakPolarHBondContact CA-O 3.33Å; E169-F221 HydrophobicContact CB-CD1 4.14Å; E169-F221 HydrophobicContact CB-CE1 4.27Å
170	F	93	Very high	92.5	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-70.9	138.9	169.6	-73.2	-70.7	0	0	0	111	L63 F172 W173 M197 W200 G220 F222 V231	L63-F170 HydrophobicContact CB-CD1 4.13Å; L63-F170 HydrophobicContact CB-CE1 4.28Å; L63-F170 HydrophobicContact CD1-CE1 4.23Å; L63-F170 HydrophobicContact CD2-CE1 4.45Å; L63-F170 CarbonylContact O-C 3.6Å; L63-F170 WeakPolarHBondContact O-CA 3.37Å; F170-F172 VanDerWaalsContact C-N 3.27Å; F170-F172 HydrophobicContact CB-CD1 4.21Å; F170-F172 HydrophobicContact CB-CD2 4.25Å; F170-F172 HydrophobicContact CB-CE1 3.87Å; F170-F172 HydrophobicContact CB-CE2 3.92Å; F170-F172 HydrophobicContact CB-CG 4.41Å; F170-F172 HydrophobicContact CB-CZ 3.72Å; F170-F172 AromaticContact CD1-CE1 3.58Å; F170-F172 HydrophobicContact CD1-CE1 3.58Å; F170-F172 HydrophobicContact CD1-CE2 4.46Å; F170-F172 AromaticContact CD1-CZ 3.51Å; F170-F172 HydrophobicContact CD1-CZ 3.51Å; F170-F172 HydrophobicContact CD2-CZ 4.23Å; F170-F172 HydrophobicContact CE1-CE1 4.37Å; F170-F172 HydrophobicContact CE1-CZ 4.13Å; F170-F172 AromaticContact CG-CE1 3.94Å; F170-F172 HydrophobicContact CG-CE1 3.94Å; F170-F172 HydrophobicContact CG-CE2 4.09Å; F170-F172 AromaticContact CG-CZ 3.56Å; F170-F172 HydrophobicContact CG-CZ 3.56Å; F170-F172 PolarHBondContact O-N 2.91Å; F170-W173 HydrophobicContact CB-CB 4.15Å; F170-W173 PolarHBondContact O-N 2.89Å; F170-W173 VanDerWaalsContact O-N 3.15Å; F170-M197 HydrophobicContact CZ-SD 4.24Å; F170-W200 HydrophobicContact CE2-CZ3 4.36Å; F170-W200 HydrophobicContact CZ-CZ3 4.21Å; F170-G220 PolarHBondContact N-O 3.18Å; F170-F222 AromaticContact CD1-CD1 3.73Å; F170-F222 HydrophobicContact CD1-CD1 3.73Å; F170-F222 HydrophobicContact CD1-CE1 4.02Å; F170-F222 HydrophobicContact CD2-CD1 4.28Å; F170-F222 HydrophobicContact CE1-CB 4.27Å; F170-F222 AromaticContact CE1-CD1 3.57Å; F170-F222 HydrophobicContact CE1-CD1 3.57Å; F170-F222 HydrophobicContact CE1-CE1 4.18Å; F170-F222 HydrophobicContact CE1-CG 4.12Å; F170-F222 HydrophobicContact CE2-CB 4.16Å; F170-F222 HydrophobicContact CE2-CD1 4.12Å; F170-F222 HydrophobicContact CG-CD1 4.09Å; F170-F222 HydrophobicContact CZ-CB 3.74Å; F170-F222 AromaticContact CZ-CD1 3.78Å; F170-F222 HydrophobicContact CZ-CD1 3.78Å; F170-F222 HydrophobicContact CZ-CG 4.08Å; F170-V231 HydrophobicContact CE2-CG1 3.7Å; F170-V231 HydrophobicContact CE2-CG2 4.22Å; F170-V231 HydrophobicContact CZ-CG1 4.2Å; F170-V231 HydrophobicContact CZ-CG2 3.89Å
171	S	90.3	Very high	91.6	Very high	54 Å²	54	52.2 Å²	52.2	38%	0.378	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-32.1	-179.3	59	0	0	0	0	113.9	L63 K65 W173	L63-S171 PolarHBondContact O-N 3.35Å; L63-S171 PolarHBondContact O-OG 3.45Å; K65-S171 WeakPolarHBondContact CE-O 3.19Å; S171-W173 VanDerWaalsContact C-N 3.3Å
172	F	89.3	Confident	91.1	Very high	40 Å²	40	54.6 Å²	54.6	18%	0.175	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	4	179.1	56	-100.3	0	0	0	113.7	F170 G201 W204 A205 I208	F170-F172 VanDerWaalsContact C-N 3.27Å; F170-F172 HydrophobicContact CB-CD1 4.21Å; F170-F172 HydrophobicContact CB-CD2 4.25Å; F170-F172 HydrophobicContact CB-CE1 3.87Å; F170-F172 HydrophobicContact CB-CE2 3.92Å; F170-F172 HydrophobicContact CB-CG 4.41Å; F170-F172 HydrophobicContact CB-CZ 3.72Å; F170-F172 AromaticContact CD1-CE1 3.58Å; F170-F172 HydrophobicContact CD1-CE1 3.58Å; F170-F172 HydrophobicContact CD1-CE2 4.46Å; F170-F172 AromaticContact CD1-CZ 3.51Å; F170-F172 HydrophobicContact CD1-CZ 3.51Å; F170-F172 HydrophobicContact CD2-CZ 4.23Å; F170-F172 HydrophobicContact CE1-CE1 4.37Å; F170-F172 HydrophobicContact CE1-CZ 4.13Å; F170-F172 AromaticContact CG-CE1 3.94Å; F170-F172 HydrophobicContact CG-CE1 3.94Å; F170-F172 HydrophobicContact CG-CE2 4.09Å; F170-F172 AromaticContact CG-CZ 3.56Å; F170-F172 HydrophobicContact CG-CZ 3.56Å; F170-F172 PolarHBondContact O-N 2.91Å; F172-G201 WeakPolarHBondContact CZ-O 3.36Å; F172-W204 HydrophobicContact CE2-CB 4.08Å; F172-W204 HydrophobicContact CZ-CB 4.2Å; F172-A205 HydrophobicContact CB-CB 4.12Å; F172-A205 HydrophobicContact CD1-CB 3.54Å; F172-A205 HydrophobicContact CD2-CB 4.18Å; F172-A205 HydrophobicContact CE1-CB 3.9Å; F172-A205 HydrophobicContact CE2-CB 4.48Å; F172-A205 HydrophobicContact CG-CB 3.68Å; F172-A205 HydrophobicContact CZ-CB 4.36Å; F172-I208 HydrophobicContact CD2-CG2 4.1Å
173	W	89.5	Confident	91	Very high	7 Å²	7	50.4 Å²	50.4	3%	0.027	27%	0.274	C	S	.	.	S	Bend	trans	-103.4	154.7	178.8	-145.8	-76.9	0	0	0	112.4	K65 F170 S171 W204 I208 A217 G219 G220 H233 W235	K65-W173 PolarHBondContact NZ-O 2.9Å; F170-W173 HydrophobicContact CB-CB 4.15Å; F170-W173 PolarHBondContact O-N 2.89Å; F170-W173 VanDerWaalsContact O-N 3.15Å; S171-W173 VanDerWaalsContact C-N 3.3Å; W173-W204 HydrophobicContact CH2-CE3 4.35Å; W173-W204 HydrophobicContact CH2-CZ3 4.27Å; W173-W204 HydrophobicContact CZ3-CE3 4.09Å; W173-W204 HydrophobicContact CZ3-CZ3 4.47Å; W173-I208 HydrophobicContact CD2-CD1 4.04Å; W173-I208 HydrophobicContact CD2-CG1 4.1Å; W173-I208 HydrophobicContact CE3-CD1 3.91Å; W173-I208 HydrophobicContact CE3-CG1 3.91Å; W173-I208 HydrophobicContact CH2-CD1 3.38Å; W173-I208 HydrophobicContact CH2-CG1 4.29Å; W173-I208 HydrophobicContact CZ2-CD1 3.52Å; W173-I208 HydrophobicContact CZ2-CG1 4.47Å; W173-I208 HydrophobicContact CZ3-CB 4.48Å; W173-I208 HydrophobicContact CZ3-CD1 3.58Å; W173-I208 HydrophobicContact CZ3-CG1 4Å; W173-A217 HydrophobicContact CZ2-CB 4.35Å; W173-G219 VanDerWaalsContact NE1-CA 3.33Å; W173-G219 PolarHBondContact NE1-O 3.45Å; W173-G220 VanDerWaalsContact CG-N 3.34Å; W173-H233 HydrophobicContact CH2-CB 4.09Å; W173-H233 AromaticContact CH2-CD2 3.32Å; W173-H233 WeakPolarHBondContact CH2-CD2 3.3Å; W173-H233 AromaticContact CH2-CE1 3.54Å; W173-H233 AromaticContact CH2-CG 3.47Å; W173-H233 VanDerWaalsContact CH2-CG 3.47Å; W173-H233 AromaticContact CH2-ND1 3.63Å; W173-H233 AromaticContact CH2-NE2 3.39Å; W173-H233 WeakPolarHBondContact CH2-NE2 3.39Å; W173-H233 HydrophobicContact CZ2-CB 4.25Å; W173-H233 AromaticContact CZ3-CD2 3.51Å; W173-H233 AromaticContact CZ3-CE1 3.64Å; W173-H233 AromaticContact CZ3-NE2 3.2Å; W173-H233 WeakPolarHBondContact CZ3-NE2 3.43Å; W173-W235 AromaticContact CH2-CH2 3.43Å; W173-W235 HydrophobicContact CH2-CH2 3.43Å; W173-W235 VanDerWaalsContact CH2-CH2 3.43Å; W173-W235 AromaticContact CH2-CZ2 3.53Å; W173-W235 HydrophobicContact CH2-CZ2 3.53Å; W173-W235 HydrophobicContact CH2-CZ3 4.34Å; W173-W235 AromaticContact CZ2-CH2 3.45Å; W173-W235 HydrophobicContact CZ2-CH2 3.45Å; W173-W235 VanDerWaalsContact CZ2-CH2 3.45Å; W173-W235 AromaticContact CZ2-CZ2 3.68Å; W173-W235 HydrophobicContact CZ2-CZ2 3.68Å; W173-W235 AromaticContact CZ2-CZ3 3.93Å; W173-W235 HydrophobicContact CZ2-CZ3 3.93Å
174	N	83.1	Confident	91	Very high	64 Å²	64	47.2 Å²	47.2	34%	0.342	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-60.2	142.8	170.8	-61.2	-13.1	0	0	0	110.3	Q212 A217	N174-Q212 PolarHBondContact OD1-NE2 3.34Å; N174-A217 PolarHBondContact ND2-O 3.49Å; N174-A217 VanDerWaalsContact ND2-O 3.07Å
175	E	86.9	Confident	91	Very high	59 Å²	59	43 Å²	43	28%	0.276	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-70.7	140.2	163.1	-171.8	174.9	-164.7	0	0	108.7	N70 R127 Q177	N70-E175 PolarHBondContact ND2-OE1 3.48Å; R127-E175 IonicContact CZ-OE1 3.75Å; R127-E175 IonicContact NH1-OE1 3.94Å; R127-E175 PolarHBondContact NH1-OE1 2.9Å; E175-Q177 PolarHBondContact O-N 3.29Å; E175-Q177 PolarHBondContact OE2-NE2 3.23Å
176	P	91.6	Very high	91	Very high	6 Å²	6	42.6 Å²	42.6	4%	0.039	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-61.1	119.3	172.7	-21	32.5	0	0	0	110.6	V109 V218 F221 L283	V109-P176 HydrophobicContact CG1-CB 3.58Å; V109-P176 HydrophobicContact CG1-CG 4.06Å; P176-V218 WeakPolarHBondContact CA-O 3.34Å; P176-V218 HydrophobicContact CB-CG1 4.2Å; P176-F221 HydrophobicContact CG-CE1 4.47Å; P176-F221 HydrophobicContact CG-CZ 3.77Å; P176-L283 HydrophobicContact CB-CD1 4.45Å; P176-L283 HydrophobicContact CB-CD2 4.19Å
177	Q	89.7	Confident	91	Very high	104 Å²	104	41.9 Å²	41.9	49%	0.486	24%	0.235	S	C	.	.			trans	-125.6	149.7	176.8	-63.8	-61.9	-22.7	0	0	109.9	E175 R179 L283	E175-Q177 PolarHBondContact O-N 3.29Å; E175-Q177 PolarHBondContact OE2-NE2 3.23Å; Q177-R179 VanDerWaalsContact O-CG 3.23Å; Q177-R179 WeakPolarHBondContact O-CG 3.22Å; Q177-L283 VanDerWaalsContact C-CD2 3.45Å; Q177-L283 WeakPolarHBondContact O-CD2 3.28Å
178	P	89.8	Confident	91.1	Very high	93 Å²	93	43.7 Å²	43.7	60%	0.604	24%	0.242	S	C	*	.			trans	-50.2	147	175.3	-26.8	35	0	0	0	112.6	P282	P178-P282 WeakPolarHBondContact CB-O 3.03Å
179	R	87.3	Confident	91.3	Very high	55 Å²	55	42.6 Å²	42.6	21%	0.208	24%	0.236	C	C	.	.			trans	-136.1	138.5	-173.3	-38.6	-171	85.5	-121.9	-11.5	110.2	Q177 G181 Q215 A236 L283 Q284	Q177-R179 VanDerWaalsContact O-CG 3.23Å; Q177-R179 WeakPolarHBondContact O-CG 3.22Å; R179-G181 PolarHBondContact O-N 2.78Å; R179-G181 VanDerWaalsContact O-N 3.14Å; R179-Q215 VanDerWaalsContact CZ-O 3.22Å; R179-Q215 PolarHBondContact NH1-O 3.08Å; R179-Q215 PolarHBondContact NH2-O 2.57Å; R179-A236 VanDerWaalsContact NH1-CB 3.35Å; R179-L283 PolarHBondContact N-O 3.42Å; R179-Q284 CarbonylContact O-C 3.16Å
180	L	83.3	Confident	91.5	Very high	171 Å²	171	42.9 Å²	42.9	90%	0.895	24%	0.237	S	C	*	.			trans	-56.8	118.6	171.7	-91.7	137.1	0	0	0	110.9	N183	L180-N183 PolarHBondContact O-ND2 3.4Å
181	G	78.1	Confident	91.8	Very high	36 Å²	36	46.1 Å²	46.1	37%	0.371	25%	0.251	S	S	.	.	S	Bend	trans	-99.8	-179	178.8	0	0	0	0	0	115	R179	R179-G181 PolarHBondContact O-N 2.78Å; R179-G181 VanDerWaalsContact O-N 3.14Å
182	P	88.4	Confident	92.1	Very high	109 Å²	109	43.8 Å²	43.8	71%	0.708	23%	0.234	S	C	*	.			cis	-76.6	144.1	5	30.6	-35	0	0	0	113.4
183	N	95.1	Very high	92.6	Very high	19 Å²	19	46.1 Å²	46.1	10%	0.102	24%	0.244	C	C	.	.			trans	-130.1	149.2	176.8	-68.7	-64.7	0	0	0	111.3	L180 Y185 Y237 P277	L180-N183 PolarHBondContact O-ND2 3.4Å; N183-Y185 HydrophobicContact CB-CE2 3.85Å; N183-Y237 CarbonylContact C-O 3.53Å; N183-Y237 WeakPolarHBondContact CA-O 3.38Å; N183-P277 VanDerWaalsContact O-CD 3.27Å; N183-P277 WeakPolarHBondContact O-CD 3.44Å; N183-P277 WeakPolarHBondContact O-CG 3.48Å
184	I	97	Very high	92.8	Very high	20 Å²	20	49 Å²	49	10%	0.103	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	152.1	160.3	66.3	167.9	0	0	0	109.9	A236 Y237 D239 L240 I274	I184-A236 WeakPolarHBondContact O-CA 3.39Å; I184-Y237 PolarHBondContact N-O 3.48Å; I184-Y237 PolarHBondContact O-N 2.88Å; I184-D239 VanDerWaalsContact CD1-C 3.44Å; I184-L240 HydrophobicContact CD1-CD2 3.61Å; I184-L240 HydrophobicContact CD1-CG 3.94Å; I184-I274 HydrophobicContact CB-CG2 4.49Å; I184-I274 HydrophobicContact CD1-CG2 4.08Å
185	Y	97.9	Very high	93.2	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	142.7	-178.2	-67.4	-105	0	0	0	110.6	W112 N183 V218 L234 W235 A236 I274 M275 P277 L283	W112-Y185 AromaticContact CD1-CD2 3.58Å; W112-Y185 AromaticContact CD1-CG 3.83Å; W112-Y185 AromaticContact CE2-CG 3.96Å; W112-Y185 HydrophobicContact CZ2-CD1 4Å; W112-Y185 HydrophobicContact CZ2-CE1 4.19Å; W112-Y185 HydrophobicContact CZ2-CG 4.37Å; W112-Y185 AromaticContact NE1-CD1 3.64Å; W112-Y185 AromaticContact NE1-CD2 3.07Å; W112-Y185 AromaticContact NE1-CE2 3.54Å; W112-Y185 AromaticContact NE1-CG 3.16Å; N183-Y185 HydrophobicContact CB-CE2 3.85Å; Y185-V218 HydrophobicContact CD1-CG2 4.44Å; Y185-V218 HydrophobicContact CE1-CG2 4.21Å; Y185-L234 HydrophobicContact CD1-CD1 4.08Å; Y185-L234 HydrophobicContact CD1-CG 4.28Å; Y185-W235 CarbonylContact C-O 3.57Å; Y185-W235 WeakPolarHBondContact CA-O 3.49Å; Y185-A236 HydrophobicContact CD1-CB 3.97Å; Y185-A236 HydrophobicContact CE1-CB 3.74Å; Y185-I274 CarbonylContact O-C 3.53Å; Y185-I274 WeakPolarHBondContact O-CA 3.29Å; Y185-M275 PolarHBondContact N-O 2.8Å; Y185-M275 PolarHBondContact O-N 2.63Å; Y185-P277 HydrophobicContact CD2-CB 4.37Å; Y185-P277 HydrophobicContact CD2-CG 4.16Å; Y185-P277 HydrophobicContact CE2-CB 4.11Å; Y185-P277 HydrophobicContact CE2-CG 3.85Å; Y185-L283 HydrophobicContact CE1-CB 4.13Å; Y185-L283 HydrophobicContact CE1-CD1 4.36Å; Y185-L283 PolarHBondContact OH-O 3.02Å
186	E	98.4	Very high	93.6	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	116.5	168.8	-175	-176.3	-173.4	0	0	109	R188 W235 Y237 R243 R247 S272 R273 I274	E186-R188 HydrophobicContact CG-CG 3.8Å; E186-R188 WeakPolarHBondContact OE1-CD 3.31Å; E186-R188 WeakPolarHBondContact OE1-CG 3.37Å; E186-R188 IonicContact OE1-NE 2.65Å; E186-W235 HydrophobicContact CB-CB 4.25Å; E186-W235 PolarHBondContact N-O 2.74Å; E186-W235 PolarHBondContact O-N 3.44Å; E186-Y237 HydrophobicContact CB-CE2 3.83Å; E186-Y237 PolarHBondContact OE2-OH 2.84Å; E186-R243 VanDerWaalsContact CD-NE 3.25Å; E186-R243 VanDerWaalsContact CD-NH2 3.3Å; E186-R243 IonicContact OE1-CZ 3.36Å; E186-R243 IonicContact OE1-NE 3.74Å; E186-R243 IonicContact OE1-NH2 2.74Å; E186-R243 PolarHBondContact OE1-NH2 3.18Å; E186-R243 IonicContact OE2-CZ 3.97Å; E186-R243 IonicContact OE2-NE 2.7Å; E186-R243 PolarHBondContact OE2-NE 3.26Å; E186-R243 IonicContact OE2-NH2 3.55Å; E186-R243 PolarHBondContact OE2-NH2 3.36Å; E186-R247 IonicContact OE1-NH1 2.78Å; E186-R247 PolarHBondContact OE1-NH1 3.15Å; E186-R247 IonicContact OE2-NH1 3.4Å; E186-S272 VanDerWaalsContact CD-OG 3.31Å; E186-S272 WeakPolarHBondContact CG-OG 3.41Å; E186-S272 PolarHBondContact OE1-OG 3.49Å; E186-R273 CarbonylContact C-O 3.52Å; E186-R273 VanDerWaalsContact CA-O 3.25Å; E186-R273 WeakPolarHBondContact CA-O 3.3Å; E186-I274 HydrophobicContact CB-CD1 3.99Å; E186-I274 HydrophobicContact CG-CD1 3.97Å
187	L	98.6	Very high	93.7	Very high	5 Å²	5	46.7 Å²	46.7	3%	0.026	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	109.5	168.1	-176.1	68.4	0	0	0	108.7	I74 F76 V123 H232 H233 L234 R273 M275	I74-L187 HydrophobicContact CD1-CD1 4.33Å; I74-L187 HydrophobicContact CD1-CD2 3.88Å; F76-L187 HydrophobicContact CE1-CD2 3.65Å; F76-L187 HydrophobicContact CZ-CD2 3.83Å; V123-L187 HydrophobicContact CG1-CD2 4.32Å; L187-H232 HydrophobicContact CD1-CB 4.01Å; L187-H233 WeakPolarHBondContact CA-O 3.25Å; L187-L234 HydrophobicContact CB-CD1 4.49Å; L187-L234 HydrophobicContact CD1-CD1 4.32Å; L187-R273 PolarHBondContact N-O 3.16Å; L187-R273 PolarHBondContact O-N 3.41Å; L187-M275 HydrophobicContact CB-CE 3.7Å; L187-M275 HydrophobicContact CB-SD 3.86Å; L187-M275 HydrophobicContact CD2-SD 4.3Å
188	R	98.3	Very high	93.8	Very high	39 Å²	39	42.3 Å²	42.3	15%	0.147	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	123.8	172.3	-60	-169.9	70.3	180	-4.5	109.7	E186 Y190 H232 H233 R247 E271	E186-R188 HydrophobicContact CG-CG 3.8Å; E186-R188 WeakPolarHBondContact OE1-CD 3.31Å; E186-R188 WeakPolarHBondContact OE1-CG 3.37Å; E186-R188 IonicContact OE1-NE 2.65Å; R188-Y190 HydrophobicContact CB-CE2 3.75Å; R188-Y190 PolarHBondContact NE-OH 3.21Å; R188-Y190 VanDerWaalsContact NE-OH 3.09Å; R188-Y190 PolarHBondContact NH2-OH 3.03Å; R188-H232 CarbonylContact O-C 3.55Å; R188-H232 WeakPolarHBondContact O-CA 3.38Å; R188-H233 HydrophobicContact CB-CB 4.44Å; R188-H233 PolarHBondContact N-O 2.75Å; R188-H233 PolarHBondContact O-N 3.04Å; R188-R247 VanDerWaalsContact NH1-NH1 3.18Å; R188-E271 CarbonylContact C-O 3.49Å; R188-E271 VanDerWaalsContact CA-O 3.3Å; R188-E271 WeakPolarHBondContact CA-O 3.32Å
189	T	98.4	Very high	94	Very high	6 Å²	6	42.6 Å²	42.6	4%	0.037	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	130.6	178.8	-58.9	0	0	0	0	109.4	V230 V231 H232 M270 E271	T189-V230 HydrophobicContact CG2-CG1 3.53Å; T189-V231 CarbonylContact C-O 3.57Å; T189-V231 WeakPolarHBondContact CA-O 3.48Å; T189-H232 WeakPolarHBondContact CG2-CE1 3.46Å; T189-H232 PolarHBondContact OG1-CE1 2.72Å; T189-H232 PolarHBondContact OG1-ND1 2.74Å; T189-M270 CarbonylContact O-C 3.59Å; T189-M270 VanDerWaalsContact O-CA 3.31Å; T189-M270 WeakPolarHBondContact O-CA 3.39Å; T189-E271 PolarHBondContact N-O 3.47Å; T189-E271 PolarHBondContact O-N 3.31Å
190	Y	98.4	Very high	94.4	Very high	13 Å²	13	40 Å²	40	5%	0.051	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	119.9	178.5	-53.8	-91.3	0	0	0	109.3	R188 W200 V230 V231 H233 V267 M270	R188-Y190 HydrophobicContact CB-CE2 3.75Å; R188-Y190 PolarHBondContact NE-OH 3.21Å; R188-Y190 VanDerWaalsContact NE-OH 3.09Å; R188-Y190 PolarHBondContact NH2-OH 3.03Å; Y190-W200 HydrophobicContact CD2-CH2 4.32Å; Y190-W200 HydrophobicContact CD2-CZ2 4.02Å; Y190-W200 HydrophobicContact CE2-CZ2 4.39Å; Y190-W200 HydrophobicContact CG-CZ2 4.11Å; Y190-V230 CarbonylContact O-C 3.53Å; Y190-V230 WeakPolarHBondContact O-CA 3.42Å; Y190-V231 HydrophobicContact CD2-CG1 4.4Å; Y190-V231 PolarHBondContact N-O 2.82Å; Y190-V231 PolarHBondContact O-N 2.89Å; Y190-H233 HydrophobicContact CE2-CB 4.46Å; Y190-H233 AromaticContact CE2-ND1 3.55Å; Y190-V267 HydrophobicContact CD1-CG1 4.33Å; Y190-V267 HydrophobicContact CD1-CG2 4.24Å; Y190-M270 HydrophobicContact CD1-CB 3.9Å; Y190-M270 HydrophobicContact CE1-CB 4.25Å
191	K	98.2	Very high	95	Very high	68 Å²	68	31.9 Å²	31.9	30%	0.296	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	110.5	168.4	-54.2	-168.3	177.7	-165.4	0	107.8	E227 V230 R268 H269	K191-E227 WeakPolarHBondContact CD-OE1 3.25Å; K191-E227 VanDerWaalsContact CE-OE1 3.25Å; K191-E227 WeakPolarHBondContact CE-OE1 3.41Å; K191-E227 VanDerWaalsContact CE-OE2 3.27Å; K191-E227 WeakPolarHBondContact CE-OE2 3.33Å; K191-E227 IonicContact NZ-OE1 2.69Å; K191-E227 PolarHBondContact NZ-OE1 3.06Å; K191-E227 IonicContact NZ-OE2 2.98Å; K191-E227 PolarHBondContact NZ-OE2 3.25Å; K191-V230 HydrophobicContact CG-CG2 4.26Å; K191-R268 PolarHBondContact O-N 3.29Å; K191-H269 HydrophobicContact CB-CB 4.11Å; K191-H269 HydrophobicContact CD-CB 4.21Å; K191-H269 HydrophobicContact CG-CB 4.23Å; K191-H269 PolarHBondContact N-O 2.86Å; K191-H269 PolarHBondContact O-N 3.2Å
192	L	98.2	Very high	95.6	Very high	5 Å²	5	34 Å²	34	3%	0.026	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	160.6	-176.9	-54.2	-174.5	0	0	0	111.3	M197 W200 Y229 V231 L266 V267	L192-M197 HydrophobicContact CD1-CB 4.4Å; L192-M197 HydrophobicContact CD1-CE 3.92Å; L192-M197 HydrophobicContact CD1-SD 3.71Å; L192-W200 HydrophobicContact CD1-CB 3.85Å; L192-W200 HydrophobicContact CD1-CD2 4.01Å; L192-W200 HydrophobicContact CD1-CE3 4.36Å; L192-W200 HydrophobicContact CD1-CG 3.81Å; L192-W200 HydrophobicContact CD2-CD2 4.13Å; L192-W200 HydrophobicContact CD2-CG 3.91Å; L192-Y229 WeakPolarHBondContact CB-O 3.36Å; L192-Y229 PolarHBondContact N-O 3.29Å; L192-V231 HydrophobicContact CD1-CG2 3.87Å; L192-V231 HydrophobicContact CG-CG2 4.38Å; L192-L266 WeakPolarHBondContact CA-O 3.47Å; L192-V267 HydrophobicContact CD2-CG2 3.82Å
193	K	97.8	Very high	95.9	Very high	90 Å²	90	29.7 Å²	29.7	39%	0.391	16%	0.16	S	C	.	.	P	Polyproline II helix	trans	-64.6	131.9	165.5	-69.2	174.6	178.9	174.2	0	108.5	G195 T196 P265 L266 R268	K193-G195 PolarHBondContact O-N 3.45Å; K193-T196 HydrophobicContact CB-CG2 3.77Å; K193-T196 WeakPolarHBondContact O-CB 3.36Å; K193-T196 PolarHBondContact O-N 2.82Å; K193-T196 PolarHBondContact O-OG1 3.16Å; K193-P265 WeakPolarHBondContact CE-O 3.49Å; K193-P265 PolarHBondContact NZ-O 2.87Å; K193-L266 WeakPolarHBondContact CG-O 3.47Å; K193-L266 PolarHBondContact N-O 2.93Å; K193-R268 HydrophobicContact CB-CG 4.46Å; K193-R268 HydrophobicContact CG-CG 3.62Å
194	P	95.3	Very high	95.9	Very high	66 Å²	66	29.3 Å²	29.3	43%	0.429	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.5	136.3	175	-29.5	36.6	0	0	0	111.9	T196 Y229 R268	P194-T196 VanDerWaalsContact C-N 3.32Å; P194-T196 PolarHBondContact O-N 3.26Å; P194-Y229 HydrophobicContact CB-CD2 4.01Å; P194-Y229 HydrophobicContact CB-CE2 3.74Å; P194-Y229 HydrophobicContact CG-CD2 4.14Å; P194-Y229 HydrophobicContact CG-CE2 4.27Å; P194-R268 VanDerWaalsContact CD-NH2 3.31Å
195	G	91.5	Very high	95.6	Very high	50 Å²	50	29.8 Å²	29.8	52%	0.515	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.6	-14.4	-176.9	0	0	0	0	0	115.8	K193	K193-G195 PolarHBondContact O-N 3.45Å
196	T	95.2	Very high	95.2	Very high	20 Å²	20	36.5 Å²	36.5	12%	0.123	19%	0.189	C	C	.	.			trans	-92.3	-1.8	-174.1	66.9	0	0	0	0	114.9	K193 P194 I198 E199 W200 L266	K193-T196 HydrophobicContact CB-CG2 3.77Å; K193-T196 WeakPolarHBondContact O-CB 3.36Å; K193-T196 PolarHBondContact O-N 2.82Å; K193-T196 PolarHBondContact O-OG1 3.16Å; P194-T196 VanDerWaalsContact C-N 3.32Å; P194-T196 PolarHBondContact O-N 3.26Å; T196-I198 VanDerWaalsContact C-N 3.33Å; T196-I198 PolarHBondContact O-N 3.42Å; T196-E199 PolarHBondContact O-N 3.46Å; T196-E199 VanDerWaalsContact O-N 3.16Å; T196-W200 WeakPolarHBondContact O-CB 3.43Å; T196-W200 PolarHBondContact O-N 3.02Å; T196-L266 HydrophobicContact CG2-CD2 4.04Å
197	M	94.1	Very high	94.8	Very high	12 Å²	12	36.6 Å²	36.6	6%	0.059	19%	0.19	C	C	.	.	H	α-helix	trans	-54.1	-43.8	-176	-179.8	67	71.7	0	0	113.3	L63 F170 L192 G201 F222 Y229 V231	L63-M197 HydrophobicContact CD1-CG 3.82Å; F170-M197 HydrophobicContact CZ-SD 4.24Å; L192-M197 HydrophobicContact CD1-CB 4.4Å; L192-M197 HydrophobicContact CD1-CE 3.92Å; L192-M197 HydrophobicContact CD1-SD 3.71Å; M197-G201 PolarHBondContact O-N 2.89Å; M197-F222 HydrophobicContact CE-CB 4.04Å; M197-F222 HydrophobicContact SD-CB 3.97Å; M197-Y229 HydrophobicContact CB-CD1 4.33Å; M197-V231 HydrophobicContact CE-CG2 3.73Å; M197-V231 HydrophobicContact SD-CG2 3.49Å; M197-V231 WeakPolarHBondContact SD-CG2 3.3Å
198	I	91.3	Very high	94.5	Very high	12 Å²	12	36.4 Å²	36.4	6%	0.062	19%	0.189	C	C	.	.	H	α-helix	trans	-68.7	-44.5	-179.9	-66.4	176.4	0	0	0	111	H59 L62 L63 T196 W200 G201 N202	H59-I198 WeakPolarHBondContact ND1-CD1 3.47Å; L62-I198 HydrophobicContact CD1-CD1 3.99Å; L63-I198 HydrophobicContact CD1-CG1 4.12Å; T196-I198 VanDerWaalsContact C-N 3.33Å; T196-I198 PolarHBondContact O-N 3.42Å; I198-W200 VanDerWaalsContact C-N 3.33Å; I198-W200 PolarHBondContact O-N 2.96Å; I198-G201 PolarHBondContact O-N 2.89Å; I198-N202 WeakPolarHBondContact O-CB 3.42Å; I198-N202 PolarHBondContact O-N 2.83Å
199	E	94.4	Very high	94	Very high	98 Å²	98	41 Å²	41	46%	0.458	21%	0.21	S	C	.	.	H	α-helix	trans	-61.1	-46	178.6	-176.1	-174.8	170.6	0	0	110.9	T196 N202 N203 L266	T196-E199 PolarHBondContact O-N 3.46Å; T196-E199 VanDerWaalsContact O-N 3.16Å; E199-N202 PolarHBondContact O-N 3.43Å; E199-N203 PolarHBondContact O-N 2.92Å; E199-N203 PolarHBondContact O-ND2 3.19Å; E199-L266 HydrophobicContact CB-CD1 4.18Å; E199-L266 HydrophobicContact CG-CD1 3.84Å
200	W	95.8	Very high	93.5	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.008	22%	0.222	C	C	.	.	H	α-helix	trans	-61.9	-46	176	-170.3	95.6	0	0	0	111.6	F170 Y190 L192 T196 I198 N202 N203 W204 V231 H233 L266	F170-W200 HydrophobicContact CE2-CZ3 4.36Å; F170-W200 HydrophobicContact CZ-CZ3 4.21Å; Y190-W200 HydrophobicContact CD2-CH2 4.32Å; Y190-W200 HydrophobicContact CD2-CZ2 4.02Å; Y190-W200 HydrophobicContact CE2-CZ2 4.39Å; Y190-W200 HydrophobicContact CG-CZ2 4.11Å; L192-W200 HydrophobicContact CD1-CB 3.85Å; L192-W200 HydrophobicContact CD1-CD2 4.01Å; L192-W200 HydrophobicContact CD1-CE3 4.36Å; L192-W200 HydrophobicContact CD1-CG 3.81Å; L192-W200 HydrophobicContact CD2-CD2 4.13Å; L192-W200 HydrophobicContact CD2-CG 3.91Å; T196-W200 WeakPolarHBondContact O-CB 3.43Å; T196-W200 PolarHBondContact O-N 3.02Å; I198-W200 VanDerWaalsContact C-N 3.33Å; I198-W200 PolarHBondContact O-N 2.96Å; W200-N202 PolarHBondContact O-N 3.33Å; W200-N203 PolarHBondContact O-N 2.65Å; W200-W204 AromaticContact CD2-CD1 3.44Å; W200-W204 VanDerWaalsContact CD2-CD1 3.44Å; W200-W204 HydrophobicContact CD2-CG 4.48Å; W200-W204 AromaticContact CD2-NE1 3.91Å; W200-W204 AromaticContact CE2-CD1 3.32Å; W200-W204 AromaticContact CE2-NE1 3.25Å; W200-W204 VanDerWaalsContact CE2-NE1 3.25Å; W200-W204 HydrophobicContact CE3-CB 4.43Å; W200-W204 AromaticContact CE3-CD1 3.48Å; W200-W204 VanDerWaalsContact CE3-CD1 3.48Å; W200-W204 HydrophobicContact CE3-CG 4.14Å; W200-W204 AromaticContact CH2-CD1 3.41Å; W200-W204 VanDerWaalsContact CH2-CD1 3.41Å; W200-W204 HydrophobicContact CH2-CD2 4.26Å; W200-W204 AromaticContact CH2-CE2 3.98Å; W200-W204 AromaticContact CH2-CG 3.91Å; W200-W204 HydrophobicContact CH2-CG 3.91Å; W200-W204 AromaticContact CH2-NE1 3.45Å; W200-W204 AromaticContact CZ2-CD1 3.36Å; W200-W204 AromaticContact CZ2-CE2 3.82Å; W200-W204 HydrophobicContact CZ2-CG 4.24Å; W200-W204 AromaticContact CZ2-NE1 3.04Å; W200-W204 HydrophobicContact CZ3-CB 4.2Å; W200-W204 AromaticContact CZ3-CD1 3.43Å; W200-W204 VanDerWaalsContact CZ3-CD1 3.43Å; W200-W204 AromaticContact CZ3-CG 3.81Å; W200-W204 HydrophobicContact CZ3-CG 3.81Å; W200-W204 AromaticContact CZ3-NE1 3.99Å; W200-W204 AromaticContact NE1-NE1 3.76Å; W200-W204 PolarHBondContact O-N 2.98Å; W200-V231 HydrophobicContact CE3-CG2 4.19Å; W200-V231 HydrophobicContact CH2-CB 3.99Å; W200-V231 HydrophobicContact CH2-CG1 3.4Å; W200-V231 VanDerWaalsContact CH2-CG1 3.4Å; W200-V231 HydrophobicContact CH2-CG2 4.21Å; W200-V231 HydrophobicContact CZ2-CG1 4.38Å; W200-V231 HydrophobicContact CZ3-CB 4.14Å; W200-V231 HydrophobicContact CZ3-CG1 3.61Å; W200-V231 HydrophobicContact CZ3-CG2 3.89Å; W200-H233 AromaticContact CH2-CE1 3.28Å; W200-H233 WeakPolarHBondContact CH2-CE1 3.33Å; W200-H233 AromaticContact CH2-NE2 3.3Å; W200-H233 VanDerWaalsContact CH2-NE2 3.3Å; W200-H233 WeakPolarHBondContact CH2-NE2 3.27Å; W200-H233 AromaticContact CZ3-NE2 3.8Å; W200-L266 HydrophobicContact CB-CD1 3.91Å
201	G	94.1	Very high	93.1	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-61.4	-41.3	177.7	0	0	0	0	0	112.9	F172 M197 I198 N203 W204 A205	F172-G201 WeakPolarHBondContact CZ-O 3.36Å; M197-G201 PolarHBondContact O-N 2.89Å; I198-G201 PolarHBondContact O-N 2.89Å; G201-N203 VanDerWaalsContact C-N 3.33Å; G201-N203 PolarHBondContact O-N 2.77Å; G201-W204 PolarHBondContact O-N 2.8Å; G201-A205 WeakPolarHBondContact O-CB 3.48Å; G201-A205 PolarHBondContact O-N 3.41Å
202	N	92.3	Very high	92.5	Very high	80 Å²	80	43.4 Å²	43.4	43%	0.428	22%	0.22	S	C	.	.	H	α-helix	trans	-63.8	-36.8	177.6	-75.1	-13.1	0	0	0	112.6	I198 E199 W200 R206	I198-N202 WeakPolarHBondContact O-CB 3.42Å; I198-N202 PolarHBondContact O-N 2.83Å; E199-N202 PolarHBondContact O-N 3.43Å; W200-N202 PolarHBondContact O-N 3.33Å; N202-R206 VanDerWaalsContact O-CZ 3.31Å; N202-R206 PolarHBondContact O-NH1 3.11Å; N202-R206 VanDerWaalsContact O-NH1 3.09Å
203	N	93.8	Very high	91.6	Very high	18 Å²	18	50 Å²	50	10%	0.096	25%	0.25	C	C	.	.	H	α-helix	trans	-66.3	-46.3	173	-76.5	-59.7	0	0	0	111	E199 W200 G201 A205 R206 A207 N259 T263	E199-N203 PolarHBondContact O-N 2.92Å; E199-N203 PolarHBondContact O-ND2 3.19Å; W200-N203 PolarHBondContact O-N 2.65Å; G201-N203 VanDerWaalsContact C-N 3.33Å; G201-N203 PolarHBondContact O-N 2.77Å; N203-A205 PolarHBondContact O-N 3.42Å; N203-R206 PolarHBondContact O-N 3.02Å; N203-R206 PolarHBondContact OD1-NH2 3.12Å; N203-A207 PolarHBondContact O-N 2.88Å; N203-A207 VanDerWaalsContact O-N 3.15Å; N203-N259 PolarHBondContact O-OD1 3.02Å; N203-T263 HydrophobicContact CB-CG2 3.52Å
204	W	94.8	Very high	90.9	Very high	11 Å²	11	49.3 Å²	49.3	4%	0.042	25%	0.251	C	S	.	.	H	α-helix	trans	-66.4	-31.7	178.6	-89.2	94.7	0	0	0	114.8	F172 W173 W200 G201 R206 A207 I208 H233 W235 W256	F172-W204 HydrophobicContact CE2-CB 4.08Å; F172-W204 HydrophobicContact CZ-CB 4.2Å; W173-W204 HydrophobicContact CH2-CE3 4.35Å; W173-W204 HydrophobicContact CH2-CZ3 4.27Å; W173-W204 HydrophobicContact CZ3-CE3 4.09Å; W173-W204 HydrophobicContact CZ3-CZ3 4.47Å; W200-W204 AromaticContact CD2-CD1 3.44Å; W200-W204 VanDerWaalsContact CD2-CD1 3.44Å; W200-W204 HydrophobicContact CD2-CG 4.48Å; W200-W204 AromaticContact CD2-NE1 3.91Å; W200-W204 AromaticContact CE2-CD1 3.32Å; W200-W204 AromaticContact CE2-NE1 3.25Å; W200-W204 VanDerWaalsContact CE2-NE1 3.25Å; W200-W204 HydrophobicContact CE3-CB 4.43Å; W200-W204 AromaticContact CE3-CD1 3.48Å; W200-W204 VanDerWaalsContact CE3-CD1 3.48Å; W200-W204 HydrophobicContact CE3-CG 4.14Å; W200-W204 AromaticContact CH2-CD1 3.41Å; W200-W204 VanDerWaalsContact CH2-CD1 3.41Å; W200-W204 HydrophobicContact CH2-CD2 4.26Å; W200-W204 AromaticContact CH2-CE2 3.98Å; W200-W204 AromaticContact CH2-CG 3.91Å; W200-W204 HydrophobicContact CH2-CG 3.91Å; W200-W204 AromaticContact CH2-NE1 3.45Å; W200-W204 AromaticContact CZ2-CD1 3.36Å; W200-W204 AromaticContact CZ2-CE2 3.82Å; W200-W204 HydrophobicContact CZ2-CG 4.24Å; W200-W204 AromaticContact CZ2-NE1 3.04Å; W200-W204 HydrophobicContact CZ3-CB 4.2Å; W200-W204 AromaticContact CZ3-CD1 3.43Å; W200-W204 VanDerWaalsContact CZ3-CD1 3.43Å; W200-W204 AromaticContact CZ3-CG 3.81Å; W200-W204 HydrophobicContact CZ3-CG 3.81Å; W200-W204 AromaticContact CZ3-NE1 3.99Å; W200-W204 AromaticContact NE1-NE1 3.76Å; W200-W204 PolarHBondContact O-N 2.98Å; G201-W204 PolarHBondContact O-N 2.8Å; W204-R206 PolarHBondContact O-N 2.85Å; W204-R206 VanDerWaalsContact O-N 3.17Å; W204-A207 HydrophobicContact CE3-CB 4.45Å; W204-A207 PolarHBondContact O-N 3.38Å; W204-A207 VanDerWaalsContact O-N 3.07Å; W204-I208 WeakPolarHBondContact O-CB 3.39Å; W204-I208 PolarHBondContact O-N 2.96Å; W204-H233 AromaticContact CD2-CE1 3.59Å; W204-H233 AromaticContact CE2-CE1 3.59Å; W204-H233 AromaticContact CE3-CE1 3.68Å; W204-H233 AromaticContact CH2-CE1 3.73Å; W204-H233 AromaticContact CH2-ND1 3.86Å; W204-H233 AromaticContact CZ2-CE1 3.66Å; W204-H233 AromaticContact CZ3-CE1 3.76Å; W204-W235 HydrophobicContact CH2-CZ2 4.31Å; W204-W235 HydrophobicContact CZ3-CH2 4.15Å; W204-W235 HydrophobicContact CZ3-CZ2 4.23Å; W204-W256 AromaticContact CH2-CH2 3.74Å; W204-W256 HydrophobicContact CH2-CH2 3.74Å; W204-W256 HydrophobicContact CH2-CZ3 4.32Å; W204-W256 HydrophobicContact CZ2-CH2 4.45Å; W204-W256 HydrophobicContact CZ3-CH2 4.15Å; W204-W256 HydrophobicContact CZ3-CZ3 4.32Å
205	A	92.2	Very high	90.5	Very high	30 Å²	30	52.6 Å²	52.6	25%	0.248	26%	0.26	C	S	.	.	H	α-helix	trans	-57.5	-29.9	175.1	0	0	0	0	0	112.7	F172 G201 N203	F172-A205 HydrophobicContact CB-CB 4.12Å; F172-A205 HydrophobicContact CD1-CB 3.54Å; F172-A205 HydrophobicContact CD2-CB 4.18Å; F172-A205 HydrophobicContact CE1-CB 3.9Å; F172-A205 HydrophobicContact CE2-CB 4.48Å; F172-A205 HydrophobicContact CG-CB 3.68Å; F172-A205 HydrophobicContact CZ-CB 4.36Å; G201-A205 WeakPolarHBondContact O-CB 3.48Å; G201-A205 PolarHBondContact O-N 3.41Å; N203-A205 PolarHBondContact O-N 3.42Å
206	R	89.3	Confident	90.6	Very high	142 Å²	142	50.3 Å²	50.3	54%	0.536	24%	0.236	S	C	.	.	H	α-helix	trans	-84	-43.8	172.3	-64.7	-176.9	-69.2	-86.1	2.7	111.4	N202 N203 W204 I208	N202-R206 VanDerWaalsContact O-CZ 3.31Å; N202-R206 PolarHBondContact O-NH1 3.11Å; N202-R206 VanDerWaalsContact O-NH1 3.09Å; N203-R206 PolarHBondContact O-N 3.02Å; N203-R206 PolarHBondContact OD1-NH2 3.12Å; W204-R206 PolarHBondContact O-N 2.85Å; W204-R206 VanDerWaalsContact O-N 3.17Å; R206-I208 PolarHBondContact O-N 3.01Å
207	A	90.1	Very high	90.6	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.008	23%	0.232	C	C	.	.	H	α-helix	trans	-74.9	-25.5	-169.8	0	0	0	0	0	115	N203 W204 K209 Y210 W256 N259	N203-A207 PolarHBondContact O-N 2.88Å; N203-A207 VanDerWaalsContact O-N 3.15Å; W204-A207 HydrophobicContact CE3-CB 4.45Å; W204-A207 PolarHBondContact O-N 3.38Å; W204-A207 VanDerWaalsContact O-N 3.07Å; A207-K209 PolarHBondContact O-N 2.96Å; A207-Y210 HydrophobicContact CB-CD2 4.28Å; A207-Y210 WeakPolarHBondContact O-CB 3.45Å; A207-Y210 VanDerWaalsContact O-CD2 3.3Å; A207-Y210 WeakPolarHBondContact O-CD2 3.32Å; A207-Y210 PolarHBondContact O-N 3.07Å; A207-Y210 VanDerWaalsContact O-N 3.11Å; A207-W256 HydrophobicContact CB-CE3 4.44Å; A207-W256 HydrophobicContact CB-CZ3 4.15Å; A207-N259 HydrophobicContact CB-CB 3.76Å; A207-N259 WeakPolarHBondContact CB-ND2 3.41Å; A207-N259 WeakPolarHBondContact CB-OD1 3.35Å
208	I	91.3	Very high	90.6	Very high	2 Å²	2	49.1 Å²	49.1	1%	0.01	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-59.6	-28.9	179.7	-168.4	51.1	0	0	0	112	F172 W173 W204 R206 Y210 R211 Q212 A217 W235	F172-I208 HydrophobicContact CD2-CG2 4.1Å; W173-I208 HydrophobicContact CD2-CD1 4.04Å; W173-I208 HydrophobicContact CD2-CG1 4.1Å; W173-I208 HydrophobicContact CE3-CD1 3.91Å; W173-I208 HydrophobicContact CE3-CG1 3.91Å; W173-I208 HydrophobicContact CH2-CD1 3.38Å; W173-I208 HydrophobicContact CH2-CG1 4.29Å; W173-I208 HydrophobicContact CZ2-CD1 3.52Å; W173-I208 HydrophobicContact CZ2-CG1 4.47Å; W173-I208 HydrophobicContact CZ3-CB 4.48Å; W173-I208 HydrophobicContact CZ3-CD1 3.58Å; W173-I208 HydrophobicContact CZ3-CG1 4Å; W204-I208 WeakPolarHBondContact O-CB 3.39Å; W204-I208 PolarHBondContact O-N 2.96Å; R206-I208 PolarHBondContact O-N 3.01Å; I208-Y210 PolarHBondContact O-N 2.71Å; I208-R211 HydrophobicContact CD1-CB 4.4Å; I208-R211 CarbonylContact O-C 3.53Å; I208-R211 WeakPolarHBondContact O-CA 3.28Å; I208-R211 PolarHBondContact O-N 2.93Å; I208-Q212 HydrophobicContact CG1-CG 4.13Å; I208-Q212 WeakPolarHBondContact O-CG 3.34Å; I208-Q212 PolarHBondContact O-N 2.8Å; I208-Q212 VanDerWaalsContact O-N 3.11Å; I208-A217 HydrophobicContact CD1-CB 4.04Å; I208-W235 HydrophobicContact CD1-CH2 3.73Å; I208-W235 HydrophobicContact CD1-CZ3 4.06Å
209	K	88.8	Confident	90.8	Very high	135 Å²	135	48.6 Å²	48.6	59%	0.587	23%	0.227	S	C	*	.	G	3₁₀ helix	trans	-57.6	-37.3	177.3	-61.4	-177.4	179.9	-175	0	112.2	A207 R211 Q212	A207-K209 PolarHBondContact O-N 2.96Å; K209-R211 PolarHBondContact O-N 2.79Å; K209-R211 VanDerWaalsContact O-N 3.12Å; K209-Q212 PolarHBondContact O-N 2.86Å
210	Y	87.9	Confident	90.9	Very high	74 Å²	74	44 Å²	44	29%	0.29	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-66.2	-14.3	176.7	-54.5	-54.4	0	0	0	113.3	A207 I208 K253 R254 W256	A207-Y210 HydrophobicContact CB-CD2 4.28Å; A207-Y210 WeakPolarHBondContact O-CB 3.45Å; A207-Y210 VanDerWaalsContact O-CD2 3.3Å; A207-Y210 WeakPolarHBondContact O-CD2 3.32Å; A207-Y210 PolarHBondContact O-N 3.07Å; A207-Y210 VanDerWaalsContact O-N 3.11Å; I208-Y210 PolarHBondContact O-N 2.71Å; Y210-K253 HydrophobicContact CD1-CB 4.26Å; Y210-K253 HydrophobicContact CD1-CD 4.4Å; Y210-K253 WeakPolarHBondContact O-CD 3.44Å; Y210-K253 WeakPolarHBondContact O-CE 3.18Å; Y210-K253 PolarHBondContact O-NZ 3.03Å; Y210-R254 PolarHBondContact OH-O 3.07Å; Y210-W256 HydrophobicContact CD2-CE3 4.17Å
211	R	88.6	Confident	90.9	Very high	4 Å²	4	44 Å²	44	2%	0.015	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-123	10.7	-174.1	-61.8	-155.5	66.2	-161.7	3.6	113.6	I208 K209 E216 W235 Y237 W256	I208-R211 HydrophobicContact CD1-CB 4.4Å; I208-R211 CarbonylContact O-C 3.53Å; I208-R211 WeakPolarHBondContact O-CA 3.28Å; I208-R211 PolarHBondContact O-N 2.93Å; K209-R211 PolarHBondContact O-N 2.79Å; K209-R211 VanDerWaalsContact O-N 3.12Å; R211-E216 VanDerWaalsContact CA-OE1 3.32Å; R211-E216 WeakPolarHBondContact CA-OE1 3.46Å; R211-E216 VanDerWaalsContact CB-OE1 3.28Å; R211-E216 WeakPolarHBondContact CB-OE1 3.14Å; R211-E216 IonicContact CZ-OE1 3.64Å; R211-E216 IonicContact NE-OE1 3.02Å; R211-E216 PolarHBondContact NE-OE1 2.86Å; R211-E216 IonicContact NH2-OE1 3.42Å; R211-E216 PolarHBondContact NH2-OE1 3.22Å; R211-E216 WeakPolarHBondContact O-CG 3.35Å; R211-W235 HydrophobicContact CB-CH2 4.25Å; R211-W235 HydrophobicContact CB-CZ3 3.97Å; R211-Y237 PolarHBondContact NH2-OH 2.88Å; R211-W256 VanDerWaalsContact CD-CH2 3.5Å; R211-W256 HydrophobicContact CG-CH2 4.22Å; R211-W256 HydrophobicContact CG-CZ3 3.93Å
212	Q	85.1	Confident	91	Very high	60 Å²	60	44.3 Å²	44.3	28%	0.28	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-27.3	174.2	-81.1	172.7	-43.4	0	0	111.9	N174 I208 K209 N214 Q215 A217	N174-Q212 PolarHBondContact OD1-NE2 3.34Å; I208-Q212 HydrophobicContact CG1-CG 4.13Å; I208-Q212 WeakPolarHBondContact O-CG 3.34Å; I208-Q212 PolarHBondContact O-N 2.8Å; I208-Q212 VanDerWaalsContact O-N 3.11Å; K209-Q212 PolarHBondContact O-N 2.86Å; Q212-N214 VanDerWaalsContact C-N 3.34Å; Q212-N214 PolarHBondContact O-N 3.08Å; Q212-Q215 WeakPolarHBondContact O-CA 3.41Å; Q212-Q215 PolarHBondContact O-N 3.34Å; Q212-A217 HydrophobicContact CG-CB 4.36Å
213	E	81	Confident	91.2	Very high	142 Å²	142	40.9 Å²	40.9	66%	0.664	19%	0.19	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-36.1	-177.3	-68.7	169.2	-176.5	0	0	113.5	Q215 K253	E213-Q215 PolarHBondContact O-N 3.02Å; E213-K253 IonicContact OE2-NZ 3.6Å; E213-K253 PolarHBondContact OE2-NZ 2.91Å
214	N	83.3	Confident	91.2	Very high	76 Å²	76	42.5 Å²	42.5	41%	0.406	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	10.5	176.6	-30.2	-72.2	0	0	0	112.4	Q212 E216 T246	Q212-N214 VanDerWaalsContact C-N 3.34Å; Q212-N214 PolarHBondContact O-N 3.08Å; N214-E216 WeakPolarHBondContact CA-OE2 3.48Å; N214-E216 WeakPolarHBondContact CB-OE2 3.29Å; N214-E216 PolarHBondContact ND2-OE2 3.29Å; N214-E216 PolarHBondContact O-N 2.76Å; N214-E216 VanDerWaalsContact O-N 3.09Å; N214-T246 HydrophobicContact CB-CG2 4.2Å
215	Q	86.5	Confident	91.2	Very high	136 Å²	136	46.4 Å²	46.4	64%	0.636	22%	0.217	S	C	*	.	S	Bend	trans	52.4	29.6	-177.4	-56.7	-174.9	-18.5	0	0	112.8	R179 Q212 E213	R179-Q215 VanDerWaalsContact CZ-O 3.22Å; R179-Q215 PolarHBondContact NH1-O 3.08Å; R179-Q215 PolarHBondContact NH2-O 2.57Å; Q212-Q215 WeakPolarHBondContact O-CA 3.41Å; Q212-Q215 PolarHBondContact O-N 3.34Å; E213-Q215 PolarHBondContact O-N 3.02Å
216	E	92.6	Very high	91.4	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.009	23%	0.228	C	C	.	.			trans	-80.6	-19.5	179.8	70.7	-98.6	-141.3	0	0	113.1	R211 N214 V218 W235 A236 Y237 T246	R211-E216 VanDerWaalsContact CA-OE1 3.32Å; R211-E216 WeakPolarHBondContact CA-OE1 3.46Å; R211-E216 VanDerWaalsContact CB-OE1 3.28Å; R211-E216 WeakPolarHBondContact CB-OE1 3.14Å; R211-E216 IonicContact CZ-OE1 3.64Å; R211-E216 IonicContact NE-OE1 3.02Å; R211-E216 PolarHBondContact NE-OE1 2.86Å; R211-E216 IonicContact NH2-OE1 3.42Å; R211-E216 PolarHBondContact NH2-OE1 3.22Å; R211-E216 WeakPolarHBondContact O-CG 3.35Å; N214-E216 WeakPolarHBondContact CA-OE2 3.48Å; N214-E216 WeakPolarHBondContact CB-OE2 3.29Å; N214-E216 PolarHBondContact ND2-OE2 3.29Å; N214-E216 PolarHBondContact O-N 2.76Å; N214-E216 VanDerWaalsContact O-N 3.09Å; E216-V218 PolarHBondContact O-N 3.18Å; E216-W235 HydrophobicContact CB-CE3 4.35Å; E216-W235 HydrophobicContact CG-CE3 3.54Å; E216-W235 HydrophobicContact CG-CZ3 3.88Å; E216-W235 CarbonylContact O-C 3.58Å; E216-W235 WeakPolarHBondContact O-CA 3.49Å; E216-A236 PolarHBondContact O-N 3.5Å; E216-Y237 HydrophobicContact CB-CD1 4.19Å; E216-Y237 HydrophobicContact CB-CE1 3.75Å; E216-Y237 HydrophobicContact CG-CE1 4.28Å; E216-T246 HydrophobicContact CB-CG2 4.35Å; E216-T246 HydrophobicContact CG-CG2 4.2Å; E216-T246 WeakPolarHBondContact OE1-CG2 3.38Å
217	A	94.7	Very high	91.6	Very high	4 Å²	4	44.6 Å²	44.6	3%	0.033	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	108.8	-172.6	0	0	0	0	0	112.2	W173 N174 I208 Q212 W235	W173-A217 HydrophobicContact CZ2-CB 4.35Å; N174-A217 PolarHBondContact ND2-O 3.49Å; N174-A217 VanDerWaalsContact ND2-O 3.07Å; I208-A217 HydrophobicContact CD1-CB 4.04Å; Q212-A217 HydrophobicContact CG-CB 4.36Å; A217-W235 HydrophobicContact CB-CE3 4.14Å; A217-W235 HydrophobicContact CB-CZ3 3.73Å
218	V	95.2	Very high	91.9	Very high	3 Å²	3	49.2 Å²	49.2	2%	0.018	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	-49.9	-179.8	-177.2	0	0	0	0	111.8	P176 Y185 E216 L234 A236 L283	P176-V218 WeakPolarHBondContact CA-O 3.34Å; P176-V218 HydrophobicContact CB-CG1 4.2Å; Y185-V218 HydrophobicContact CD1-CG2 4.44Å; Y185-V218 HydrophobicContact CE1-CG2 4.21Å; E216-V218 PolarHBondContact O-N 3.18Å; V218-L234 HydrophobicContact CB-CB 4.26Å; V218-L234 HydrophobicContact CB-CD2 4.17Å; V218-L234 HydrophobicContact CB-CG 3.97Å; V218-L234 WeakPolarHBondContact CB-O 3.28Å; V218-L234 HydrophobicContact CG1-CD2 3.74Å; V218-L234 HydrophobicContact CG1-CG 4.1Å; V218-L234 PolarHBondContact N-O 3.11Å; V218-A236 HydrophobicContact CG2-CB 3.45Å; V218-A236 VanDerWaalsContact CG2-CB 3.45Å; V218-L283 HydrophobicContact CG1-CD1 3.93Å; V218-L283 HydrophobicContact CG1-CD2 4.17Å
219	G	95.3	Very high	92.1	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.8	148.8	-175.4	0	0	0	0	0	112.5	W173 L234	W173-G219 VanDerWaalsContact NE1-CA 3.33Å; W173-G219 PolarHBondContact NE1-O 3.45Å; G219-L234 PolarHBondContact N-O 3.17Å; G219-L234 PolarHBondContact O-N 3.26Å
220	G	96.2	Very high	92.5	Very high	1 Å²	1	46.8 Å²	46.8	1%	0.01	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	123.8	178.6	0	0	0	0	0	109.2	E169 F170 W173 H232	E169-G220 WeakPolarHBondContact CA-O 3.33Å; F170-G220 PolarHBondContact N-O 3.18Å; W173-G220 VanDerWaalsContact CG-N 3.34Å; G220-H232 WeakPolarHBondContact CA-O 3.36Å
221	F	96.6	Very high	93	Very high	4 Å²	4	43.3 Å²	43.3	2%	0.018	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	152.5	-169.3	-49.5	-85.4	0	0	0	112.1	Y72 L125 L167 L168 E169 P176 V231 H232	Y72-F221 AromaticContact CD1-CE1 3.77Å; Y72-F221 HydrophobicContact CD1-CE1 3.77Å; Y72-F221 HydrophobicContact CD1-CZ 4.42Å; Y72-F221 HydrophobicContact CD2-CD1 4.02Å; Y72-F221 AromaticContact CD2-CE1 3.84Å; Y72-F221 HydrophobicContact CD2-CE1 3.84Å; Y72-F221 AromaticContact CE1-CE1 3.85Å; Y72-F221 HydrophobicContact CE1-CE1 3.85Å; Y72-F221 HydrophobicContact CE1-CZ 4.42Å; Y72-F221 HydrophobicContact CE2-CD1 4.41Å; Y72-F221 AromaticContact CE2-CE1 3.92Å; Y72-F221 HydrophobicContact CE2-CE1 3.92Å; Y72-F221 HydrophobicContact CG-CD1 4.06Å; Y72-F221 AromaticContact CG-CE1 3.75Å; Y72-F221 HydrophobicContact CG-CE1 3.75Å; Y72-F221 AromaticContact CZ-CE1 3.9Å; L125-F221 HydrophobicContact CD2-CE2 4.02Å; L125-F221 HydrophobicContact CD2-CZ 3.81Å; L167-F221 HydrophobicContact CB-CB 3.97Å; L167-F221 HydrophobicContact CD1-CB 3.68Å; L167-F221 HydrophobicContact CD1-CG 4.12Å; L167-F221 HydrophobicContact CG-CB 4.42Å; L168-F221 CarbonylContact O-C 3.52Å; L168-F221 WeakPolarHBondContact O-CA 3.3Å; E169-F221 HydrophobicContact CB-CD1 4.14Å; E169-F221 HydrophobicContact CB-CE1 4.27Å; P176-F221 HydrophobicContact CG-CE1 4.47Å; P176-F221 HydrophobicContact CG-CZ 3.77Å; F221-V231 CarbonylContact O-C 3.54Å; F221-V231 VanDerWaalsContact O-CA 3.31Å; F221-V231 WeakPolarHBondContact O-CA 3.37Å; F221-V231 WeakPolarHBondContact O-CG1 3.21Å; F221-H232 HydrophobicContact CB-CB 4.47Å; F221-H232 HydrophobicContact CD2-CB 4.5Å; F221-H232 PolarHBondContact N-O 2.82Å; F221-H232 PolarHBondContact O-N 2.84Å
222	F	96.1	Very high	93.4	Very high	5 Å²	5	43.1 Å²	43.1	2%	0.022	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	144	173.4	62.8	-81.1	0	0	0	112	L63 L167 L168 F170 M197 V230 V231	L63-F222 HydrophobicContact CB-CE1 3.94Å; L63-F222 HydrophobicContact CB-CZ 3.86Å; L167-F222 VanDerWaalsContact CA-O 3.28Å; L167-F222 WeakPolarHBondContact CA-O 3.42Å; L168-F222 HydrophobicContact CB-CD1 4.38Å; L168-F222 HydrophobicContact CB-CE1 3.75Å; L168-F222 HydrophobicContact CB-CE2 4.14Å; L168-F222 HydrophobicContact CB-CZ 3.62Å; L168-F222 HydrophobicContact CD1-CE2 4.24Å; L168-F222 HydrophobicContact CD1-CZ 4.02Å; L168-F222 HydrophobicContact CG-CZ 4.46Å; L168-F222 PolarHBondContact N-O 3.26Å; L168-F222 WeakPolarHBondContact O-CD1 3.44Å; L168-F222 PolarHBondContact O-N 2.86Å; F170-F222 AromaticContact CD1-CD1 3.73Å; F170-F222 HydrophobicContact CD1-CD1 3.73Å; F170-F222 HydrophobicContact CD1-CE1 4.02Å; F170-F222 HydrophobicContact CD2-CD1 4.28Å; F170-F222 HydrophobicContact CE1-CB 4.27Å; F170-F222 AromaticContact CE1-CD1 3.57Å; F170-F222 HydrophobicContact CE1-CD1 3.57Å; F170-F222 HydrophobicContact CE1-CE1 4.18Å; F170-F222 HydrophobicContact CE1-CG 4.12Å; F170-F222 HydrophobicContact CE2-CB 4.16Å; F170-F222 HydrophobicContact CE2-CD1 4.12Å; F170-F222 HydrophobicContact CG-CD1 4.09Å; F170-F222 HydrophobicContact CZ-CB 3.74Å; F170-F222 AromaticContact CZ-CD1 3.78Å; F170-F222 HydrophobicContact CZ-CD1 3.78Å; F170-F222 HydrophobicContact CZ-CG 4.08Å; M197-F222 HydrophobicContact CE-CB 4.04Å; M197-F222 HydrophobicContact SD-CB 3.97Å; F222-V230 WeakPolarHBondContact CA-O 3.46Å; F222-V231 HydrophobicContact CB-CG2 4.3Å
223	S	95.6	Very high	94	Very high	8 Å²	8	40.2 Å²	40.2	6%	0.056	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	132.1	-175.9	60	0	0	0	0	113.1	E227 L228 Y229 V230	S223-E227 WeakPolarHBondContact CB-O 3.43Å; S223-E227 PolarHBondContact OG-O 2.77Å; S223-L228 WeakPolarHBondContact OG-CA 3.28Å; S223-Y229 PolarHBondContact OG-N 3.31Å; S223-V230 PolarHBondContact N-O 2.9Å; S223-V230 PolarHBondContact OG-N 3.09Å; S223-V230 VanDerWaalsContact OG-N 3.15Å; S223-V230 PolarHBondContact OG-O 3.34Å
224	Q	94.1	Very high	94.8	Very high	53 Å²	53	33.7 Å²	33.7	25%	0.248	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	-43.8	164.7	-67.4	-56.4	-74.1	0	0	112.4	L166 L168 L228	L166-Q224 PolarHBondContact O-N 2.92Å; L168-Q224 HydrophobicContact CB-CG 4.36Å; L168-Q224 VanDerWaalsContact CD1-CD 3.49Å; L168-Q224 HydrophobicContact CD1-CG 3.6Å; L168-Q224 HydrophobicContact CG-CG 3.54Å; Q224-L228 WeakPolarHBondContact O-CD2 3.31Å
225	I	95.4	Very high	95.5	Very high	92 Å²	92	30 Å²	30	47%	0.472	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	140.3	-179.5	-54.4	-171.7	0	0	0	109.3	Y132 Q165 L166	Y132-I225 HydrophobicContact CE1-CD1 3.9Å; Q165-I225 WeakPolarHBondContact CA-O 3.13Å; L166-I225 HydrophobicContact CB-CB 4.09Å; L166-I225 HydrophobicContact CD1-CB 4.21Å; L166-I225 HydrophobicContact CD1-CD1 4.06Å; L166-I225 HydrophobicContact CD1-CG1 4.41Å; L166-I225 HydrophobicContact CG-CB 4.43Å; L166-I225 PolarHBondContact N-O 2.76Å; L166-I225 PolarHBondContact O-N 3.37Å
226	G	95.6	Very high	96	Very high	46 Å²	46	23.7 Å²	23.7	47%	0.474	13%	0.127	S	C	.	.	S	Bend	trans	108	-141.8	-170.4	0	0	0	0	0	110.3	L228	G226-L228 PolarHBondContact O-N 3.48Å
227	E	94.1	Very high	96.1	Very high	88 Å²	88	24 Å²	24	41%	0.411	13%	0.128	S	C	.	.	S	Bend	trans	-69	120.7	172.6	-169.3	175.7	-162	0	0	109.9	Q165 K191 S223 V230	Q165-E227 PolarHBondContact NE2-O 3.38Å; K191-E227 WeakPolarHBondContact CD-OE1 3.25Å; K191-E227 VanDerWaalsContact CE-OE1 3.25Å; K191-E227 WeakPolarHBondContact CE-OE1 3.41Å; K191-E227 VanDerWaalsContact CE-OE2 3.27Å; K191-E227 WeakPolarHBondContact CE-OE2 3.33Å; K191-E227 IonicContact NZ-OE1 2.69Å; K191-E227 PolarHBondContact NZ-OE1 3.06Å; K191-E227 IonicContact NZ-OE2 2.98Å; K191-E227 PolarHBondContact NZ-OE2 3.25Å; S223-E227 WeakPolarHBondContact CB-O 3.43Å; S223-E227 PolarHBondContact OG-O 2.77Å; E227-V230 HydrophobicContact CB-CG2 4.06Å; E227-V230 HydrophobicContact CG-CG2 3.72Å
228	L	95.1	Very high	96.1	Very high	98 Å²	98	31 Å²	31	51%	0.513	16%	0.158	S	C	.	.	S	Bend	trans	-86.5	162.7	-175.4	-60.3	-178	0	0	0	112.4	S223 Q224 G226 V230	S223-L228 WeakPolarHBondContact OG-CA 3.28Å; Q224-L228 WeakPolarHBondContact O-CD2 3.31Å; G226-L228 PolarHBondContact O-N 3.48Å; L228-V230 PolarHBondContact O-N 2.87Å
229	Y	96.1	Very high	96.1	Very high	86 Å²	86	33.7 Å²	33.7	34%	0.337	17%	0.172	S	C	.	.	S	Bend	trans	58.1	30.1	-175.4	-55.5	-78.2	0	0	0	113.3	L192 P194 M197 S223	L192-Y229 WeakPolarHBondContact CB-O 3.36Å; L192-Y229 PolarHBondContact N-O 3.29Å; P194-Y229 HydrophobicContact CB-CD2 4.01Å; P194-Y229 HydrophobicContact CB-CE2 3.74Å; P194-Y229 HydrophobicContact CG-CD2 4.14Å; P194-Y229 HydrophobicContact CG-CE2 4.27Å; M197-Y229 HydrophobicContact CB-CD1 4.33Å; S223-Y229 PolarHBondContact OG-N 3.31Å
230	V	97.7	Very high	96.2	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.006	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	134.5	176.2	-178.4	0	0	0	0	109.9	T189 Y190 K191 F222 S223 E227 L228	T189-V230 HydrophobicContact CG2-CG1 3.53Å; Y190-V230 CarbonylContact O-C 3.53Å; Y190-V230 WeakPolarHBondContact O-CA 3.42Å; K191-V230 HydrophobicContact CG-CG2 4.26Å; F222-V230 WeakPolarHBondContact CA-O 3.46Å; S223-V230 PolarHBondContact N-O 2.9Å; S223-V230 PolarHBondContact OG-N 3.09Å; S223-V230 VanDerWaalsContact OG-N 3.15Å; S223-V230 PolarHBondContact OG-O 3.34Å; E227-V230 HydrophobicContact CB-CG2 4.06Å; E227-V230 HydrophobicContact CG-CG2 3.72Å; L228-V230 PolarHBondContact O-N 2.87Å
231	V	97.8	Very high	96.3	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	138.2	171.8	173	0	0	0	0	109.8	F170 T189 Y190 L192 M197 W200 F221 F222	F170-V231 HydrophobicContact CE2-CG1 3.7Å; F170-V231 HydrophobicContact CE2-CG2 4.22Å; F170-V231 HydrophobicContact CZ-CG1 4.2Å; F170-V231 HydrophobicContact CZ-CG2 3.89Å; T189-V231 CarbonylContact C-O 3.57Å; T189-V231 WeakPolarHBondContact CA-O 3.48Å; Y190-V231 HydrophobicContact CD2-CG1 4.4Å; Y190-V231 PolarHBondContact N-O 2.82Å; Y190-V231 PolarHBondContact O-N 2.89Å; L192-V231 HydrophobicContact CD1-CG2 3.87Å; L192-V231 HydrophobicContact CG-CG2 4.38Å; M197-V231 HydrophobicContact CE-CG2 3.73Å; M197-V231 HydrophobicContact SD-CG2 3.49Å; M197-V231 WeakPolarHBondContact SD-CG2 3.3Å; W200-V231 HydrophobicContact CE3-CG2 4.19Å; W200-V231 HydrophobicContact CH2-CB 3.99Å; W200-V231 HydrophobicContact CH2-CG1 3.4Å; W200-V231 VanDerWaalsContact CH2-CG1 3.4Å; W200-V231 HydrophobicContact CH2-CG2 4.21Å; W200-V231 HydrophobicContact CZ2-CG1 4.38Å; W200-V231 HydrophobicContact CZ3-CB 4.14Å; W200-V231 HydrophobicContact CZ3-CG1 3.61Å; W200-V231 HydrophobicContact CZ3-CG2 3.89Å; F221-V231 CarbonylContact O-C 3.54Å; F221-V231 VanDerWaalsContact O-CA 3.31Å; F221-V231 WeakPolarHBondContact O-CA 3.37Å; F221-V231 WeakPolarHBondContact O-CG1 3.21Å; F222-V231 HydrophobicContact CB-CG2 4.3Å
232	H	98.3	Very high	96.2	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	126.1	171.1	-61	-71	0	0	0	110.2	Q165 L187 R188 T189 G220 F221	Q165-H232 PolarHBondContact OE1-NE2 3.23Å; L187-H232 HydrophobicContact CD1-CB 4.01Å; R188-H232 CarbonylContact O-C 3.55Å; R188-H232 WeakPolarHBondContact O-CA 3.38Å; T189-H232 WeakPolarHBondContact CG2-CE1 3.46Å; T189-H232 PolarHBondContact OG1-CE1 2.72Å; T189-H232 PolarHBondContact OG1-ND1 2.74Å; G220-H232 WeakPolarHBondContact CA-O 3.36Å; F221-H232 HydrophobicContact CB-CB 4.47Å; F221-H232 HydrophobicContact CD2-CB 4.5Å; F221-H232 PolarHBondContact N-O 2.82Å; F221-H232 PolarHBondContact O-N 2.84Å
233	H	97.8	Very high	96.2	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	125.8	165.6	-64.8	167.7	0	0	0	109.3	W173 L187 R188 Y190 W200 W204 W235	W173-H233 HydrophobicContact CH2-CB 4.09Å; W173-H233 AromaticContact CH2-CD2 3.32Å; W173-H233 WeakPolarHBondContact CH2-CD2 3.3Å; W173-H233 AromaticContact CH2-CE1 3.54Å; W173-H233 AromaticContact CH2-CG 3.47Å; W173-H233 VanDerWaalsContact CH2-CG 3.47Å; W173-H233 AromaticContact CH2-ND1 3.63Å; W173-H233 AromaticContact CH2-NE2 3.39Å; W173-H233 WeakPolarHBondContact CH2-NE2 3.39Å; W173-H233 HydrophobicContact CZ2-CB 4.25Å; W173-H233 AromaticContact CZ3-CD2 3.51Å; W173-H233 AromaticContact CZ3-CE1 3.64Å; W173-H233 AromaticContact CZ3-NE2 3.2Å; W173-H233 WeakPolarHBondContact CZ3-NE2 3.43Å; L187-H233 WeakPolarHBondContact CA-O 3.25Å; R188-H233 HydrophobicContact CB-CB 4.44Å; R188-H233 PolarHBondContact N-O 2.75Å; R188-H233 PolarHBondContact O-N 3.04Å; Y190-H233 HydrophobicContact CE2-CB 4.46Å; Y190-H233 AromaticContact CE2-ND1 3.55Å; W200-H233 AromaticContact CH2-CE1 3.28Å; W200-H233 WeakPolarHBondContact CH2-CE1 3.33Å; W200-H233 AromaticContact CH2-NE2 3.3Å; W200-H233 VanDerWaalsContact CH2-NE2 3.3Å; W200-H233 WeakPolarHBondContact CH2-NE2 3.27Å; W200-H233 AromaticContact CZ3-NE2 3.8Å; W204-H233 AromaticContact CD2-CE1 3.59Å; W204-H233 AromaticContact CE2-CE1 3.59Å; W204-H233 AromaticContact CE3-CE1 3.68Å; W204-H233 AromaticContact CH2-CE1 3.73Å; W204-H233 AromaticContact CH2-ND1 3.86Å; W204-H233 AromaticContact CZ2-CE1 3.66Å; W204-H233 AromaticContact CZ3-CE1 3.76Å; H233-W235 HydrophobicContact CB-CZ2 3.8Å; H233-W235 AromaticContact CG-CZ2 3.97Å; H233-W235 AromaticContact ND1-CZ2 3.7Å
234	L	97.7	Very high	96.3	Very high	4 Å²	4	49 Å²	49	2%	0.021	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	122.7	173	-173.7	63.2	0	0	0	108.9	W112 L125 Y185 L187 V218 G219 M275 L283	W112-L234 HydrophobicContact CH2-CD2 3.86Å; W112-L234 HydrophobicContact CZ2-CD2 4.04Å; L125-L234 HydrophobicContact CD2-CD2 4.47Å; Y185-L234 HydrophobicContact CD1-CD1 4.08Å; Y185-L234 HydrophobicContact CD1-CG 4.28Å; L187-L234 HydrophobicContact CB-CD1 4.49Å; L187-L234 HydrophobicContact CD1-CD1 4.32Å; V218-L234 HydrophobicContact CB-CB 4.26Å; V218-L234 HydrophobicContact CB-CD2 4.17Å; V218-L234 HydrophobicContact CB-CG 3.97Å; V218-L234 WeakPolarHBondContact CB-O 3.28Å; V218-L234 HydrophobicContact CG1-CD2 3.74Å; V218-L234 HydrophobicContact CG1-CG 4.1Å; V218-L234 PolarHBondContact N-O 3.11Å; G219-L234 PolarHBondContact N-O 3.17Å; G219-L234 PolarHBondContact O-N 3.26Å; L234-M275 HydrophobicContact CD1-CE 3.75Å; L234-L283 HydrophobicContact CD2-CD1 4.19Å
235	W	97.1	Very high	96.3	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	153.1	177.5	-47.8	91.4	0	0	0	110	W173 Y185 E186 W204 I208 R211 E216 A217 H233 Y237	W173-W235 AromaticContact CH2-CH2 3.43Å; W173-W235 HydrophobicContact CH2-CH2 3.43Å; W173-W235 VanDerWaalsContact CH2-CH2 3.43Å; W173-W235 AromaticContact CH2-CZ2 3.53Å; W173-W235 HydrophobicContact CH2-CZ2 3.53Å; W173-W235 HydrophobicContact CH2-CZ3 4.34Å; W173-W235 AromaticContact CZ2-CH2 3.45Å; W173-W235 HydrophobicContact CZ2-CH2 3.45Å; W173-W235 VanDerWaalsContact CZ2-CH2 3.45Å; W173-W235 AromaticContact CZ2-CZ2 3.68Å; W173-W235 HydrophobicContact CZ2-CZ2 3.68Å; W173-W235 AromaticContact CZ2-CZ3 3.93Å; W173-W235 HydrophobicContact CZ2-CZ3 3.93Å; Y185-W235 CarbonylContact C-O 3.57Å; Y185-W235 WeakPolarHBondContact CA-O 3.49Å; E186-W235 HydrophobicContact CB-CB 4.25Å; E186-W235 PolarHBondContact N-O 2.74Å; E186-W235 PolarHBondContact O-N 3.44Å; W204-W235 HydrophobicContact CH2-CZ2 4.31Å; W204-W235 HydrophobicContact CZ3-CH2 4.15Å; W204-W235 HydrophobicContact CZ3-CZ2 4.23Å; I208-W235 HydrophobicContact CD1-CH2 3.73Å; I208-W235 HydrophobicContact CD1-CZ3 4.06Å; R211-W235 HydrophobicContact CB-CH2 4.25Å; R211-W235 HydrophobicContact CB-CZ3 3.97Å; E216-W235 HydrophobicContact CB-CE3 4.35Å; E216-W235 HydrophobicContact CG-CE3 3.54Å; E216-W235 HydrophobicContact CG-CZ3 3.88Å; E216-W235 CarbonylContact O-C 3.58Å; E216-W235 WeakPolarHBondContact O-CA 3.49Å; A217-W235 HydrophobicContact CB-CE3 4.14Å; A217-W235 HydrophobicContact CB-CZ3 3.73Å; H233-W235 HydrophobicContact CB-CZ2 3.8Å; H233-W235 AromaticContact CG-CZ2 3.97Å; H233-W235 AromaticContact ND1-CZ2 3.7Å; W235-Y237 HydrophobicContact CB-CE2 3.64Å
236	A	96.3	Very high	96.3	Very high	3 Å²	3	48.3 Å²	48.3	3%	0.025	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	140.7	173.3	0	0	0	0	0	110.6	R179 I184 Y185 E216 V218	R179-A236 VanDerWaalsContact NH1-CB 3.35Å; I184-A236 WeakPolarHBondContact O-CA 3.39Å; Y185-A236 HydrophobicContact CD1-CB 3.97Å; Y185-A236 HydrophobicContact CE1-CB 3.74Å; E216-A236 PolarHBondContact O-N 3.5Å; V218-A236 HydrophobicContact CG2-CB 3.45Å; V218-A236 VanDerWaalsContact CG2-CB 3.45Å
237	Y	95.9	Very high	96.2	Very high	8 Å²	8	49.5 Å²	49.5	3%	0.031	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	156	178.5	-49.9	-82.3	0	0	0	109	N183 I184 E186 R211 E216 W235 D239 R243 T246	N183-Y237 CarbonylContact C-O 3.53Å; N183-Y237 WeakPolarHBondContact CA-O 3.38Å; I184-Y237 PolarHBondContact N-O 3.48Å; I184-Y237 PolarHBondContact O-N 2.88Å; E186-Y237 HydrophobicContact CB-CE2 3.83Å; E186-Y237 PolarHBondContact OE2-OH 2.84Å; R211-Y237 PolarHBondContact NH2-OH 2.88Å; E216-Y237 HydrophobicContact CB-CD1 4.19Å; E216-Y237 HydrophobicContact CB-CE1 3.75Å; E216-Y237 HydrophobicContact CG-CE1 4.28Å; W235-Y237 HydrophobicContact CB-CE2 3.64Å; Y237-D239 VanDerWaalsContact C-N 3.34Å; Y237-R243 HydrophobicContact CD1-CB 3.91Å; Y237-R243 HydrophobicContact CD1-CG 4.28Å; Y237-R243 HydrophobicContact CD2-CB 3.74Å; Y237-R243 HydrophobicContact CD2-CG 3.76Å; Y237-R243 HydrophobicContact CE1-CB 4.29Å; Y237-R243 HydrophobicContact CE1-CG 4.19Å; Y237-R243 HydrophobicContact CE2-CB 4.13Å; Y237-R243 HydrophobicContact CE2-CG 3.64Å; Y237-R243 HydrophobicContact CG-CB 3.61Å; Y237-R243 HydrophobicContact CG-CG 4.07Å; Y237-T246 HydrophobicContact CE1-CG2 4.09Å
238	K	94.8	Very high	96.1	Very high	151 Å²	151	49.1 Å²	49.1	66%	0.657	23%	0.232	S	C	*	.	S	Bend	trans	-62.4	-44.5	174.4	-178.6	-175	174.9	-173.6	0	111.2	S242	K238-S242 PolarHBondContact N-OG 3.31Å
239	D	95.4	Very high	96	Very high	60 Å²	60	46 Å²	46	32%	0.321	22%	0.22	S	C	.	.	S	Bend	trans	-159.8	-179.8	-175.8	50.9	44.7	0	0	0	111.1	I184 Y237 Q241 S242 R243	I184-D239 VanDerWaalsContact CD1-C 3.44Å; Y237-D239 VanDerWaalsContact C-N 3.34Å; D239-Q241 VanDerWaalsContact C-N 3.31Å; D239-Q241 PolarHBondContact O-N 2.89Å; D239-Q241 PolarHBondContact OD1-N 2.99Å; D239-S242 PolarHBondContact N-OG 2.82Å; D239-S242 PolarHBondContact O-OG 2.96Å; D239-S242 WeakPolarHBondContact OD1-CB 3.46Å; D239-S242 PolarHBondContact OD1-N 2.78Å; D239-S242 PolarHBondContact OD1-OG 3.33Å; D239-R243 WeakPolarHBondContact O-CB 3.3Å; D239-R243 PolarHBondContact O-N 3.15Å; D239-R243 VanDerWaalsContact O-N 3.1Å
240	L	97.2	Very high	95.8	Very high	63 Å²	63	42 Å²	42	33%	0.33	21%	0.205	S	C	.	.	H	α-helix	trans	-67.5	-30.1	-179.7	-69.1	175.9	0	0	0	113.2	W115 Y116 I184 R243 E244 I274	W115-L240 HydrophobicContact CH2-CD1 4.07Å; W115-L240 HydrophobicContact CZ3-CD1 3.92Å; W115-L240 HydrophobicContact CZ3-CG 4.22Å; Y116-L240 HydrophobicContact CE2-CD1 3.91Å; I184-L240 HydrophobicContact CD1-CD2 3.61Å; I184-L240 HydrophobicContact CD1-CG 3.94Å; L240-R243 WeakPolarHBondContact O-CB 3.2Å; L240-R243 PolarHBondContact O-N 2.98Å; L240-E244 PolarHBondContact O-N 3.48Å; L240-I274 HydrophobicContact CD2-CD1 4.35Å; L240-I274 HydrophobicContact CD2-CG1 4.19Å; L240-I274 HydrophobicContact CD2-CG2 4.19Å
241	Q	97.2	Very high	95.4	Very high	105 Å²	105	48.9 Å²	48.9	49%	0.491	23%	0.231	S	C	.	.	H	α-helix	trans	-69.4	-52.7	179.6	-178.6	61.4	38.4	0	0	110.4	D239 R243 E244 E245	D239-Q241 VanDerWaalsContact C-N 3.31Å; D239-Q241 PolarHBondContact O-N 2.89Å; D239-Q241 PolarHBondContact OD1-N 2.99Å; Q241-R243 PolarHBondContact O-N 3.22Å; Q241-E244 WeakPolarHBondContact O-CB 3.44Å; Q241-E244 PolarHBondContact O-N 2.8Å; Q241-E245 WeakPolarHBondContact CG-OE1 3.2Å; Q241-E245 PolarHBondContact NE2-OE1 3.33Å; Q241-E245 WeakPolarHBondContact O-CG 3.47Å; Q241-E245 PolarHBondContact O-N 3.2Å
242	S	95.3	Very high	95.1	Very high	22 Å²	22	59 Å²	59	15%	0.154	27%	0.27	C	S	.	.	H	α-helix	trans	-59	-34.4	173.9	54.2	0	0	0	0	112.2	K238 D239 T246	K238-S242 PolarHBondContact N-OG 3.31Å; D239-S242 PolarHBondContact N-OG 2.82Å; D239-S242 PolarHBondContact O-OG 2.96Å; D239-S242 WeakPolarHBondContact OD1-CB 3.46Å; D239-S242 PolarHBondContact OD1-N 2.78Å; D239-S242 PolarHBondContact OD1-OG 3.33Å; S242-T246 WeakPolarHBondContact O-CB 3.38Å; S242-T246 PolarHBondContact O-N 3.36Å; S242-T246 PolarHBondContact O-OG1 2.88Å
243	R	96.3	Very high	94.7	Very high	49 Å²	49	61 Å²	61	19%	0.185	28%	0.278	C	S	.	.	H	α-helix	trans	-60	-48.6	170.5	174.8	-179.1	173.6	-85.2	5.8	112.2	E186 Y237 D239 L240 Q241 R247	E186-R243 VanDerWaalsContact CD-NE 3.25Å; E186-R243 VanDerWaalsContact CD-NH2 3.3Å; E186-R243 IonicContact OE1-CZ 3.36Å; E186-R243 IonicContact OE1-NE 3.74Å; E186-R243 IonicContact OE1-NH2 2.74Å; E186-R243 PolarHBondContact OE1-NH2 3.18Å; E186-R243 IonicContact OE2-CZ 3.97Å; E186-R243 IonicContact OE2-NE 2.7Å; E186-R243 PolarHBondContact OE2-NE 3.26Å; E186-R243 IonicContact OE2-NH2 3.55Å; E186-R243 PolarHBondContact OE2-NH2 3.36Å; Y237-R243 HydrophobicContact CD1-CB 3.91Å; Y237-R243 HydrophobicContact CD1-CG 4.28Å; Y237-R243 HydrophobicContact CD2-CB 3.74Å; Y237-R243 HydrophobicContact CD2-CG 3.76Å; Y237-R243 HydrophobicContact CE1-CB 4.29Å; Y237-R243 HydrophobicContact CE1-CG 4.19Å; Y237-R243 HydrophobicContact CE2-CB 4.13Å; Y237-R243 HydrophobicContact CE2-CG 3.64Å; Y237-R243 HydrophobicContact CG-CB 3.61Å; Y237-R243 HydrophobicContact CG-CG 4.07Å; D239-R243 WeakPolarHBondContact O-CB 3.3Å; D239-R243 PolarHBondContact O-N 3.15Å; D239-R243 VanDerWaalsContact O-N 3.1Å; L240-R243 WeakPolarHBondContact O-CB 3.2Å; L240-R243 PolarHBondContact O-N 2.98Å; Q241-R243 PolarHBondContact O-N 3.22Å; R243-R247 WeakPolarHBondContact O-CB 3.39Å; R243-R247 VanDerWaalsContact O-CG 3.25Å; R243-R247 WeakPolarHBondContact O-CG 3.32Å; R243-R247 PolarHBondContact O-N 2.69Å; R243-R247 VanDerWaalsContact O-N 3.08Å
244	E	96.3	Very high	94.3	Very high	101 Å²	101	72 Å²	72	47%	0.472	32%	0.32	S	S	.	.	H	α-helix	trans	-61.4	-50.4	178.5	177.9	174.7	-172.1	0	0	111	L240 Q241 T246 R247 N248	L240-E244 PolarHBondContact O-N 3.48Å; Q241-E244 WeakPolarHBondContact O-CB 3.44Å; Q241-E244 PolarHBondContact O-N 2.8Å; E244-T246 PolarHBondContact O-N 2.99Å; E244-R247 PolarHBondContact O-N 3.26Å; E244-N248 WeakPolarHBondContact CG-ND2 3.33Å; E244-N248 WeakPolarHBondContact O-CB 3.36Å; E244-N248 VanDerWaalsContact O-CG 3.31Å; E244-N248 PolarHBondContact O-N 3.07Å; E244-N248 PolarHBondContact O-ND2 3.21Å
245	E	95.8	Very high	93.8	Very high	107 Å²	107	72.3 Å²	72.3	50%	0.5	32%	0.323	S	S	.	.	H	α-helix	trans	-57.6	-48	179.6	-70.9	169	-176.6	0	0	111.7	Q241 R247 N248 A249	Q241-E245 WeakPolarHBondContact CG-OE1 3.2Å; Q241-E245 PolarHBondContact NE2-OE1 3.33Å; Q241-E245 WeakPolarHBondContact O-CG 3.47Å; Q241-E245 PolarHBondContact O-N 3.2Å; E245-R247 VanDerWaalsContact C-N 3.35Å; E245-R247 PolarHBondContact O-N 3.32Å; E245-N248 PolarHBondContact O-N 3.15Å; E245-A249 VanDerWaalsContact O-CB 3.27Å; E245-A249 WeakPolarHBondContact O-CB 3.38Å; E245-A249 PolarHBondContact O-N 3.21Å
246	T	94.4	Very high	93.5	Very high	23 Å²	23	73.2 Å²	73.2	14%	0.141	33%	0.327	C	S	.	.	H	α-helix	trans	-60.3	-44.4	178.5	-61.1	0	0	0	0	111.3	N214 E216 Y237 S242 E244 A249 A250	N214-T246 HydrophobicContact CB-CG2 4.2Å; E216-T246 HydrophobicContact CB-CG2 4.35Å; E216-T246 HydrophobicContact CG-CG2 4.2Å; E216-T246 WeakPolarHBondContact OE1-CG2 3.38Å; Y237-T246 HydrophobicContact CE1-CG2 4.09Å; S242-T246 WeakPolarHBondContact O-CB 3.38Å; S242-T246 PolarHBondContact O-N 3.36Å; S242-T246 PolarHBondContact O-OG1 2.88Å; E244-T246 PolarHBondContact O-N 2.99Å; T246-A249 PolarHBondContact O-N 3.41Å; T246-A250 PolarHBondContact O-N 3.22Å; T246-A250 VanDerWaalsContact O-N 3.16Å
247	R	93.5	Very high	93.3	Very high	71 Å²	71	77.1 Å²	77.1	27%	0.268	35%	0.347	S	S	.	.	H	α-helix	trans	-67.2	-39.4	178.9	-74.3	178.3	62.9	122	-1	112.4	E186 R188 R243 E244 E245 A250	E186-R247 IonicContact OE1-NH1 2.78Å; E186-R247 PolarHBondContact OE1-NH1 3.15Å; E186-R247 IonicContact OE2-NH1 3.4Å; R188-R247 VanDerWaalsContact NH1-NH1 3.18Å; R243-R247 WeakPolarHBondContact O-CB 3.39Å; R243-R247 VanDerWaalsContact O-CG 3.25Å; R243-R247 WeakPolarHBondContact O-CG 3.32Å; R243-R247 PolarHBondContact O-N 2.69Å; R243-R247 VanDerWaalsContact O-N 3.08Å; E244-R247 PolarHBondContact O-N 3.26Å; E245-R247 VanDerWaalsContact C-N 3.35Å; E245-R247 PolarHBondContact O-N 3.32Å; R247-A250 PolarHBondContact O-N 3.23Å
248	N	93.2	Very high	93.2	Very high	80 Å²	80	82.3 Å²	82.3	43%	0.428	37%	0.372	S	S	.	.	H	α-helix	trans	-71.1	-36.3	177.7	-71.6	-17.3	0	0	0	111.5	E244 E245 A250 W251	E244-N248 WeakPolarHBondContact CG-ND2 3.33Å; E244-N248 WeakPolarHBondContact O-CB 3.36Å; E244-N248 VanDerWaalsContact O-CG 3.31Å; E244-N248 PolarHBondContact O-N 3.07Å; E244-N248 PolarHBondContact O-ND2 3.21Å; E245-N248 PolarHBondContact O-N 3.15Å; N248-A250 VanDerWaalsContact C-N 3.3Å; N248-A250 PolarHBondContact O-N 3.17Å; N248-W251 PolarHBondContact O-N 3.06Å
249	A	92.5	Very high	93.1	Very high	32 Å²	32	75.6 Å²	75.6	26%	0.264	34%	0.343	S	S	.	.	H	α-helix	trans	-62.8	-35.7	174.9	0	0	0	0	0	112.2	E245 T246 W251 R252	E245-A249 VanDerWaalsContact O-CB 3.27Å; E245-A249 WeakPolarHBondContact O-CB 3.38Å; E245-A249 PolarHBondContact O-N 3.21Å; T246-A249 PolarHBondContact O-N 3.41Å; A249-W251 VanDerWaalsContact C-N 3.25Å; A249-W251 PolarHBondContact O-N 3.4Å; A249-R252 WeakPolarHBondContact O-CB 3.28Å; A249-R252 PolarHBondContact O-N 2.94Å
250	A	90.6	Very high	92.9	Very high	2 Å²	2	74.3 Å²	74.3	2%	0.017	34%	0.338	C	S	.	.	H	α-helix	trans	-58.8	-35	176.4	0	0	0	0	0	112.9	T246 R247 N248 R252 K253 W256	T246-A250 PolarHBondContact O-N 3.22Å; T246-A250 VanDerWaalsContact O-N 3.16Å; R247-A250 PolarHBondContact O-N 3.23Å; N248-A250 VanDerWaalsContact C-N 3.3Å; N248-A250 PolarHBondContact O-N 3.17Å; A250-R252 PolarHBondContact O-N 3.3Å; A250-K253 WeakPolarHBondContact O-CB 3.49Å; A250-K253 PolarHBondContact O-N 2.84Å; A250-W256 HydrophobicContact CB-CD2 4.38Å; A250-W256 WeakPolarHBondContact O-CB 3.4Å
251	W	90.4	Very high	92.7	Very high	146 Å²	146	79.2 Å²	79.2	55%	0.553	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-17.2	176.3	-75.8	103.4	0	0	0	114.5	N248 A249 K253 W256 D257 V260	N248-W251 PolarHBondContact O-N 3.06Å; A249-W251 VanDerWaalsContact C-N 3.25Å; A249-W251 PolarHBondContact O-N 3.4Å; W251-K253 VanDerWaalsContact C-N 3.3Å; W251-W256 AromaticContact CD2-CD1 3.71Å; W251-W256 AromaticContact CD2-NE1 3.85Å; W251-W256 AromaticContact CE2-NE1 3.81Å; W251-W256 AromaticContact CE3-CD1 3.78Å; W251-D257 HydrophobicContact CE3-CB 4.49Å; W251-D257 HydrophobicContact CZ3-CB 4.16Å; W251-V260 HydrophobicContact CH2-CB 4.11Å; W251-V260 HydrophobicContact CH2-CG1 3.94Å; W251-V260 HydrophobicContact CH2-CG2 3.94Å; W251-V260 HydrophobicContact CZ2-CG2 4.26Å; W251-V260 HydrophobicContact CZ3-CG2 4.49Å
252	R	91.3	Very high	92.6	Very high	213 Å²	213	80.2 Å²	80.2	80%	0.804	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-9.7	174.5	-57.2	178.4	-173.6	152.4	1.5	112.2	A249 A250	A249-R252 WeakPolarHBondContact O-CB 3.28Å; A249-R252 PolarHBondContact O-N 2.94Å; A250-R252 PolarHBondContact O-N 3.3Å
253	K	89.9	Confident	92.7	Very high	41 Å²	41	79.6 Å²	79.6	18%	0.178	35%	0.348	C	S	.	.	S	Bend	trans	-85.5	122.3	179	-59.8	-173.1	179.9	-170.1	0	109.8	Y210 E213 A250 W251 G255 W256	Y210-K253 HydrophobicContact CD1-CB 4.26Å; Y210-K253 HydrophobicContact CD1-CD 4.4Å; Y210-K253 WeakPolarHBondContact O-CD 3.44Å; Y210-K253 WeakPolarHBondContact O-CE 3.18Å; Y210-K253 PolarHBondContact O-NZ 3.03Å; E213-K253 IonicContact OE2-NZ 3.6Å; E213-K253 PolarHBondContact OE2-NZ 2.91Å; A250-K253 WeakPolarHBondContact O-CB 3.49Å; A250-K253 PolarHBondContact O-N 2.84Å; W251-K253 VanDerWaalsContact C-N 3.3Å; K253-G255 PolarHBondContact O-N 3.05Å; K253-W256 WeakPolarHBondContact O-CB 3.31Å; K253-W256 PolarHBondContact O-N 2.91Å
254	R	89.2	Confident	92.6	Very high	231 Å²	231	80.8 Å²	80.8	87%	0.872	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	128.7	177.7	177.6	177.8	157.4	-175.7	-6.2	110.6	Y210	Y210-R254 PolarHBondContact OH-O 3.07Å
255	G	87.8	Confident	92.7	Very high	10 Å²	10	79.4 Å²	79.4	10%	0.103	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	91.7	-6.9	178.7	0	0	0	0	0	114.5	K253 D257 N259	K253-G255 PolarHBondContact O-N 3.05Å; G255-D257 PolarHBondContact N-OD1 3.33Å; G255-N259 PolarHBondContact O-N 3.15Å
256	W	91.1	Very high	92.8	Very high	19 Å²	19	75 Å²	75	7%	0.072	34%	0.341	C	S	.	.	H	α-helix	trans	-67.4	-42.2	170.8	177.4	-105.4	0	0	0	111.6	W204 A207 Y210 R211 A250 W251 K253 N259 V260	W204-W256 AromaticContact CH2-CH2 3.74Å; W204-W256 HydrophobicContact CH2-CH2 3.74Å; W204-W256 HydrophobicContact CH2-CZ3 4.32Å; W204-W256 HydrophobicContact CZ2-CH2 4.45Å; W204-W256 HydrophobicContact CZ3-CH2 4.15Å; W204-W256 HydrophobicContact CZ3-CZ3 4.32Å; A207-W256 HydrophobicContact CB-CE3 4.44Å; A207-W256 HydrophobicContact CB-CZ3 4.15Å; Y210-W256 HydrophobicContact CD2-CE3 4.17Å; R211-W256 VanDerWaalsContact CD-CH2 3.5Å; R211-W256 HydrophobicContact CG-CH2 4.22Å; R211-W256 HydrophobicContact CG-CZ3 3.93Å; A250-W256 HydrophobicContact CB-CD2 4.38Å; A250-W256 WeakPolarHBondContact O-CB 3.4Å; W251-W256 AromaticContact CD2-CD1 3.71Å; W251-W256 AromaticContact CD2-NE1 3.85Å; W251-W256 AromaticContact CE2-NE1 3.81Å; W251-W256 AromaticContact CE3-CD1 3.78Å; K253-W256 WeakPolarHBondContact O-CB 3.31Å; K253-W256 PolarHBondContact O-N 2.91Å; W256-N259 WeakPolarHBondContact O-CB 3.25Å; W256-N259 PolarHBondContact O-N 3.18Å; W256-V260 HydrophobicContact CZ2-CG2 4.21Å; W256-V260 WeakPolarHBondContact O-CG2 3.42Å; W256-V260 PolarHBondContact O-N 3.2Å
257	D	91.7	Very high	92.9	Very high	85 Å²	85	75.3 Å²	75.3	46%	0.455	34%	0.342	S	S	.	.	H	α-helix	trans	-59.8	-45.8	176.2	59.8	-46.5	0	0	0	112.3	W251 G255 N259 V260 Y261	W251-D257 HydrophobicContact CE3-CB 4.49Å; W251-D257 HydrophobicContact CZ3-CB 4.16Å; G255-D257 PolarHBondContact N-OD1 3.33Å; D257-N259 VanDerWaalsContact C-N 3.34Å; D257-N259 PolarHBondContact O-N 3.45Å; D257-V260 PolarHBondContact O-N 3.02Å; D257-Y261 PolarHBondContact O-N 3.4Å
258	E	92.6	Very high	93.1	Very high	118 Å²	118	80.2 Å²	80.2	55%	0.551	36%	0.361	S	S	*	.	H	α-helix	trans	-59.6	-44.5	173.8	-68.1	179.7	-173.3	0	0	111.5	V260 Y261 Y262	E258-V260 VanDerWaalsContact C-N 3.32Å; E258-V260 PolarHBondContact O-N 3.08Å; E258-Y261 WeakPolarHBondContact O-CB 3.39Å; E258-Y261 PolarHBondContact O-N 3Å; E258-Y262 WeakPolarHBondContact O-CD2 3.27Å; E258-Y262 PolarHBondContact O-N 3.38Å
259	N	92.4	Very high	93.4	Very high	9 Å²	9	81.2 Å²	81.2	5%	0.048	36%	0.363	C	S	.	.	H	α-helix	trans	-60.7	-42.1	176.4	175	65.4	0	0	0	112.1	N203 A207 G255 W256 D257 Y261 Y262 T263	N203-N259 PolarHBondContact O-OD1 3.02Å; A207-N259 HydrophobicContact CB-CB 3.76Å; A207-N259 WeakPolarHBondContact CB-ND2 3.41Å; A207-N259 WeakPolarHBondContact CB-OD1 3.35Å; G255-N259 PolarHBondContact O-N 3.15Å; W256-N259 WeakPolarHBondContact O-CB 3.25Å; W256-N259 PolarHBondContact O-N 3.18Å; D257-N259 VanDerWaalsContact C-N 3.34Å; D257-N259 PolarHBondContact O-N 3.45Å; N259-Y261 VanDerWaalsContact C-N 3.32Å; N259-Y262 PolarHBondContact O-N 2.71Å; N259-T263 WeakPolarHBondContact O-CB 3.11Å; N259-T263 VanDerWaalsContact O-CG2 3.29Å; N259-T263 WeakPolarHBondContact O-CG2 3.3Å; N259-T263 PolarHBondContact O-N 2.96Å; N259-T263 PolarHBondContact O-OG1 3.12Å; N259-T263 WeakPolarHBondContact OD1-CG2 3.48Å
260	V	91.6	Very high	93.6	Very high	34 Å²	34	85 Å²	85	21%	0.206	38%	0.376	C	S	.	.	H	α-helix	trans	-62.2	-43.8	175.8	175.5	0	0	0	0	110.3	W251 W256 D257 E258 Y262 T263 V264	W251-V260 HydrophobicContact CH2-CB 4.11Å; W251-V260 HydrophobicContact CH2-CG1 3.94Å; W251-V260 HydrophobicContact CH2-CG2 3.94Å; W251-V260 HydrophobicContact CZ2-CG2 4.26Å; W251-V260 HydrophobicContact CZ3-CG2 4.49Å; W256-V260 HydrophobicContact CZ2-CG2 4.21Å; W256-V260 WeakPolarHBondContact O-CG2 3.42Å; W256-V260 PolarHBondContact O-N 3.2Å; D257-V260 PolarHBondContact O-N 3.02Å; E258-V260 VanDerWaalsContact C-N 3.32Å; E258-V260 PolarHBondContact O-N 3.08Å; V260-Y262 VanDerWaalsContact C-N 3.33Å; V260-Y262 PolarHBondContact O-N 3.32Å; V260-T263 PolarHBondContact O-N 2.77Å; V260-V264 HydrophobicContact CG1-CG2 3.66Å; V260-V264 WeakPolarHBondContact O-CB 3.31Å; V260-V264 VanDerWaalsContact O-CG2 3.32Å; V260-V264 WeakPolarHBondContact O-CG2 3.35Å; V260-V264 PolarHBondContact O-N 2.82Å
261	Y	93.9	Very high	93.9	Very high	165 Å²	165	87.6 Å²	87.6	65%	0.647	39%	0.388	S	S	*	.	H	α-helix	trans	-57	-43	177.4	179.7	-96	0	0	0	112.6	D257 E258 N259 P265	D257-Y261 PolarHBondContact O-N 3.4Å; E258-Y261 WeakPolarHBondContact O-CB 3.39Å; E258-Y261 PolarHBondContact O-N 3Å; N259-Y261 VanDerWaalsContact C-N 3.32Å; Y261-P265 WeakPolarHBondContact O-CD 3.44Å; Y261-P265 VanDerWaalsContact O-CG 3.3Å; Y261-P265 WeakPolarHBondContact O-CG 3.39Å
262	Y	95.8	Very high	94.3	Very high	127 Å²	127	82.9 Å²	82.9	50%	0.498	38%	0.377	S	S	.	.	H	α-helix	trans	-81.5	-26.4	-179.8	-69.7	-64.3	0	0	0	114.4	E258 N259 V260	E258-Y262 WeakPolarHBondContact O-CD2 3.27Å; E258-Y262 PolarHBondContact O-N 3.38Å; N259-Y262 PolarHBondContact O-N 2.71Å; V260-Y262 VanDerWaalsContact C-N 3.33Å; V260-Y262 PolarHBondContact O-N 3.32Å
263	T	95.4	Very high	94.6	Very high	8 Å²	8	72.7 Å²	72.7	5%	0.049	34%	0.339	C	S	.	.	H	α-helix	trans	-91.4	-37.4	-175.2	55	0	0	0	0	113.7	N203 N259 V260 L266	N203-T263 HydrophobicContact CB-CG2 3.52Å; N259-T263 WeakPolarHBondContact O-CB 3.11Å; N259-T263 VanDerWaalsContact O-CG2 3.29Å; N259-T263 WeakPolarHBondContact O-CG2 3.3Å; N259-T263 PolarHBondContact O-N 2.96Å; N259-T263 PolarHBondContact O-OG1 3.12Å; N259-T263 WeakPolarHBondContact OD1-CG2 3.48Å; V260-T263 PolarHBondContact O-N 2.77Å; T263-L266 WeakPolarHBondContact O-CB 3.08Å; T263-L266 PolarHBondContact O-N 3.39Å; T263-L266 VanDerWaalsContact O-N 3.12Å
264	V	95.6	Very high	95	Very high	75 Å²	75	71.3 Å²	71.3	46%	0.455	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-59.7	-44.2	-176.7	168.9	0	0	0	0	112.9	V260 L266 V267	V260-V264 HydrophobicContact CG1-CG2 3.66Å; V260-V264 WeakPolarHBondContact O-CB 3.31Å; V260-V264 VanDerWaalsContact O-CG2 3.32Å; V260-V264 WeakPolarHBondContact O-CG2 3.35Å; V260-V264 PolarHBondContact O-N 2.82Å; V264-L266 PolarHBondContact O-N 2.83Å; V264-L266 VanDerWaalsContact O-N 3.08Å; V264-V267 PolarHBondContact O-N 3.42Å
265	P	97.4	Very high	95.4	Very high	71 Å²	71	60.3 Å²	60.3	46%	0.461	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-61.9	-18.4	178.1	-25.2	36.2	0	0	0	114.3	K193 Y261 V267	K193-P265 WeakPolarHBondContact CE-O 3.49Å; K193-P265 PolarHBondContact NZ-O 2.87Å; Y261-P265 WeakPolarHBondContact O-CD 3.44Å; Y261-P265 VanDerWaalsContact O-CG 3.3Å; Y261-P265 WeakPolarHBondContact O-CG 3.39Å; P265-V267 VanDerWaalsContact C-N 3.34Å
266	L	97.8	Very high	95.9	Very high	16 Å²	16	63.5 Å²	63.5	8%	0.084	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-84.8	-10.5	178.5	-51.2	179	0	0	0	112.5	L192 K193 T196 E199 W200 T263 V264	L192-L266 WeakPolarHBondContact CA-O 3.47Å; K193-L266 WeakPolarHBondContact CG-O 3.47Å; K193-L266 PolarHBondContact N-O 2.93Å; T196-L266 HydrophobicContact CG2-CD2 4.04Å; E199-L266 HydrophobicContact CB-CD1 4.18Å; E199-L266 HydrophobicContact CG-CD1 3.84Å; W200-L266 HydrophobicContact CB-CD1 3.91Å; T263-L266 WeakPolarHBondContact O-CB 3.08Å; T263-L266 PolarHBondContact O-N 3.39Å; T263-L266 VanDerWaalsContact O-N 3.12Å; V264-L266 PolarHBondContact O-N 2.83Å; V264-L266 VanDerWaalsContact O-N 3.08Å
267	V	97.9	Very high	96.1	Very high	28 Å²	28	63.2 Å²	63.2	17%	0.17	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	133.5	-177.6	-177.3	0	0	0	0	110.2	Y190 L192 V264 P265 H269 M270	Y190-V267 HydrophobicContact CD1-CG1 4.33Å; Y190-V267 HydrophobicContact CD1-CG2 4.24Å; L192-V267 HydrophobicContact CD2-CG2 3.82Å; V264-V267 PolarHBondContact O-N 3.42Å; P265-V267 VanDerWaalsContact C-N 3.34Å; V267-H269 WeakPolarHBondContact CG1-O 3.25Å; V267-M270 HydrophobicContact CG1-CB 4.21Å
268	R	97.7	Very high	96.3	Very high	174 Å²	174	60.1 Å²	60.1	66%	0.657	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.1	-39.6	171.4	-68.1	-176.1	168	-176.1	-3.5	112.2	K191 K193 P194	K191-R268 PolarHBondContact O-N 3.29Å; K193-R268 HydrophobicContact CB-CG 4.46Å; K193-R268 HydrophobicContact CG-CG 3.62Å; P194-R268 VanDerWaalsContact CD-NH2 3.31Å
269	H	97.9	Very high	96.3	Very high	102 Å²	102	63.4 Å²	63.4	47%	0.472	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	143.3	-179.1	-178.3	80.7	0	0	0	109.6	K191 V267	K191-H269 HydrophobicContact CB-CB 4.11Å; K191-H269 HydrophobicContact CD-CB 4.21Å; K191-H269 HydrophobicContact CG-CB 4.23Å; K191-H269 PolarHBondContact N-O 2.86Å; K191-H269 PolarHBondContact O-N 3.2Å; V267-H269 WeakPolarHBondContact CG1-O 3.25Å
270	M	97.1	Very high	96.3	Very high	112 Å²	112	64.7 Å²	64.7	55%	0.552	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.6	142	174.1	57.9	179.1	157.9	0	0	110.4	T189 Y190 V267	T189-M270 CarbonylContact O-C 3.59Å; T189-M270 VanDerWaalsContact O-CA 3.31Å; T189-M270 WeakPolarHBondContact O-CA 3.39Å; Y190-M270 HydrophobicContact CD1-CB 3.9Å; Y190-M270 HydrophobicContact CE1-CB 4.25Å; V267-M270 HydrophobicContact CG1-CB 4.21Å
271	E	97.3	Very high	96.5	Very high	55 Å²	55	63.2 Å²	63.2	26%	0.257	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	142.9	178.6	-169.2	-169.1	164.5	0	0	108.4	R188 T189 R273	R188-E271 CarbonylContact C-O 3.49Å; R188-E271 VanDerWaalsContact CA-O 3.3Å; R188-E271 WeakPolarHBondContact CA-O 3.32Å; T189-E271 PolarHBondContact N-O 3.47Å; T189-E271 PolarHBondContact O-N 3.31Å; E271-R273 IonicContact OE1-CZ 3.13Å; E271-R273 IonicContact OE1-NH1 2.76Å; E271-R273 PolarHBondContact OE1-NH1 2.89Å; E271-R273 IonicContact OE1-NH2 3.5Å; E271-R273 PolarHBondContact OE1-NH2 3.09Å; E271-R273 IonicContact OE2-NH1 2.8Å
272	S	97.9	Very high	96.4	Very high	47 Å²	47	57.2 Å²	57.2	33%	0.329	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	137.5	169.9	173.5	0	0	0	0	108.7	E186	E186-S272 VanDerWaalsContact CD-OG 3.31Å; E186-S272 WeakPolarHBondContact CG-OG 3.41Å; E186-S272 PolarHBondContact OE1-OG 3.49Å
273	R	98.2	Very high	96.1	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	125.7	-178.6	179.9	-173.1	-87.1	79.2	7	109.5	T114 Y116 E118 E186 L187 E271 M275	T114-R273 HydrophobicContact CG2-CG 3.42Å; T114-R273 VanDerWaalsContact CG2-CG 3.42Å; T114-R273 WeakPolarHBondContact OG1-CD 3.45Å; T114-R273 PolarHBondContact OG1-NE 3Å; Y116-R273 WeakPolarHBondContact O-CA 3.1Å; E118-R273 IonicContact OE2-NH2 3.62Å; E118-R273 PolarHBondContact OE2-NH2 3.25Å; E186-R273 CarbonylContact C-O 3.52Å; E186-R273 VanDerWaalsContact CA-O 3.25Å; E186-R273 WeakPolarHBondContact CA-O 3.3Å; L187-R273 PolarHBondContact N-O 3.16Å; L187-R273 PolarHBondContact O-N 3.41Å; E271-R273 IonicContact OE1-CZ 3.13Å; E271-R273 IonicContact OE1-NH1 2.76Å; E271-R273 PolarHBondContact OE1-NH1 2.89Å; E271-R273 IonicContact OE1-NH2 3.5Å; E271-R273 PolarHBondContact OE1-NH2 3.09Å; E271-R273 IonicContact OE2-NH1 2.8Å; R273-M275 HydrophobicContact CG-CG 3.71Å; R273-M275 HydrophobicContact CG-SD 4.33Å
274	I	98.6	Very high	95.3	Very high	11 Å²	11	55.3 Å²	55.3	6%	0.056	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	129.8	170.4	-53.7	-58.9	0	0	0	107.9	W115 Y116 I184 Y185 E186 L240	W115-I274 HydrophobicContact CE3-CG2 4.04Å; W115-I274 PolarHBondContact N-O 3.07Å; Y116-I274 HydrophobicContact CD2-CB 4.01Å; Y116-I274 HydrophobicContact CD2-CG1 4.23Å; Y116-I274 HydrophobicContact CD2-CG2 4.3Å; Y116-I274 PolarHBondContact N-O 2.69Å; Y116-I274 PolarHBondContact O-N 2.86Å; I184-I274 HydrophobicContact CB-CG2 4.49Å; I184-I274 HydrophobicContact CD1-CG2 4.08Å; Y185-I274 CarbonylContact O-C 3.53Å; Y185-I274 WeakPolarHBondContact O-CA 3.29Å; E186-I274 HydrophobicContact CB-CD1 3.99Å; E186-I274 HydrophobicContact CG-CD1 3.97Å; L240-I274 HydrophobicContact CD2-CD1 4.35Å; L240-I274 HydrophobicContact CD2-CG1 4.19Å; L240-I274 HydrophobicContact CD2-CG2 4.19Å
275	M	98.3	Very high	95.3	Very high	1 Å²	1	54.4 Å²	54.4	1%	0.005	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	141.8	-173.8	-46.9	-178.1	-56.7	0	0	110.4	W112 N113 V123 Y185 L187 L234 R273	W112-M275 HydrophobicContact CB-CB 3.63Å; W112-M275 HydrophobicContact CB-CE 4.36Å; W112-M275 HydrophobicContact CB-CG 4.48Å; W112-M275 HydrophobicContact CB-SD 4.3Å; W112-M275 HydrophobicContact CD2-CE 3.94Å; W112-M275 HydrophobicContact CE3-CE 4.2Å; W112-M275 HydrophobicContact CG-CB 4.02Å; W112-M275 HydrophobicContact CG-CE 4.01Å; N113-M275 CarbonylContact O-C 3.39Å; N113-M275 WeakPolarHBondContact O-CA 3.35Å; V123-M275 HydrophobicContact CB-SD 3.95Å; V123-M275 HydrophobicContact CG1-SD 4.22Å; V123-M275 HydrophobicContact CG2-SD 3.78Å; Y185-M275 PolarHBondContact N-O 2.8Å; Y185-M275 PolarHBondContact O-N 2.63Å; L187-M275 HydrophobicContact CB-CE 3.7Å; L187-M275 HydrophobicContact CB-SD 3.86Å; L187-M275 HydrophobicContact CD2-SD 4.3Å; L234-M275 HydrophobicContact CD1-CE 3.75Å; R273-M275 HydrophobicContact CG-CG 3.71Å; R273-M275 HydrophobicContact CG-SD 4.33Å
276	I	97.2	Very high	95.2	Very high	77 Å²	77	53.5 Å²	53.5	40%	0.395	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	124.9	175.6	-61.5	170.9	0	0	0	107.4	W112 N113 W115	W112-I276 CarbonylContact C-O 3.49Å; W112-I276 VanDerWaalsContact CA-O 3.27Å; W112-I276 WeakPolarHBondContact CA-O 3.36Å; W112-I276 WeakPolarHBondContact CB-O 3.42Å; N113-I276 PolarHBondContact N-O 3.38Å; N113-I276 PolarHBondContact O-N 3.05Å; W115-I276 HydrophobicContact CB-CD1 3.82Å; W115-I276 HydrophobicContact CB-CG1 3.96Å; W115-I276 HydrophobicContact CD2-CD1 3.79Å; W115-I276 HydrophobicContact CD2-CG1 4.39Å; W115-I276 HydrophobicContact CE3-CD1 4Å; W115-I276 HydrophobicContact CE3-CG1 4.24Å; W115-I276 HydrophobicContact CG-CD1 3.72Å; W115-I276 HydrophobicContact CG-CG1 4.31Å
277	P	96.5	Very high	95.1	Very high	13 Å²	13	55.6 Å²	55.6	8%	0.084	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	141.9	-179.4	31.9	-37.6	0	0	0	111.2	N111 W112 N183 Y185 Q284	N111-P277 WeakPolarHBondContact O-CA 3.49Å; W112-P277 HydrophobicContact CG-CB 4.42Å; N183-P277 VanDerWaalsContact O-CD 3.27Å; N183-P277 WeakPolarHBondContact O-CD 3.44Å; N183-P277 WeakPolarHBondContact O-CG 3.48Å; Y185-P277 HydrophobicContact CD2-CB 4.37Å; Y185-P277 HydrophobicContact CD2-CG 4.16Å; Y185-P277 HydrophobicContact CE2-CB 4.11Å; Y185-P277 HydrophobicContact CE2-CG 3.85Å; P277-Q284 HydrophobicContact CB-CG 3.7Å; P277-Q284 HydrophobicContact CG-CG 3.64Å; P277-Q284 PolarHBondContact O-NE2 3.46Å
278	L	95.3	Very high	94.9	Very high	20 Å²	20	57.2 Å²	57.2	11%	0.105	27%	0.272	C	S	.	.			trans	-73.7	161.1	168.2	-71	178.4	0	0	0	110.4	N88 N111 I280 S281 Q284	N88-L278 HydrophobicContact CB-CD1 4.3Å; N88-L278 HydrophobicContact CB-CD2 4.25Å; N111-L278 PolarHBondContact O-N 3.47Å; N111-L278 WeakPolarHBondContact OD1-CD1 3.44Å; L278-I280 HydrophobicContact CB-CG1 4.15Å; L278-I280 PolarHBondContact O-N 2.77Å; L278-I280 VanDerWaalsContact O-N 3.12Å; L278-S281 WeakPolarHBondContact O-CB 3.39Å; L278-S281 PolarHBondContact O-N 3.19Å; L278-Q284 PolarHBondContact O-NE2 3.42Å
279	K	92.3	Very high	94.7	Very high	186 Å²	186	49.9 Å²	49.9	81%	0.809	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57	-31.3	-178.8	-68	179.1	-178.3	173.5	0	113	S281	K279-S281 VanDerWaalsContact C-N 3.29Å; K279-S281 PolarHBondContact O-N 2.98Å
280	I	93.1	Very high	94.5	Very high	36 Å²	36	46.4 Å²	46.4	19%	0.185	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81	-3.2	179.1	62.6	156	0	0	0	114.3	E92 L95 P96 L108 N111 L278 P282	E92-I280 HydrophobicContact CB-CG2 3.95Å; E92-I280 HydrophobicContact CG-CD1 4.23Å; E92-I280 HydrophobicContact CG-CG1 4.04Å; E92-I280 HydrophobicContact CG-CG2 3.85Å; L95-I280 HydrophobicContact CB-CD1 4.1Å; L95-I280 HydrophobicContact CD1-CD1 4.41Å; P96-I280 HydrophobicContact CG-CB 3.95Å; P96-I280 HydrophobicContact CG-CD1 4.32Å; P96-I280 HydrophobicContact CG-CG2 3.69Å; L108-I280 HydrophobicContact CD2-CD1 4.36Å; N111-I280 WeakPolarHBondContact ND2-CD1 3.39Å; L278-I280 HydrophobicContact CB-CG1 4.15Å; L278-I280 PolarHBondContact O-N 2.77Å; L278-I280 VanDerWaalsContact O-N 3.12Å; I280-P282 WeakPolarHBondContact O-CD 3.1Å
281	S	94.6	Very high	94.3	Very high	4 Å²	4	41.7 Å²	41.7	3%	0.028	21%	0.211	C	C	.	.			trans	-72.7	116.8	-176	-173.9	0	0	0	0	110.4	G110 N111 L278 K279 L283 Q284	G110-S281 WeakPolarHBondContact CA-OG 3.48Å; N111-S281 PolarHBondContact N-OG 2.84Å; N111-S281 VanDerWaalsContact O-CB 3.27Å; N111-S281 WeakPolarHBondContact O-CB 3.36Å; N111-S281 PolarHBondContact O-OG 3.19Å; L278-S281 WeakPolarHBondContact O-CB 3.39Å; L278-S281 PolarHBondContact O-N 3.19Å; K279-S281 VanDerWaalsContact C-N 3.29Å; K279-S281 PolarHBondContact O-N 2.98Å; S281-L283 PolarHBondContact O-N 3.03Å; S281-Q284 PolarHBondContact O-N 3.13Å
282	P	92.5	Very high	94.1	Very high	38 Å²	38	40.7 Å²	40.7	25%	0.247	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-8.4	-174.4	-28.2	41.7	0	0	0	115.3	L108 P178 I280 Q284	L108-P282 HydrophobicContact CB-CG 4.29Å; L108-P282 HydrophobicContact CD2-CG 4.41Å; L108-P282 HydrophobicContact CG-CG 4.26Å; L108-P282 WeakPolarHBondContact O-CG 3.3Å; P178-P282 WeakPolarHBondContact CB-O 3.03Å; I280-P282 WeakPolarHBondContact O-CD 3.1Å; P282-Q284 VanDerWaalsContact C-N 3.26Å; P282-Q284 PolarHBondContact O-N 3.03Å
283	L	89.9	Confident	93.8	Very high	3 Å²	3	40.2 Å²	40.2	2%	0.016	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	5	175.5	-77.2	170.4	0	0	0	114.2	V109 W112 P176 Q177 R179 Y185 V218 L234 S281	V109-L283 HydrophobicContact CG1-CD1 3.95Å; V109-L283 HydrophobicContact CG1-CG 4.46Å; V109-L283 WeakPolarHBondContact O-CD1 3.14Å; V109-L283 WeakPolarHBondContact O-CG 3.44Å; W112-L283 HydrophobicContact CH2-CD1 3.81Å; W112-L283 HydrophobicContact CZ2-CB 4.48Å; W112-L283 HydrophobicContact CZ2-CD1 3.58Å; P176-L283 HydrophobicContact CB-CD1 4.45Å; P176-L283 HydrophobicContact CB-CD2 4.19Å; Q177-L283 VanDerWaalsContact C-CD2 3.45Å; Q177-L283 WeakPolarHBondContact O-CD2 3.28Å; R179-L283 PolarHBondContact N-O 3.42Å; Y185-L283 HydrophobicContact CE1-CB 4.13Å; Y185-L283 HydrophobicContact CE1-CD1 4.36Å; Y185-L283 PolarHBondContact OH-O 3.02Å; V218-L283 HydrophobicContact CG1-CD1 3.93Å; V218-L283 HydrophobicContact CG1-CD2 4.17Å; L234-L283 HydrophobicContact CD2-CD1 4.19Å; S281-L283 PolarHBondContact O-N 3.03Å
284	Q	79.3	Confident	93.4	Very high	93 Å²	93	43.8 Å²	43.8	44%	0.435	22%	0.215	S	C	.	.			trans	-99.2	0	175.2	-65.5	-156.3	63.6	0	0	114.2	R179 P277 L278 S281 P282	R179-Q284 CarbonylContact O-C 3.16Å; P277-Q284 HydrophobicContact CB-CG 3.7Å; P277-Q284 HydrophobicContact CG-CG 3.64Å; P277-Q284 PolarHBondContact O-NE2 3.46Å; L278-Q284 PolarHBondContact O-NE2 3.42Å; S281-Q284 PolarHBondContact O-N 3.13Å; P282-Q284 VanDerWaalsContact C-N 3.26Å; P282-Q284 PolarHBondContact O-N 3.03Å

Retrieved 284 of 284 residues in 677.5 ms (Link to these results)

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