A0A3Q0KBD0_SCHMA Loading...

E3 ubiquitin-protein ligase

E3 ubiquitin-protein ligase that mediates ubiquitination and subsequent proteasomal degradation of target proteins. E3 ubiquitin ligases accept ubiquitin from an E2 ubiquitin-conjugating enzyme in the form of a thioester and then directly transfers the ubiquitin to targeted substrates.

AlphaFold DB , UniProt , Accession A0A3Q0KBD0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 362 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	38.1	Very low	35.2	Very low	236 Å²	236	147 Å²	147	100%	1.163	85%	0.85	S	S	*	*				0	78.1	0	-59.8	178.3	179.2	0	0	105.7
2	S	35.4	Very low	34.9	Very low	116 Å²	116	148.3 Å²	148.3	81%	0.811	85%	0.851	S	S	*	*				54.3	110.7	90.1	-38.8	0	0	0	0	109.6
3	V	36.8	Very low	34.3	Very low	135 Å²	135	147 Å²	147	82%	0.818	85%	0.848	S	S	*	*				-165.1	149.1	69.7	172	0	0	0	0	110.5
4	P	39.5	Very low	34.2	Very low	113 Å²	113	147.3 Å²	147.3	73%	0.734	84%	0.842	S	S	*	*			trans	-110	168.1	178.3	40.2	-30.7	0	0	0	114.6
5	S	36	Very low	33.8	Very low	122 Å²	122	148.4 Å²	148.4	85%	0.853	84%	0.844	S	S	*	*			trans	171.9	144.6	157.2	-79.6	0	0	0	0	107.3
6	R	33.7	Very low	33.6	Very low	246 Å²	246	145.7 Å²	145.7	93%	0.928	84%	0.837	S	S	*	*			cis	-170.7	144.8	33.5	-164.6	167.6	160.8	-173.2	-5.6	108.4
7	A	31	Very low	33.3	Very low	93 Å²	93	148.2 Å²	148.2	77%	0.769	84%	0.839	S	S	*	*			trans	-76.7	154.2	176.2	0	0	0	0	0	113.4
8	T	38.1	Very low	33.1	Very low	142 Å²	142	149.9 Å²	149.9	87%	0.871	84%	0.839	S	S	*	*			trans	-130.8	127	160.6	40.6	0	0	0	0	108.9
9	N	30.2	Very low	33	Very low	156 Å²	156	154.6 Å²	154.6	83%	0.834	84%	0.843	S	S	*	*			trans	-108.1	134.8	-179.5	-158.3	14.5	0	0	0	107.8
10	S	38.4	Very low	32.9	Very low	112 Å²	112	153.2 Å²	153.2	78%	0.783	84%	0.839	S	S	*	*			trans	-120.1	113.8	-179.1	-48	0	0	0	0	109.2
11	N	30.1	Very low	32.8	Very low	146 Å²	146	152.1 Å²	152.1	78%	0.781	84%	0.841	S	S	*	*			trans	-68.3	137.4	172.9	-75.9	-22.4	0	0	0	110.9
12	N	31.9	Very low	32.5	Very low	163 Å²	163	149.6 Å²	149.6	87%	0.872	83%	0.826	S	S	*	*			trans	-131.4	115.9	156.6	-107.6	-5.5	0	0	0	108.8
13	T	26.5	Very low	32.2	Very low	131 Å²	131	154 Å²	154	80%	0.804	83%	0.825	S	S	*	*			trans	-101.8	116.7	176.3	-48.2	0	0	0	0	107.3
14	I	33.3	Very low	31.9	Very low	151 Å²	151	152.8 Å²	152.8	77%	0.774	82%	0.823	S	S	*	*			trans	-135.1	100	165.6	-59.8	-177.8	0	0	0	108.5
15	L	27.8	Very low	31.2	Very low	164 Å²	164	155.8 Å²	155.8	86%	0.859	83%	0.827	S	S	*	*			trans	14.1	106.6	150.7	-65	155.8	0	0	0	117.9
16	S	30.7	Very low	30.9	Very low	105 Å²	105	158.5 Å²	158.5	73%	0.734	83%	0.828	S	S	*	*			trans	-97.1	117.5	153.6	52.5	0	0	0	0	108.9	E18	S16-E18 PolarHBondContact O-N 3.46Å
17	E	28.4	Very low	30.7	Very low	189 Å²	189	151.5 Å²	151.5	88%	0.883	82%	0.823	S	S	*	*			trans	-70.5	105.2	169.7	-76.4	-179.9	127.1	0	0	109.7	R19	E17-R19 PolarHBondContact O-N 3.45Å
18	E	30.3	Very low	30.5	Very low	179 Å²	179	153 Å²	153	84%	0.836	83%	0.828	S	S	*	*			trans	-73.5	101.3	170.3	-70.9	178.8	129.6	0	0	109.9	S16 T20	S16-E18 PolarHBondContact O-N 3.46Å; E18-T20 PolarHBondContact O-N 3.41Å
19	R	31.5	Very low	30.2	Very low	239 Å²	239	151.3 Å²	151.3	90%	0.902	82%	0.821	S	S	*	*			trans	-83.3	100.5	162.5	-79.7	-175	177.5	-169.1	-0.1	109.4	E17 C21	E17-R19 PolarHBondContact O-N 3.45Å; R19-C21 PolarHBondContact O-N 3.45Å
20	T	30.1	Very low	30.1	Very low	126 Å²	126	151.7 Å²	151.7	77%	0.773	82%	0.824	S	S	*	*			trans	-71.2	114	172.1	16	0	0	0	0	110	E18	E18-T20 PolarHBondContact O-N 3.41Å
21	C	31	Very low	29.8	Very low	131 Å²	131	149.7 Å²	149.7	89%	0.885	81%	0.814	S	S	*	*			trans	-93.6	117.8	170.4	-149.8	0	0	0	0	109.4	R19 R23	R19-C21 PolarHBondContact O-N 3.45Å; C21-R23 PolarHBondContact O-N 2.97Å
22	H	32.6	Very low	29.8	Very low	183 Å²	183	149.9 Å²	149.9	85%	0.847	82%	0.82	S	S	*	*			trans	-71.5	123.3	-176.9	-90.3	-82.4	0	0	0	112.1	S24	H22-S24 PolarHBondContact O-N 2.9Å
23	R	28	Very low	29.9	Very low	209 Å²	209	144.6 Å²	144.6	79%	0.789	80%	0.804	S	S	*	*			trans	-67.1	114.1	177.3	-174.9	177.2	-172	175.9	3.8	112.1	C21	C21-R23 PolarHBondContact O-N 2.97Å
24	S	30.2	Very low	30.5	Very low	109 Å²	109	149.6 Å²	149.6	76%	0.762	81%	0.808	S	S	*	*			trans	-94.3	122.3	158.3	-69.1	0	0	0	0	109.2	H22 M26	H22-S24 PolarHBondContact O-N 2.9Å; S24-M26 PolarHBondContact O-N 3.1Å
25	Q	25.7	Very low	30.8	Very low	175 Å²	175	146.6 Å²	146.6	82%	0.818	80%	0.797	S	S	*	*			trans	-74	118.3	173.8	-66.9	176.9	15.1	0	0	109
26	M	29.4	Very low	31.8	Very low	180 Å²	180	144 Å²	144	89%	0.887	78%	0.782	S	S	*	*			trans	-122.6	133.2	167	-75.3	-88.3	176.7	0	0	108.2	S24	S24-M26 PolarHBondContact O-N 3.1Å
27	A	28.6	Very low	32.6	Very low	99 Å²	99	142 Å²	142	82%	0.818	77%	0.772	S	S	*	*			trans	-69.5	141.9	-174	0	0	0	0	0	112.1	S29	A27-S29 PolarHBondContact O-N 3.27Å
28	S	28.2	Very low	34.2	Very low	124 Å²	124	133.4 Å²	133.4	87%	0.867	73%	0.731	S	S	*	*			trans	-64.1	122.6	173.7	53.9	0	0	0	0	111.2
29	S	32.3	Very low	35.4	Very low	106 Å²	106	131.5 Å²	131.5	74%	0.741	73%	0.727	S	S	*	*			trans	-113.2	129.8	163.1	55	0	0	0	0	109.1	A27 A31	A27-S29 PolarHBondContact O-N 3.27Å; S29-A31 PolarHBondContact O-N 2.91Å
30	D	28	Very low	36.7	Very low	165 Å²	165	121.8 Å²	121.8	88%	0.882	69%	0.694	S	S	*	*			trans	-50.1	114.2	-175.5	-60.8	-56.3	0	0	0	113.6
31	A	31.3	Very low	38.4	Very low	69 Å²	69	118 Å²	118	57%	0.57	67%	0.669	S	S	*	*			trans	-101.9	105.3	169.6	0	0	0	0	0	109.9	S29 G33	S29-A31 PolarHBondContact O-N 2.91Å; A31-G33 PolarHBondContact O-N 3.06Å; A31-G33 VanDerWaalsContact O-N 3.09Å
32	V	30.5	Very low	39.4	Very low	151 Å²	151	116.4 Å²	116.4	92%	0.915	65%	0.652	S	S	*	*			trans	-78.5	86.4	173.1	179.8	0	0	0	0	108.7
33	G	34.5	Very low	40.5	Very low	52 Å²	52	111.1 Å²	111.1	54%	0.536	63%	0.627	S	S	.	*	P	Polyproline II helix	trans	-97.4	134.4	171.5	0	0	0	0	0	111.6	A31 T35	A31-G33 PolarHBondContact O-N 3.06Å; A31-G33 VanDerWaalsContact O-N 3.09Å; G33-T35 PolarHBondContact O-N 3.25Å
34	R	38.9	Very low	40.9	Very low	235 Å²	235	106.5 Å²	106.5	89%	0.887	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-65.3	117	176.3	-77.2	177.2	169.1	172.1	-3.4	110.7
35	T	39.8	Very low	41.2	Very low	88 Å²	88	110.5 Å²	110.5	54%	0.54	62%	0.624	S	S	.	*	P	Polyproline II helix	trans	-72.7	124.5	172.9	-42.9	0	0	0	0	110.7	G33 L242	G33-T35 PolarHBondContact O-N 3.25Å; T35-L242 HydrophobicContact CG2-CB 3.94Å; T35-L242 HydrophobicContact CG2-CD2 3.69Å; T35-L242 HydrophobicContact CG2-CG 4.36Å
36	M	47.9	Very low	41.5	Very low	111 Å²	111	106.3 Å²	106.3	55%	0.547	62%	0.62	S	S	.	*			trans	-114.4	128.9	164	-81	-164.8	165.7	0	0	109.3	T232	M36-T232 HydrophobicContact CB-CG2 4.29Å; M36-T232 HydrophobicContact SD-CG2 3.87Å
37	A	47.6	Very low	41.4	Very low	63 Å²	63	105.4 Å²	105.4	52%	0.521	62%	0.617	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-73.7	131.1	176.4	0	0	0	0	0	110.6	L242 T244	A37-L242 HydrophobicContact CB-CD2 4.2Å; A37-T244 HydrophobicContact CB-CG2 3.5Å; A37-T244 VanDerWaalsContact CB-CG2 3.5Å
38	L	61.7	Low	41.4	Very low	7 Å²	7	109.7 Å²	109.7	4%	0.037	62%	0.62	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.2	126.5	177	-75.9	173	0	0	0	111.7	T232 F241 L242 T244 W254 V255 M256	L38-T232 WeakPolarHBondContact CD2-OG1 3.33Å; L38-F241 HydrophobicContact CD1-CD2 3.72Å; L38-F241 HydrophobicContact CD1-CE2 3.36Å; L38-F241 HydrophobicContact CD1-CZ 4.44Å; L38-L242 PolarHBondContact N-O 3.16Å; L38-T244 PolarHBondContact O-OG1 3.18Å; L38-W254 VanDerWaalsContact O-CD1 3.28Å; L38-V255 VanDerWaalsContact CD1-O 3.31Å; L38-V255 WeakPolarHBondContact CD1-O 3.46Å; L38-M256 HydrophobicContact CD1-CB 3.44Å; L38-M256 VanDerWaalsContact CD1-CB 3.44Å; L38-M256 HydrophobicContact CD1-CG 3.68Å; L38-M256 HydrophobicContact CD1-SD 3.76Å
39	L	56.1	Low	41.5	Very low	140 Å²	140	112.8 Å²	112.8	73%	0.733	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-76.3	145.3	173.6	-72.7	168.6	0	0	0	110.9
40	P	58.2	Low	41.1	Very low	35 Å²	35	111.1 Å²	111.1	23%	0.227	62%	0.62	C	S	.	*	P	Polyproline II helix	trans	-67.4	141.9	179.9	27.8	-37.2	0	0	0	113.2	L248 V252 W254	P40-L248 HydrophobicContact CB-CD1 4.19Å; P40-L248 HydrophobicContact CG-CD1 3.52Å; P40-V252 HydrophobicContact CB-CG1 3.18Å; P40-V252 HydrophobicContact CG-CG1 4.5Å; P40-W254 HydrophobicContact CB-CZ2 4.28Å
41	I	66.5	Low	41.1	Very low	46 Å²	46	110.6 Å²	110.6	24%	0.236	62%	0.615	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-91.2	109.8	164.6	-54.5	176.1	0	0	0	107.2	D253 V255	I41-D253 HydrophobicContact CB-CB 4.48Å; I41-D253 PolarHBondContact N-O 3.49Å; I41-D253 PolarHBondContact O-N 3.27Å; I41-V255 HydrophobicContact CD1-CG2 4.09Å
42	N	51.9	Low	40.8	Very low	98 Å²	98	117.1 Å²	117.1	52%	0.524	63%	0.631	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.1	128.6	-178.6	-167.7	-13.2	0	0	0	111.1	N44	N42-N44 VanDerWaalsContact C-N 3.31Å; N42-N44 PolarHBondContact O-N 3.04Å; N42-N44 WeakPolarHBondContact OD1-CB 3.37Å; N42-N44 PolarHBondContact OD1-N 3.38Å
43	H	56	Low	40.7	Very low	72 Å²	72	117.2 Å²	117.2	33%	0.333	63%	0.625	S	S	.	*			trans	-78.5	-5.9	-179	-71.8	91.9	0	0	0	115	H45 G208 A251 D253	H43-H45 PolarHBondContact O-N 3.43Å; H43-G208 WeakPolarHBondContact NE2-CA 3.46Å; H43-A251 PolarHBondContact ND1-O 3.15Å; H43-D253 IonicContact CE1-OD1 2.93Å; H43-D253 IonicContact CE1-OD2 2.72Å; H43-D253 PolarHBondContact CE1-OD2 2.79Å; H43-D253 IonicContact NE2-OD2 3.57Å; H43-D253 PolarHBondContact NE2-OD2 2.94Å
44	N	36.7	Very low	40.6	Very low	111 Å²	111	122.7 Å²	122.7	59%	0.594	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	38	-167	-91.6	-15.5	0	0	0	117	N42	N42-N44 VanDerWaalsContact C-N 3.31Å; N42-N44 PolarHBondContact O-N 3.04Å; N42-N44 WeakPolarHBondContact OD1-CB 3.37Å; N42-N44 PolarHBondContact OD1-N 3.38Å
45	H	36.2	Very low	40.3	Very low	194 Å²	194	115.7 Å²	115.7	90%	0.898	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119	14.5	167.8	-109.2	-72.7	0	0	0	115.3	H43	H43-H45 PolarHBondContact O-N 3.43Å
46	A	30.6	Very low	39.7	Very low	87 Å²	87	120.7 Å²	120.7	72%	0.719	64%	0.641	S	S	*	*			trans	-134.3	54.5	179	0	0	0	0	0	114.2
47	L	27.3	Very low	39.1	Very low	160 Å²	160	122.8 Å²	122.8	84%	0.838	65%	0.653	S	S	*	*			trans	-114.6	80.8	159.7	-74.8	173.4	0	0	0	109.2
48	H	30	Very low	38.1	Very low	189 Å²	189	127.4 Å²	127.4	88%	0.875	67%	0.669	S	S	*	*			trans	-128.2	123.6	154.7	-117	-82.5	0	0	0	108.3
49	H	28.9	Very low	36.7	Very low	190 Å²	190	131.7 Å²	131.7	88%	0.88	69%	0.69	S	S	*	*			trans	-45.8	137.3	177.1	-71.9	-91.8	0	0	0	113.9
50	G	25.4	Very low	35.6	Very low	70 Å²	70	130.6 Å²	130.6	72%	0.722	69%	0.691	S	S	*	*			trans	91.2	127.5	138.5	0	0	0	0	0	118
51	I	28.2	Very low	34.2	Very low	155 Å²	155	138.4 Å²	138.4	80%	0.795	72%	0.724	S	S	*	*			trans	84.3	98.4	162.4	-45.7	177.5	0	0	0	115.6	L53	I51-L53 HydrophobicContact CG2-CG 4.27Å; I51-L53 PolarHBondContact O-N 2.77Å; I51-L53 VanDerWaalsContact O-N 3.09Å
52	K	24.4	Very low	32.7	Very low	205 Å²	205	147.5 Å²	147.5	89%	0.891	76%	0.755	S	S	*	*			trans	-50.7	105.5	159	-114.3	176.3	175.8	177.1	0	109.8
53	L	27.5	Very low	31.9	Very low	153 Å²	153	152.1 Å²	152.1	80%	0.801	77%	0.774	S	S	*	*			trans	-120.9	109.3	158.6	-78	165.5	0	0	0	107.6	I51	I51-L53 HydrophobicContact CG2-CG 4.27Å; I51-L53 PolarHBondContact O-N 2.77Å; I51-L53 VanDerWaalsContact O-N 3.09Å
54	M	32.8	Very low	30.8	Very low	168 Å²	168	155.6 Å²	155.6	83%	0.828	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-67.5	148.3	173.2	-72.2	179.4	131.2	0	0	110.1
55	P	32.2	Very low	30.6	Very low	88 Å²	88	153.7 Å²	153.7	57%	0.571	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-71.5	144.4	-176	30.3	-32.4	0	0	0	111.5	I57 K212	P55-I57 PolarHBondContact O-N 3.06Å; P55-K212 HydrophobicContact CG-CD 4.47Å
56	H	27.8	Very low	30.5	Very low	192 Å²	192	149.3 Å²	149.3	89%	0.889	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-56.4	120	175.3	-80.9	-93.4	0	0	0	111.4	N58	H56-N58 PolarHBondContact O-N 3.19Å
57	I	34.6	Very low	30.6	Very low	155 Å²	155	151.6 Å²	151.6	80%	0.795	81%	0.809	S	S	*	*			trans	-79.2	113.5	163.4	-50.8	169.5	0	0	0	105.9	P55 M59	P55-I57 PolarHBondContact O-N 3.06Å; I57-M59 PolarHBondContact O-N 3.24Å
58	N	27.9	Very low	31	Very low	161 Å²	161	150.4 Å²	150.4	86%	0.861	81%	0.808	S	S	*	*			trans	-79.8	103.6	174.2	-149	16.2	0	0	0	107.1	H56	H56-N58 PolarHBondContact O-N 3.19Å
59	M	31.9	Very low	31.1	Very low	97 Å²	97	147 Å²	147	48%	0.478	80%	0.803	S	S	.	*	P	Polyproline II helix	trans	-88	135.7	173	-85	-162	99.4	0	0	110.5	I57 V119 M121	I57-M59 PolarHBondContact O-N 3.24Å; M59-V119 VanDerWaalsContact SD-O 3.41Å; M59-M121 HydrophobicContact CE-CE 3.93Å; M59-M121 HydrophobicContact CE-CG 3.65Å
60	P	33.6	Very low	31.4	Very low	116 Å²	116	146.1 Å²	146.1	75%	0.753	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-74.1	132.1	169.3	30.3	-30	0	0	0	110.3	R62	P60-R62 PolarHBondContact O-N 3.21Å
61	H	28.9	Very low	31.7	Very low	200 Å²	200	148.8 Å²	148.8	93%	0.926	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-59.9	128.1	169.8	-91.9	-92.4	0	0	0	110.5
62	R	34.4	Very low	31.9	Very low	237 Å²	237	148.3 Å²	148.3	89%	0.894	81%	0.81	S	S	*	*			trans	-126.9	123.2	160	-166.6	172	172.2	174.9	-3.5	109.1	P60	P60-R62 PolarHBondContact O-N 3.21Å
63	E	34.2	Very low	32.1	Very low	194 Å²	194	145.9 Å²	145.9	91%	0.907	81%	0.807	S	S	*	*			trans	-64.2	133.6	-176.8	-69.5	177.3	122.3	0	0	112.1
64	V	33.6	Very low	32.6	Very low	146 Å²	146	144.3 Å²	144.3	89%	0.885	81%	0.809	S	S	*	*			trans	-90.5	106.9	171	178	0	0	0	0	107.9
65	G	32.1	Very low	32.5	Very low	70 Å²	70	139.6 Å²	139.6	72%	0.722	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-83	127.6	169.2	0	0	0	0	0	110.9
66	A	33.9	Very low	32.7	Very low	102 Å²	102	142.5 Å²	142.5	84%	0.843	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-67.3	137.6	-178.7	0	0	0	0	0	113.2
67	T	33	Very low	33	Very low	136 Å²	136	138.2 Å²	138.2	83%	0.834	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-72.9	138.3	169	46.2	0	0	0	0	112.1
68	T	35.2	Very low	33.3	Very low	135 Å²	135	136.8 Å²	136.8	83%	0.828	82%	0.821	S	S	*	*			trans	-127	137.9	153.3	38.6	0	0	0	0	108.5
69	P	32.5	Very low	33.4	Very low	116 Å²	116	135.5 Å²	135.5	75%	0.753	82%	0.819	S	S	*	*			trans	-98.2	144.8	-177.6	35.7	-29	0	0	0	111.5
70	L	34.6	Very low	33.6	Very low	173 Å²	173	136.5 Å²	136.5	91%	0.906	84%	0.835	S	S	*	*			trans	-134.7	122.3	158.5	-115	103.4	0	0	0	110.5
71	V	31.8	Very low	33.9	Very low	126 Å²	126	135.4 Å²	135.4	76%	0.764	83%	0.829	S	S	*	*			trans	-82.1	137	172.1	-179.5	0	0	0	0	108.2
72	T	33.7	Very low	34.6	Very low	144 Å²	144	133.6 Å²	133.6	88%	0.883	82%	0.824	S	S	*	*			trans	-169	136.2	136.9	15.8	0	0	0	0	110.9
73	N	28.1	Very low	34.9	Very low	154 Å²	154	128.3 Å²	128.3	82%	0.824	82%	0.823	S	S	*	*			trans	-106	139.9	-167.1	-160.1	21.9	0	0	0	109.3
74	S	37.2	Very low	35.7	Very low	121 Å²	121	126.6 Å²	126.6	85%	0.846	82%	0.819	S	S	*	*			trans	177.2	120.9	157.9	21.8	0	0	0	0	106.7
75	G	31.5	Very low	36.3	Very low	69 Å²	69	125.4 Å²	125.4	71%	0.711	81%	0.814	S	S	*	*			cis	113.3	83.4	24.7	0	0	0	0	0	108.5
76	T	36.9	Very low	36.7	Very low	149 Å²	149	125.4 Å²	125.4	91%	0.914	81%	0.814	S	S	*	*			trans	-155.3	117.2	157.9	42.2	0	0	0	0	109.7
77	A	33.4	Very low	37.3	Very low	101 Å²	101	126 Å²	126	84%	0.835	81%	0.812	S	S	*	*			trans	-127.3	128.6	163.1	0	0	0	0	0	107.1
78	S	40.4	Very low	37.9	Very low	126 Å²	126	127.7 Å²	127.7	88%	0.881	81%	0.813	S	S	*	*			trans	-99.2	137.7	174.3	-73.3	0	0	0	0	110.5
79	T	31.3	Very low	38.4	Very low	133 Å²	133	126.7 Å²	126.7	82%	0.816	81%	0.811	S	S	*	*			trans	-75.2	152.2	-172.9	-17.5	0	0	0	0	113.1
80	C	34.6	Very low	39	Very low	119 Å²	119	126.6 Å²	126.6	80%	0.804	81%	0.813	S	S	*	*			trans	168	147.7	134.9	-85.8	0	0	0	0	108.8
81	S	40.5	Very low	39.4	Very low	92 Å²	92	123 Å²	123	64%	0.643	81%	0.808	S	S	*	*			cis	-177	133.8	-15.4	-85.9	0	0	0	0	106.8
82	M	42.9	Very low	39.9	Very low	163 Å²	163	123 Å²	123	80%	0.803	81%	0.814	S	S	*	*			trans	55	120.2	143.8	-50.6	-58.2	174.9	0	0	121.8
83	S	41.5	Very low	40.1	Very low	125 Å²	125	123.9 Å²	123.9	87%	0.874	81%	0.813	S	S	*	*				176.3	155.1	100.2	32.4	0	0	0	0	112.6
84	L	50.2	Low	40.7	Very low	159 Å²	159	122.5 Å²	122.5	83%	0.832	81%	0.81	S	S	*	*			trans	-118.4	-175.4	-150.2	-114.1	122.3	0	0	0	111.2
85	P	47.1	Very low	40.7	Very low	121 Å²	121	123.1 Å²	123.1	79%	0.786	81%	0.809	S	S	*	*				-123.7	-171	-126.1	38.5	-17.3	0	0	0	114.7
86	G	40.4	Very low	41	Very low	70 Å²	70	125.2 Å²	125.2	72%	0.722	81%	0.812	S	S	*	*			trans	-163.8	113.7	170.9	0	0	0	0	0	116
87	S	46.2	Very low	40.8	Very low	113 Å²	113	125.8 Å²	125.8	79%	0.79	81%	0.809	S	S	*	*			trans	52.4	114.1	143.9	-58.1	0	0	0	0	122.9
88	M	46.3	Very low	41.2	Very low	173 Å²	173	128.6 Å²	128.6	85%	0.852	81%	0.808	S	S	*	*				75.8	111.4	88	-48.5	-142.7	91	0	0	115.5
89	S	46.2	Very low	41.2	Very low	114 Å²	114	129.9 Å²	129.9	80%	0.797	80%	0.804	S	S	*	*				154	116.9	121	-63.9	0	0	0	0	114.7
90	S	45.3	Very low	41.5	Very low	113 Å²	113	129.6 Å²	129.6	79%	0.79	81%	0.805	S	S	*	*			trans	47.8	116.9	138.7	61.7	0	0	0	0	123.8
91	A	41.6	Very low	41.5	Very low	98 Å²	98	131.4 Å²	131.4	81%	0.81	80%	0.801	S	S	*	*				63.1	110.8	127.4	0	0	0	0	0	120.9
92	S	42.3	Very low	41.1	Very low	125 Å²	125	134.8 Å²	134.8	87%	0.874	81%	0.812	S	S	*	*				-174.7	127	121.7	-105	0	0	0	0	110.5	T94	S92-T94 PolarHBondContact O-N 2.87Å
93	D	38.8	Very low	40.8	Very low	163 Å²	163	131.7 Å²	131.7	87%	0.872	80%	0.803	S	S	*	*			trans	-64.2	119	169.9	-75.7	-46.4	0	0	0	110.3
94	T	41.1	Very low	40.4	Very low	125 Å²	125	131.5 Å²	131.5	77%	0.767	80%	0.801	S	S	*	*			trans	-172.7	115.6	148.7	-67.7	0	0	0	0	109.1	S92	S92-T94 PolarHBondContact O-N 2.87Å
95	V	36.9	Very low	39.7	Very low	135 Å²	135	130 Å²	130	82%	0.818	79%	0.794	S	S	*	*			trans	29.3	110.8	151.6	-169.8	0	0	0	0	117.4
96	C	36.9	Very low	39.2	Very low	113 Å²	113	130.3 Å²	130.3	76%	0.764	80%	0.799	S	S	*	*			trans	-136.6	121.9	164.2	-76.7	0	0	0	0	111.5
97	N	34	Very low	39.3	Very low	160 Å²	160	131.1 Å²	131.1	86%	0.856	79%	0.794	S	S	*	*			trans	-49.2	132.6	156.6	-73.8	-27.6	0	0	0	110
98	I	40.6	Very low	39.4	Very low	161 Å²	161	131 Å²	131	83%	0.826	79%	0.793	S	S	*	*			trans	-124.9	119.1	166	-58.8	-179.2	0	0	0	108.2
99	L	40.6	Very low	40.1	Very low	152 Å²	152	128.7 Å²	128.7	80%	0.796	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-54.3	154.4	171.3	-72.1	122.1	0	0	0	112	H101	L99-H101 PolarHBondContact O-N 3Å
100	P	37.7	Very low	41.9	Very low	127 Å²	127	127.6 Å²	127.6	83%	0.825	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-74.4	124	-174.8	30.6	-31.6	0	0	0	110.7
101	H	34.1	Very low	44.1	Very low	157 Å²	157	126.5 Å²	126.5	73%	0.727	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-81.6	118	167.5	-174.5	-73.5	0	0	0	108.8	L99 T103	L99-H101 PolarHBondContact O-N 3Å; H101-T103 WeakPolarHBondContact ND1-CG2 3.44Å; H101-T103 PolarHBondContact O-N 2.83Å
102	N	32.9	Very low	46.6	Very low	163 Å²	163	121.9 Å²	121.9	87%	0.872	71%	0.714	S	S	*	*			trans	-57	102.4	165.3	-99.3	-13.9	0	0	0	109.9
103	T	36.2	Very low	49	Very low	99 Å²	99	118.5 Å²	118.5	61%	0.607	69%	0.691	S	S	*	*			trans	-118.9	110.7	152	46.5	0	0	0	0	107.5	H101 D105	H101-T103 WeakPolarHBondContact ND1-CG2 3.44Å; H101-T103 PolarHBondContact O-N 2.83Å; T103-D105 VanDerWaalsContact C-N 3.33Å; T103-D105 PolarHBondContact O-N 2.97Å
104	S	33.3	Very low	51.7	Low	121 Å²	121	115.5 Å²	115.5	85%	0.846	67%	0.674	S	S	*	*			trans	-58.6	92.7	166.3	49.6	0	0	0	0	109.4	S106	S104-S106 PolarHBondContact O-N 3.18Å
105	D	35.8	Very low	54.3	Low	127 Å²	127	109.7 Å²	109.7	68%	0.679	64%	0.638	S	S	*	*			trans	-90.8	98.6	176.7	-128.2	4.3	0	0	0	109	T103 S107	T103-D105 VanDerWaalsContact C-N 3.33Å; T103-D105 PolarHBondContact O-N 2.97Å; D105-S107 PolarHBondContact O-N 2.8Å
106	S	35.4	Very low	57.1	Low	127 Å²	127	107.8 Å²	107.8	89%	0.888	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	44	177.5	39.7	0	0	0	0	113.5	S104	S104-S106 PolarHBondContact O-N 3.18Å
107	S	43.3	Very low	60	Low	87 Å²	87	102.4 Å²	102.4	61%	0.608	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-157.1	25.1	-179.3	59.9	0	0	0	0	116	D105 I109	D105-S107 PolarHBondContact O-N 2.8Å; S107-I109 PolarHBondContact O-N 3.09Å; S107-I109 VanDerWaalsContact O-N 3.09Å
108	S	47.3	Very low	62.9	Low	110 Å²	110	97.1 Å²	97.1	77%	0.769	56%	0.559	S	S	*	*			trans	-73.2	99.2	163.3	63.4	0	0	0	0	108.5	D110	S108-D110 PolarHBondContact O-N 3.18Å; S108-D110 VanDerWaalsContact O-N 3.08Å
109	I	61.5	Low	65.6	Low	125 Å²	125	91.6 Å²	91.6	64%	0.641	53%	0.532	S	S	*	.			trans	-55.3	118.3	166.7	-64.7	171.7	0	0	0	106.3	S107 L111	S107-I109 PolarHBondContact O-N 3.09Å; S107-I109 VanDerWaalsContact O-N 3.09Å; I109-L111 HydrophobicContact CG2-CD2 4.15Å; I109-L111 PolarHBondContact O-N 2.8Å
110	D	85.2	Confident	68.2	Low	91 Å²	91	87.1 Å²	87.1	49%	0.487	51%	0.513	S	S	.	.			trans	-65.3	91.9	169.6	175.5	16	0	0	0	107.8	S108 A112 S113	S108-D110 PolarHBondContact O-N 3.18Å; S108-D110 VanDerWaalsContact O-N 3.08Å; D110-A112 PolarHBondContact O-N 2.87Å; D110-A112 VanDerWaalsContact O-N 3.15Å; D110-A112 WeakPolarHBondContact OD1-CB 3.29Å; D110-A112 PolarHBondContact OD1-N 2.79Å; D110-A112 VanDerWaalsContact OD1-N 3.13Å; D110-S113 WeakPolarHBondContact O-CB 3.41Å; D110-S113 PolarHBondContact O-N 2.83Å; D110-S113 PolarHBondContact O-OG 2.9Å
111	L	91.1	Very high	70.8	Confident	90 Å²	90	85.8 Å²	85.8	47%	0.471	50%	0.497	S	S	.	.	G	3₁₀ helix	trans	-59.3	-25.7	-177.6	-68.2	177.3	0	0	0	111.7	I109 S113 L114 F115 V170	I109-L111 HydrophobicContact CG2-CD2 4.15Å; I109-L111 PolarHBondContact O-N 2.8Å; L111-S113 VanDerWaalsContact C-N 3.3Å; L111-S113 PolarHBondContact O-N 2.88Å; L111-L114 HydrophobicContact CD2-CD1 4.02Å; L111-L114 WeakPolarHBondContact O-CB 3.34Å; L111-L114 PolarHBondContact O-N 3.03Å; L111-F115 VanDerWaalsContact O-CD2 3.24Å; L111-F115 WeakPolarHBondContact O-CD2 3.46Å; L111-F115 WeakPolarHBondContact O-CE2 3.35Å; L111-V170 HydrophobicContact CB-CG1 4.26Å; L111-V170 HydrophobicContact CB-CG2 3.91Å; L111-V170 HydrophobicContact CD1-CG2 4.27Å
112	A	93.7	Very high	73.6	Confident	1 Å²	1	80.9 Å²	80.9	1%	0.008	48%	0.476	C	S	.	.	G	3₁₀ helix	trans	-64.8	-35.9	177.6	0	0	0	0	0	111.3	D110 L114 F115 Y123 V170 F172	D110-A112 PolarHBondContact O-N 2.87Å; D110-A112 VanDerWaalsContact O-N 3.15Å; D110-A112 WeakPolarHBondContact OD1-CB 3.29Å; D110-A112 PolarHBondContact OD1-N 2.79Å; D110-A112 VanDerWaalsContact OD1-N 3.13Å; A112-L114 PolarHBondContact O-N 3.11Å; A112-L114 VanDerWaalsContact O-N 3.16Å; A112-F115 WeakPolarHBondContact O-CB 3.31Å; A112-F115 PolarHBondContact O-N 2.91Å; A112-Y123 HydrophobicContact CB-CD1 4.43Å; A112-Y123 HydrophobicContact CB-CE1 3.77Å; A112-Y123 VanDerWaalsContact O-CD1 3.24Å; A112-Y123 WeakPolarHBondContact O-CD1 3.37Å; A112-Y123 WeakPolarHBondContact O-CE1 3.45Å; A112-V170 HydrophobicContact CB-CG1 4.14Å; A112-F172 HydrophobicContact CB-CD1 4.04Å; A112-F172 HydrophobicContact CB-CE1 4.39Å
113	S	93.5	Very high	76.6	Confident	55 Å²	55	75.3 Å²	75.3	39%	0.385	44%	0.443	S	S	.	.	G	3₁₀ helix	trans	-58.2	-28.3	177.8	71.7	0	0	0	0	113.6	D110 L111 F115 E116	D110-S113 WeakPolarHBondContact O-CB 3.41Å; D110-S113 PolarHBondContact O-N 2.83Å; D110-S113 PolarHBondContact O-OG 2.9Å; L111-S113 VanDerWaalsContact C-N 3.3Å; L111-S113 PolarHBondContact O-N 2.88Å; S113-F115 PolarHBondContact O-N 2.95Å; S113-F115 VanDerWaalsContact O-N 3.13Å; S113-E116 WeakPolarHBondContact O-CB 3.25Å; S113-E116 PolarHBondContact O-N 3.21Å; S113-E116 VanDerWaalsContact O-N 3.16Å
114	L	94.5	Very high	79.4	Confident	99 Å²	99	70.6 Å²	70.6	52%	0.518	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-66.2	-13.9	176.1	-60	176.7	0	0	0	113.3	L111 A112 I136 M163	L111-L114 HydrophobicContact CD2-CD1 4.02Å; L111-L114 WeakPolarHBondContact O-CB 3.34Å; L111-L114 PolarHBondContact O-N 3.03Å; A112-L114 PolarHBondContact O-N 3.11Å; A112-L114 VanDerWaalsContact O-N 3.16Å; L114-I136 VanDerWaalsContact O-CD1 3.26Å; L114-I136 WeakPolarHBondContact O-CD1 3.37Å; L114-M163 HydrophobicContact CB-CE 4.34Å; L114-M163 WeakPolarHBondContact O-CE 3.42Å
115	F	96.5	Very high	82.4	Confident	4 Å²	4	66.8 Å²	66.8	2%	0.018	38%	0.384	C	S	.	.	G	3₁₀ helix	trans	-99.1	-0.1	179.1	-65.5	-97.2	0	0	0	112.7	L111 A112 S113 C117 Y123 A124 I128 M163 L166 A167 V170 F172	L111-F115 VanDerWaalsContact O-CD2 3.24Å; L111-F115 WeakPolarHBondContact O-CD2 3.46Å; L111-F115 WeakPolarHBondContact O-CE2 3.35Å; A112-F115 WeakPolarHBondContact O-CB 3.31Å; A112-F115 PolarHBondContact O-N 2.91Å; S113-F115 PolarHBondContact O-N 2.95Å; S113-F115 VanDerWaalsContact O-N 3.13Å; F115-C117 PolarHBondContact O-N 3.43Å; F115-Y123 HydrophobicContact CB-CD1 4.2Å; F115-Y123 CarbonylContact O-C 3.38Å; F115-A124 WeakPolarHBondContact O-CB 3.33Å; F115-A124 PolarHBondContact O-N 3.05Å; F115-I128 HydrophobicContact CD1-CD1 3.76Å; F115-I128 HydrophobicContact CE1-CD1 3.85Å; F115-M163 HydrophobicContact CD1-CE 3.71Å; F115-M163 HydrophobicContact CD2-CE 4.1Å; F115-M163 HydrophobicContact CE1-CB 4.24Å; F115-M163 HydrophobicContact CE1-CE 3.51Å; F115-M163 VanDerWaalsContact CE1-O 3.28Å; F115-M163 WeakPolarHBondContact CE1-O 3.28Å; F115-M163 HydrophobicContact CE1-SD 4.46Å; F115-M163 HydrophobicContact CE2-CE 3.93Å; F115-M163 HydrophobicContact CG-CE 3.99Å; F115-M163 HydrophobicContact CZ-CE 3.64Å; F115-M163 HydrophobicContact CZ-SD 4.42Å; F115-L166 HydrophobicContact CZ-CB 3.86Å; F115-A167 HydrophobicContact CD1-CB 4.3Å; F115-A167 HydrophobicContact CE1-CB 3.61Å; F115-A167 HydrophobicContact CZ-CB 4.12Å; F115-V170 HydrophobicContact CE2-CG2 4.1Å; F115-F172 HydrophobicContact CB-CE1 3.75Å; F115-F172 HydrophobicContact CB-CZ 4.44Å; F115-F172 HydrophobicContact CD1-CE1 4.21Å; F115-F172 HydrophobicContact CD1-CZ 4.06Å; F115-F172 AromaticContact CD2-CE1 3.73Å; F115-F172 HydrophobicContact CD2-CE1 3.73Å; F115-F172 AromaticContact CD2-CZ 3.98Å; F115-F172 HydrophobicContact CD2-CZ 3.98Å; F115-F172 HydrophobicContact CE1-CZ 4.33Å; F115-F172 HydrophobicContact CE2-CE1 4.42Å; F115-F172 HydrophobicContact CE2-CZ 4.26Å; F115-F172 AromaticContact CG-CE1 3.62Å; F115-F172 HydrophobicContact CG-CE1 3.62Å; F115-F172 AromaticContact CG-CZ 3.89Å; F115-F172 HydrophobicContact CG-CZ 3.89Å; F115-F172 HydrophobicContact CZ-CZ 4.43Å
116	E	95.9	Very high	85.2	Confident	94 Å²	94	62.2 Å²	62.2	44%	0.439	36%	0.362	S	S	.	.	B	Isolated β-bridge	trans	-62.2	128	-176.2	-168.5	178.9	163.9	0	0	112	S113	S113-E116 WeakPolarHBondContact O-CB 3.25Å; S113-E116 PolarHBondContact O-N 3.21Å; S113-E116 VanDerWaalsContact O-N 3.16Å
117	C	96.7	Very high	88.1	Confident	0 Å²	0	59 Å²	59	0%	0	34%	0.337	C	S	.	.			trans	-83.6	120.8	173.7	-179.6	0	0	0	0	109.7	F115 V119 M121 D122 A124 C138	F115-C117 PolarHBondContact O-N 3.43Å; C117-V119 PolarHBondContact O-N 3.29Å; C117-M121 WeakPolarHBondContact O-CA 3.48Å; C117-M121 PolarHBondContact O-N 2.91Å; C117-D122 VanDerWaalsContact CB-O 3.26Å; C117-D122 WeakPolarHBondContact CB-O 3.27Å; C117-D122 PolarHBondContact N-O 3.24Å; C117-A124 HydrophobicContact CB-CB 4.26Å; C117-C138 HydrophobicContact CB-CB 4.26Å; C117-C138 PolarHBondContact SG-N 3.38Å; C117-C138 VanDerWaalsContact SG-N 3.39Å
118	P	96	Very high	90.7	Very high	50 Å²	50	54.8 Å²	54.8	33%	0.325	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	1.1	-176	29.3	-38	0	0	0	114.6	I136 V137 P149	P118-I136 WeakPolarHBondContact CD-O 3.14Å; P118-V137 HydrophobicContact CG-CG1 4.3Å; P118-P149 HydrophobicContact CG-CG 3.85Å
119	V	96.3	Very high	93.1	Very high	44 Å²	44	50.3 Å²	50.3	27%	0.267	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	-46.5	-176	-177	0	0	0	0	112.2	M59 C117 V137 C141 L145 P149	M59-V119 VanDerWaalsContact SD-O 3.41Å; C117-V119 PolarHBondContact O-N 3.29Å; V119-V137 HydrophobicContact CG2-CG1 4.43Å; V119-C141 HydrophobicContact CB-CB 3.97Å; V119-C141 HydrophobicContact CG1-CB 4Å; V119-C141 HydrophobicContact CG2-CB 4.49Å; V119-L145 HydrophobicContact CG2-CD1 3.83Å; V119-L145 HydrophobicContact CG2-CD2 4.42Å; V119-P149 HydrophobicContact CG2-CB 4.05Å; V119-P149 HydrophobicContact CG2-CG 3.74Å
120	C	94.7	Very high	94.8	Very high	58 Å²	58	46.4 Å²	46.4	39%	0.392	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-8	177.6	61.6	0	0	0	0	113.2	D122	C120-D122 PolarHBondContact O-N 3.02Å
121	M	93	Very high	95.3	Very high	100 Å²	100	42.1 Å²	42.1	49%	0.493	23%	0.231	S	C	.	.	S	Bend	trans	55.2	28.5	-174.2	-49.6	-57	-173.7	0	0	113	M59 C117	M59-M121 HydrophobicContact CE-CE 3.93Å; M59-M121 HydrophobicContact CE-CG 3.65Å; C117-M121 WeakPolarHBondContact O-CA 3.48Å; C117-M121 PolarHBondContact O-N 2.91Å
122	D	93	Very high	95.5	Very high	53 Å²	53	43.8 Å²	43.8	28%	0.283	24%	0.237	S	C	.	.	S	Bend	trans	-117.9	166.3	172.4	-164.7	-1.4	0	0	0	107.9	C117 C120 A124	C117-D122 VanDerWaalsContact CB-O 3.26Å; C117-D122 WeakPolarHBondContact CB-O 3.27Å; C117-D122 PolarHBondContact N-O 3.24Å; C120-D122 PolarHBondContact O-N 3.02Å; D122-A124 PolarHBondContact O-N 2.63Å
123	Y	95.1	Very high	95.6	Very high	47 Å²	47	47.7 Å²	47.7	18%	0.184	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-68.9	128.1	-178.5	-57.2	-72.8	0	0	0	111.4	A112 F115 L125 F172 P173	A112-Y123 HydrophobicContact CB-CD1 4.43Å; A112-Y123 HydrophobicContact CB-CE1 3.77Å; A112-Y123 VanDerWaalsContact O-CD1 3.24Å; A112-Y123 WeakPolarHBondContact O-CD1 3.37Å; A112-Y123 WeakPolarHBondContact O-CE1 3.45Å; F115-Y123 HydrophobicContact CB-CD1 4.2Å; F115-Y123 CarbonylContact O-C 3.38Å; Y123-L125 PolarHBondContact O-N 3.36Å; Y123-F172 AromaticContact CD1-CD1 3.84Å; Y123-F172 HydrophobicContact CD1-CD1 3.84Å; Y123-F172 HydrophobicContact CD1-CE1 4.26Å; Y123-F172 HydrophobicContact CD2-CB 4.33Å; Y123-F172 HydrophobicContact CD2-CD1 4.13Å; Y123-F172 HydrophobicContact CE1-CD1 4.39Å; Y123-F172 AromaticContact CG-CD1 3.68Å; Y123-F172 HydrophobicContact CG-CD1 3.68Å; Y123-F172 HydrophobicContact CG-CE1 4.33Å; Y123-P173 HydrophobicContact CE2-CG 3.74Å; Y123-P173 WeakPolarHBondContact OH-CD 3.37Å; Y123-P173 WeakPolarHBondContact OH-CG 3.5Å
124	A	96.5	Very high	95.6	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	26%	0.264	C	S	.	.			trans	-70.8	94.2	166.4	0	0	0	0	0	109.2	F115 C117 D122 I128 I136 C138	F115-A124 WeakPolarHBondContact O-CB 3.33Å; F115-A124 PolarHBondContact O-N 3.05Å; C117-A124 HydrophobicContact CB-CB 4.26Å; D122-A124 PolarHBondContact O-N 2.63Å; A124-I128 HydrophobicContact CB-CG2 4.22Å; A124-I128 WeakPolarHBondContact O-CD1 3.37Å; A124-I128 VanDerWaalsContact O-CG1 3.25Å; A124-I128 WeakPolarHBondContact O-CG1 3.43Å; A124-I136 HydrophobicContact CB-CD1 4.34Å; A124-C138 HydrophobicContact CB-CB 3.99Å
125	L	95.4	Very high	95.8	Very high	40 Å²	40	45.2 Å²	45.2	21%	0.209	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-90.5	157.5	175.7	-55.1	179.3	0	0	0	110.8	Y123 P127 F172 K190	Y123-L125 PolarHBondContact O-N 3.36Å; L125-P127 CarbonylContact O-C 3.52Å; L125-F172 HydrophobicContact CD2-CD1 3.97Å; L125-F172 HydrophobicContact CD2-CD2 3.92Å; L125-F172 HydrophobicContact CD2-CE1 3.9Å; L125-F172 HydrophobicContact CD2-CE2 3.85Å; L125-F172 HydrophobicContact CD2-CG 3.98Å; L125-F172 HydrophobicContact CD2-CZ 3.84Å; L125-K190 HydrophobicContact CD1-CD 4.01Å
126	P	95.7	Very high	95.8	Very high	32 Å²	32	46.1 Å²	46.1	21%	0.208	26%	0.259	C	S	.	.	S	Bend	trans	-50.7	133.7	178.7	-29.1	35.6	0	0	0	113.8	E164 A167 Y187	P126-E164 HydrophobicContact CB-CB 4.32Å; P126-E164 HydrophobicContact CB-CG 3.93Å; P126-E164 HydrophobicContact CG-CB 4.05Å; P126-E164 HydrophobicContact CG-CG 3.99Å; P126-A167 HydrophobicContact CG-CB 4.06Å; P126-Y187 HydrophobicContact CB-CD2 4.44Å; P126-Y187 HydrophobicContact CB-CE2 3.97Å; P126-Y187 HydrophobicContact CG-CD1 4.35Å; P126-Y187 HydrophobicContact CG-CD2 4Å; P126-Y187 HydrophobicContact CG-CE1 4.12Å; P126-Y187 HydrophobicContact CG-CE2 3.76Å; P126-Y187 HydrophobicContact CG-CG 4.3Å
127	P	95.9	Very high	95.9	Very high	58 Å²	58	41.7 Å²	41.7	38%	0.377	24%	0.238	S	C	.	.	S	Bend	cis	-75.1	131.5	-1.9	28	-30	0	0	0	113	L125 A139 E164	L125-P127 CarbonylContact O-C 3.52Å; P127-A139 HydrophobicContact CG-CB 3.93Å; P127-A139 WeakPolarHBondContact O-CB 3.2Å; P127-E164 VanDerWaalsContact CA-OE1 3.26Å; P127-E164 WeakPolarHBondContact CA-OE1 3.02Å
128	I	97.2	Very high	95.9	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	126.3	-178.2	-57	177.6	0	0	0	108.2	F115 A124 I136 R159 N160 M163 E164	F115-I128 HydrophobicContact CD1-CD1 3.76Å; F115-I128 HydrophobicContact CE1-CD1 3.85Å; A124-I128 HydrophobicContact CB-CG2 4.22Å; A124-I128 WeakPolarHBondContact O-CD1 3.37Å; A124-I128 VanDerWaalsContact O-CG1 3.25Å; A124-I128 WeakPolarHBondContact O-CG1 3.43Å; I128-I136 HydrophobicContact CG2-CB 3.94Å; I128-I136 HydrophobicContact CG2-CD1 4.48Å; I128-I136 HydrophobicContact CG2-CG2 4Å; I128-R159 CarbonylContact O-C 3.48Å; I128-R159 VanDerWaalsContact O-CA 3.32Å; I128-R159 WeakPolarHBondContact O-CA 3.49Å; I128-N160 HydrophobicContact CB-CB 4.47Å; I128-N160 HydrophobicContact CG2-CB 4.24Å; I128-N160 PolarHBondContact O-N 3.12Å; I128-M163 HydrophobicContact CD1-CB 3.81Å; I128-M163 HydrophobicContact CG2-CB 4.41Å; I128-E164 HydrophobicContact CB-CG 4.04Å; I128-E164 HydrophobicContact CD1-CG 4.18Å; I128-E164 HydrophobicContact CG1-CG 3.91Å; I128-E164 PolarHBondContact N-OE1 3.34Å
129	M	97.4	Very high	95.9	Very high	15 Å²	15	41.7 Å²	41.7	7%	0.074	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	141.1	-176.9	-54	-56.2	-61.8	0	0	109.8	I136 V137 A139 R142 N157 I158 R159	M129-I136 CarbonylContact O-C 3.54Å; M129-I136 VanDerWaalsContact O-CA 3.23Å; M129-I136 WeakPolarHBondContact O-CA 3.23Å; M129-V137 HydrophobicContact CB-CG2 3.92Å; M129-V137 PolarHBondContact N-O 2.87Å; M129-V137 PolarHBondContact O-N 3.07Å; M129-A139 HydrophobicContact CG-CB 4.39Å; M129-R142 HydrophobicContact CB-CB 4.01Å; M129-R142 HydrophobicContact CB-CG 4.07Å; M129-R142 HydrophobicContact CE-CG 4.19Å; M129-R142 HydrophobicContact CG-CB 3.73Å; M129-R142 HydrophobicContact CG-CG 3.85Å; M129-N157 VanDerWaalsContact CE-CA 3.46Å; M129-N157 HydrophobicContact CE-CB 4.03Å; M129-I158 CarbonylContact C-O 3.58Å; M129-I158 WeakPolarHBondContact CA-O 3.31Å; M129-R159 HydrophobicContact CE-CG 4.39Å; M129-R159 HydrophobicContact SD-CG 3.89Å
130	Q	96.8	Very high	95.8	Very high	43 Å²	43	43 Å²	43	20%	0.201	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	149.8	176.4	61.3	177.9	-21.7	0	0	112.5	H135 I158 R159 N160	Q130-H135 CarbonylContact C-O 3.54Å; Q130-H135 WeakPolarHBondContact CA-O 3.4Å; Q130-I158 HydrophobicContact CG-CB 4Å; Q130-I158 HydrophobicContact CG-CG2 3.64Å; Q130-I158 PolarHBondContact N-O 2.78Å; Q130-R159 PolarHBondContact NE2-O 2.84Å; Q130-N160 HydrophobicContact CB-CB 4.1Å; Q130-N160 HydrophobicContact CG-CB 4.01Å; Q130-N160 PolarHBondContact OE1-ND2 3.33Å
131	C	96.7	Very high	95.9	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.007	24%	0.236	C	C	.	.			trans	-79.3	171.6	165.2	79.6	0	0	0	0	111.3	S133 G134 H135 C148 C151 L155	C131-S133 PolarHBondContact O-N 3.03Å; C131-S133 VanDerWaalsContact O-N 3.14Å; C131-S133 PolarHBondContact SG-N 2.94Å; C131-G134 PolarHBondContact O-N 2.72Å; C131-H135 PolarHBondContact N-O 2.85Å; C131-H135 PolarHBondContact SG-N 3.34Å; C131-C148 HydrophobicContact CB-CB 3.66Å; C131-C148 VanDerWaalsContact SG-SG 3.62Å; C131-C151 VanDerWaalsContact SG-SG 3.62Å; C131-L155 HydrophobicContact CB-CD1 3.7Å
132	Q	95	Very high	96	Very high	125 Å²	125	37.6 Å²	37.6	58%	0.584	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-23.2	177.7	-63.7	-179.1	-0.4	0	0	113.7	D156 I158	Q132-D156 PolarHBondContact NE2-OD2 3.45Å; Q132-I158 HydrophobicContact CG-CD1 4.18Å
133	S	95.4	Very high	96	Very high	84 Å²	84	39.7 Å²	39.7	59%	0.587	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.2	0.9	175.5	-43.1	0	0	0	0	114.1	C131	C131-S133 PolarHBondContact O-N 3.03Å; C131-S133 VanDerWaalsContact O-N 3.14Å; C131-S133 PolarHBondContact SG-N 2.94Å
134	G	95.1	Very high	96	Very high	37 Å²	37	44.8 Å²	44.8	38%	0.381	26%	0.261	S	S	.	.			trans	90.6	1	177.3	0	0	0	0	0	116.8	C131	C131-G134 PolarHBondContact O-N 2.72Å
135	H	97.1	Very high	95.9	Very high	65 Å²	65	46.7 Å²	46.7	30%	0.301	27%	0.271	S	S	.	.			trans	-71	136.2	174.2	-58.7	108.8	0	0	0	111.1	Q130 C131 T150 C151	Q130-H135 CarbonylContact C-O 3.54Å; Q130-H135 WeakPolarHBondContact CA-O 3.4Å; C131-H135 PolarHBondContact N-O 2.85Å; C131-H135 PolarHBondContact SG-N 3.34Å; H135-T150 VanDerWaalsContact CD2-CG2 3.44Å; H135-T150 WeakPolarHBondContact CD2-CG2 3.12Å; H135-C151 PolarHBondContact ND1-SG 3.15Å
136	I	97.2	Very high	95.9	Very high	23 Å²	23	50.5 Å²	50.5	12%	0.118	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	150.3	-175.3	65.7	168.6	0	0	0	113.3	L114 P118 A124 I128 M129 M163	L114-I136 VanDerWaalsContact O-CD1 3.26Å; L114-I136 WeakPolarHBondContact O-CD1 3.37Å; P118-I136 WeakPolarHBondContact CD-O 3.14Å; A124-I136 HydrophobicContact CB-CD1 4.34Å; I128-I136 HydrophobicContact CG2-CB 3.94Å; I128-I136 HydrophobicContact CG2-CD1 4.48Å; I128-I136 HydrophobicContact CG2-CG2 4Å; M129-I136 CarbonylContact O-C 3.54Å; M129-I136 VanDerWaalsContact O-CA 3.23Å; M129-I136 WeakPolarHBondContact O-CA 3.23Å; I136-M163 HydrophobicContact CD1-CE 4.14Å; I136-M163 HydrophobicContact CG2-CG 4.41Å
137	V	97.6	Very high	95.9	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.006	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	155.6	166.4	-62.3	0	0	0	0	109.5	P118 V119 M129 R142 L145 P149 L155	P118-V137 HydrophobicContact CG-CG1 4.3Å; V119-V137 HydrophobicContact CG2-CG1 4.43Å; M129-V137 HydrophobicContact CB-CG2 3.92Å; M129-V137 PolarHBondContact N-O 2.87Å; M129-V137 PolarHBondContact O-N 3.07Å; V137-R142 HydrophobicContact CG2-CB 4.04Å; V137-L145 HydrophobicContact CG1-CD1 4.26Å; V137-P149 HydrophobicContact CG1-CG 3.85Å; V137-L155 HydrophobicContact CG2-CD1 4.33Å; V137-L155 HydrophobicContact CG2-CD2 4.31Å
138	C	96.8	Very high	95.9	Very high	10 Å²	10	48.5 Å²	48.5	7%	0.068	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	155.8	173.5	70	0	0	0	0	111.2	C117 A124 S140 C141 R142	C117-C138 HydrophobicContact CB-CB 4.26Å; C117-C138 PolarHBondContact SG-N 3.38Å; C117-C138 VanDerWaalsContact SG-N 3.39Å; A124-C138 HydrophobicContact CB-CB 3.99Å; C138-S140 VanDerWaalsContact C-N 3.26Å; C138-S140 PolarHBondContact O-N 3.1Å; C138-S140 PolarHBondContact SG-OG 3.07Å; C138-C141 PolarHBondContact O-N 2.81Å; C138-C141 VanDerWaalsContact SG-CB 3.52Å; C138-C141 PolarHBondContact SG-N 2.83Å; C138-C141 VanDerWaalsContact SG-N 3.41Å; C138-C141 PolarHBondContact SG-SG 3.27Å; C138-R142 PolarHBondContact O-N 3Å
139	A	95.3	Very high	95.9	Very high	39 Å²	39	51.2 Å²	51.2	32%	0.322	31%	0.306	S	S	.	.	H	α-helix	trans	-59.2	-35	-179.8	0	0	0	0	0	113.7	P127 M129 R142	P127-A139 HydrophobicContact CG-CB 3.93Å; P127-A139 WeakPolarHBondContact O-CB 3.2Å; M129-A139 HydrophobicContact CG-CB 4.39Å; A139-R142 PolarHBondContact O-N 2.96Å
140	S	95	Very high	95.8	Very high	72 Å²	72	54.1 Å²	54.1	50%	0.503	33%	0.325	S	S	.	.	H	α-helix	trans	-70.5	-30.6	179.7	61.6	0	0	0	0	113.1	C138 S143 K144	C138-S140 VanDerWaalsContact C-N 3.26Å; C138-S140 PolarHBondContact O-N 3.1Å; C138-S140 PolarHBondContact SG-OG 3.07Å; S140-S143 PolarHBondContact O-OG 2.88Å; S140-K144 WeakPolarHBondContact O-CE 3.48Å
141	C	96.9	Very high	95.8	Very high	6 Å²	6	54.3 Å²	54.3	4%	0.041	33%	0.331	C	S	.	.	H	α-helix	trans	-82.6	-34.5	172.8	-71.8	0	0	0	0	111.7	V119 C138 S143 K144 L145	V119-C141 HydrophobicContact CB-CB 3.97Å; V119-C141 HydrophobicContact CG1-CB 4Å; V119-C141 HydrophobicContact CG2-CB 4.49Å; C138-C141 PolarHBondContact O-N 2.81Å; C138-C141 VanDerWaalsContact SG-CB 3.52Å; C138-C141 PolarHBondContact SG-N 2.83Å; C138-C141 VanDerWaalsContact SG-N 3.41Å; C138-C141 PolarHBondContact SG-SG 3.27Å; C141-S143 PolarHBondContact O-N 2.81Å; C141-K144 PolarHBondContact O-N 3.49Å; C141-L145 HydrophobicContact CB-CD1 4.35Å; C141-L145 WeakPolarHBondContact O-CD1 3.34Å; C141-L145 VanDerWaalsContact O-CG 3.28Å; C141-L145 WeakPolarHBondContact O-CG 3.36Å; C141-L145 PolarHBondContact O-N 2.99Å
142	R	95.7	Very high	95.8	Very high	39 Å²	39	64.7 Å²	64.7	15%	0.147	37%	0.37	C	S	.	.	H	α-helix	trans	-51.8	-42.5	177.6	172.8	59.7	-171.9	78.5	1.4	112.7	M129 V137 C138 A139 K144 L145 L155 D156 N157	M129-R142 HydrophobicContact CB-CB 4.01Å; M129-R142 HydrophobicContact CB-CG 4.07Å; M129-R142 HydrophobicContact CE-CG 4.19Å; M129-R142 HydrophobicContact CG-CB 3.73Å; M129-R142 HydrophobicContact CG-CG 3.85Å; V137-R142 HydrophobicContact CG2-CB 4.04Å; C138-R142 PolarHBondContact O-N 3Å; A139-R142 PolarHBondContact O-N 2.96Å; R142-K144 PolarHBondContact O-N 3.19Å; R142-L145 PolarHBondContact O-N 3.37Å; R142-L155 PolarHBondContact NE-O 3Å; R142-L155 PolarHBondContact NH2-O 2.92Å; R142-D156 PolarHBondContact NE-O 3.05Å; R142-D156 VanDerWaalsContact NH2-C 3.33Å; R142-D156 PolarHBondContact NH2-O 3.21Å; R142-N157 PolarHBondContact NE-OD1 2.86Å; R142-N157 PolarHBondContact NH2-OD1 2.85Å; R142-N157 VanDerWaalsContact NH2-OD1 3.14Å
143	S	92.8	Very high	95.7	Very high	96 Å²	96	60 Å²	60	67%	0.671	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-16.5	-179.2	61.1	0	0	0	0	114.1	S140 C141	S140-S143 PolarHBondContact O-OG 2.88Å; C141-S143 PolarHBondContact O-N 2.81Å
144	K	94.7	Very high	95.6	Very high	154 Å²	154	60.9 Å²	60.9	67%	0.67	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.9	-2.6	-178	-56.3	173.1	-172.3	171.6	0	113	S140 C141 R142	S140-K144 WeakPolarHBondContact O-CE 3.48Å; C141-K144 PolarHBondContact O-N 3.49Å; R142-K144 PolarHBondContact O-N 3.19Å
145	L	94.7	Very high	95.4	Very high	41 Å²	41	59.4 Å²	59.4	22%	0.215	34%	0.336	C	S	.	.			trans	-116.5	136	-171.6	-62.4	165.7	0	0	0	111	V119 V137 C141 R142 P149 L155	V119-L145 HydrophobicContact CG2-CD1 3.83Å; V119-L145 HydrophobicContact CG2-CD2 4.42Å; V137-L145 HydrophobicContact CG1-CD1 4.26Å; C141-L145 HydrophobicContact CB-CD1 4.35Å; C141-L145 WeakPolarHBondContact O-CD1 3.34Å; C141-L145 VanDerWaalsContact O-CG 3.28Å; C141-L145 WeakPolarHBondContact O-CG 3.36Å; C141-L145 PolarHBondContact O-N 2.99Å; R142-L145 PolarHBondContact O-N 3.37Å; L145-P149 HydrophobicContact CD1-CG 4.45Å; L145-L155 HydrophobicContact CB-CD2 3.7Å; L145-L155 HydrophobicContact CD1-CD2 3.97Å
146	S	94.4	Very high	95	Very high	119 Å²	119	59.4 Å²	59.4	83%	0.832	34%	0.338	S	S	*	.	S	Bend	trans	-91.9	-22	172.9	57.1	0	0	0	0	113.3
147	S	96	Very high	94.7	Very high	48 Å²	48	64.1 Å²	64.1	34%	0.336	36%	0.364	S	S	.	.	B	Isolated β-bridge	trans	-146.5	163.8	-177.5	57.7	0	0	0	0	110.4
148	C	96.9	Very high	94.6	Very high	1 Å²	1	67.1 Å²	67.1	1%	0.007	38%	0.379	C	S	.	.			trans	-67.1	125.9	179.8	178	0	0	0	0	110.1	C131 T150 C151 R152 G153 L155	C131-C148 HydrophobicContact CB-CB 3.66Å; C131-C148 VanDerWaalsContact SG-SG 3.62Å; C148-T150 PolarHBondContact O-N 2.98Å; C148-C151 VanDerWaalsContact SG-SG 3.61Å; C148-R152 WeakPolarHBondContact O-CA 3.23Å; C148-R152 PolarHBondContact O-N 2.83Å; C148-G153 PolarHBondContact N-O 3.25Å; C148-L155 HydrophobicContact CB-CB 4.47Å; C148-L155 HydrophobicContact CB-CD1 4.32Å
149	P	95.7	Very high	94.6	Very high	56 Å²	56	72.7 Å²	72.7	36%	0.364	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-25.7	-178.9	27.3	-35.4	0	0	0	112.7	P118 V119 V137 L145	P118-P149 HydrophobicContact CG-CG 3.85Å; V119-P149 HydrophobicContact CG2-CB 4.05Å; V119-P149 HydrophobicContact CG2-CG 3.74Å; V137-P149 HydrophobicContact CG1-CG 3.85Å; L145-P149 HydrophobicContact CD1-CG 4.45Å
150	T	95.9	Very high	94.7	Very high	76 Å²	76	71.8 Å²	71.8	47%	0.466	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-50.7	-176.6	-44.2	0	0	0	0	112.8	H135 C148	H135-T150 VanDerWaalsContact CD2-CG2 3.44Å; H135-T150 WeakPolarHBondContact CD2-CG2 3.12Å; C148-T150 PolarHBondContact O-N 2.98Å
151	C	97	Very high	94.8	Very high	47 Å²	47	73.8 Å²	73.8	32%	0.318	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.7	-2.4	-176	67.1	0	0	0	0	115.2	C131 H135 C148 G153	C131-C151 VanDerWaalsContact SG-SG 3.62Å; H135-C151 PolarHBondContact ND1-SG 3.15Å; C148-C151 VanDerWaalsContact SG-SG 3.61Å; C151-G153 PolarHBondContact O-N 3.41Å
152	R	95.7	Very high	94.7	Very high	220 Å²	220	76.6 Å²	76.6	83%	0.83	42%	0.417	S	S	*	.			trans	60.9	7.2	-175.3	-51.5	179.1	-178.7	178.4	-0.2	115.2	C148	C148-R152 WeakPolarHBondContact O-CA 3.23Å; C148-R152 PolarHBondContact O-N 2.83Å
153	G	93.3	Very high	94.8	Very high	25 Å²	25	76.1 Å²	76.1	26%	0.258	42%	0.416	S	S	.	.	S	Bend	trans	-77	178	175.9	0	0	0	0	0	113.6	C148 C151 L155	C148-G153 PolarHBondContact N-O 3.25Å; C151-G153 PolarHBondContact O-N 3.41Å; G153-L155 PolarHBondContact O-N 3.14Å
154	N	93.3	Very high	95	Very high	103 Å²	103	72.6 Å²	72.6	55%	0.551	39%	0.389	S	S	*	.	B	Isolated β-bridge	trans	-58	123.2	177.2	-68.7	62.2	0	0	0	110.9
155	L	91.4	Very high	95	Very high	6 Å²	6	73 Å²	73	3%	0.031	39%	0.391	C	S	.	.			trans	-105	82.8	174.1	-170.2	68.9	0	0	0	107.2	C131 V137 R142 L145 C148 G153	C131-L155 HydrophobicContact CB-CD1 3.7Å; V137-L155 HydrophobicContact CG2-CD1 4.33Å; V137-L155 HydrophobicContact CG2-CD2 4.31Å; R142-L155 PolarHBondContact NE-O 3Å; R142-L155 PolarHBondContact NH2-O 2.92Å; L145-L155 HydrophobicContact CB-CD2 3.7Å; L145-L155 HydrophobicContact CD1-CD2 3.97Å; C148-L155 HydrophobicContact CB-CB 4.47Å; C148-L155 HydrophobicContact CB-CD1 4.32Å; G153-L155 PolarHBondContact O-N 3.14Å
156	D	87.8	Confident	95	Very high	66 Å²	66	75.8 Å²	75.8	35%	0.353	41%	0.406	S	S	.	.			trans	-74.6	-179.1	174.9	-65.5	-44.4	0	0	0	110.8	Q132 R142 I158	Q132-D156 PolarHBondContact NE2-OD2 3.45Å; R142-D156 PolarHBondContact NE-O 3.05Å; R142-D156 VanDerWaalsContact NH2-C 3.33Å; R142-D156 PolarHBondContact NH2-O 3.21Å; D156-I158 HydrophobicContact CB-CD1 4.06Å; D156-I158 HydrophobicContact CB-CG1 3.92Å; D156-I158 PolarHBondContact O-N 3.16Å; D156-I158 VanDerWaalsContact O-N 3.15Å
157	N	91.2	Very high	95.1	Very high	122 Å²	122	70.1 Å²	70.1	65%	0.652	37%	0.366	S	S	*	.	S	Bend	trans	-86.6	49.2	175.2	-74.3	-36.7	0	0	0	111.6	M129 R142	M129-N157 VanDerWaalsContact CE-CA 3.46Å; M129-N157 HydrophobicContact CE-CB 4.03Å; R142-N157 PolarHBondContact NE-OD1 2.86Å; R142-N157 PolarHBondContact NH2-OD1 2.85Å; R142-N157 VanDerWaalsContact NH2-OD1 3.14Å
158	I	95.8	Very high	95	Very high	64 Å²	64	70.7 Å²	70.7	33%	0.328	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	121.2	-179.4	-56.3	167.4	0	0	0	108.7	M129 Q130 Q132 D156	M129-I158 CarbonylContact C-O 3.58Å; M129-I158 WeakPolarHBondContact CA-O 3.31Å; Q130-I158 HydrophobicContact CG-CB 4Å; Q130-I158 HydrophobicContact CG-CG2 3.64Å; Q130-I158 PolarHBondContact N-O 2.78Å; Q132-I158 HydrophobicContact CG-CD1 4.18Å; D156-I158 HydrophobicContact CB-CD1 4.06Å; D156-I158 HydrophobicContact CB-CG1 3.92Å; D156-I158 PolarHBondContact O-N 3.16Å; D156-I158 VanDerWaalsContact O-N 3.15Å
159	R	97.1	Very high	94.7	Very high	127 Å²	127	75.6 Å²	75.6	48%	0.479	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	137.3	172.9	-72.1	179	63.9	-176.8	1.6	111	I128 M129 Q130 L161 E164	I128-R159 CarbonylContact O-C 3.48Å; I128-R159 VanDerWaalsContact O-CA 3.32Å; I128-R159 WeakPolarHBondContact O-CA 3.49Å; M129-R159 HydrophobicContact CE-CG 4.39Å; M129-R159 HydrophobicContact SD-CG 3.89Å; Q130-R159 PolarHBondContact NE2-O 2.84Å; R159-L161 HydrophobicContact CB-CD2 4.16Å; R159-L161 PolarHBondContact O-N 3.3Å; R159-E164 IonicContact CZ-OE1 3.46Å; R159-E164 IonicContact CZ-OE2 3.52Å; R159-E164 IonicContact NE-OE1 2.91Å; R159-E164 PolarHBondContact NE-OE1 3.4Å; R159-E164 IonicContact NE-OE2 3.68Å; R159-E164 VanDerWaalsContact NH2-CD 3.3Å; R159-E164 IonicContact NH2-OE1 3.17Å; R159-E164 PolarHBondContact NH2-OE1 3.26Å; R159-E164 IonicContact NH2-OE2 2.67Å; R159-E164 PolarHBondContact NH2-OE2 3.36Å
160	N	96.9	Very high	94.7	Very high	19 Å²	19	73.5 Å²	73.5	10%	0.102	39%	0.39	C	S	.	.			trans	-91.2	80.7	173.5	-167.5	-28	0	0	0	110.1	I128 Q130 A162 M163 E164	I128-N160 HydrophobicContact CB-CB 4.47Å; I128-N160 HydrophobicContact CG2-CB 4.24Å; I128-N160 PolarHBondContact O-N 3.12Å; Q130-N160 HydrophobicContact CB-CB 4.1Å; Q130-N160 HydrophobicContact CG-CB 4.01Å; Q130-N160 PolarHBondContact OE1-ND2 3.33Å; N160-A162 PolarHBondContact O-N 3.48Å; N160-A162 PolarHBondContact OD1-N 2.66Å; N160-M163 HydrophobicContact CB-CB 4.12Å; N160-M163 HydrophobicContact CB-CG 4.38Å; N160-M163 VanDerWaalsContact CG-CG 3.46Å; N160-M163 VanDerWaalsContact ND2-CG 3.28Å; N160-M163 WeakPolarHBondContact ND2-CG 3.45Å; N160-M163 PolarHBondContact O-N 3.21Å; N160-M163 PolarHBondContact OD1-N 2.81Å; N160-E164 WeakPolarHBondContact O-CG 3.48Å; N160-E164 PolarHBondContact O-N 3.01Å
161	L	96.9	Very high	94.7	Very high	114 Å²	114	74.8 Å²	74.8	60%	0.597	39%	0.394	S	S	*	.	H	α-helix	trans	-61	-28.6	-178.5	-57.6	179.6	0	0	0	113	R159 K165	R159-L161 HydrophobicContact CB-CD2 4.16Å; R159-L161 PolarHBondContact O-N 3.3Å; L161-K165 WeakPolarHBondContact O-CB 3.48Å; L161-K165 PolarHBondContact O-N 3.21Å
162	A	96.3	Very high	94.6	Very high	66 Å²	66	72.6 Å²	72.6	55%	0.545	38%	0.379	S	S	.	.	H	α-helix	trans	-68	-47.6	176.5	0	0	0	0	0	111	N160 E164 K165 L166	N160-A162 PolarHBondContact O-N 3.48Å; N160-A162 PolarHBondContact OD1-N 2.66Å; A162-E164 VanDerWaalsContact C-N 3.34Å; A162-K165 PolarHBondContact O-N 3.15Å; A162-L166 WeakPolarHBondContact O-CG 3.43Å; A162-L166 PolarHBondContact O-N 2.97Å
163	M	96.4	Very high	94.6	Very high	28 Å²	28	63.4 Å²	63.4	14%	0.138	35%	0.348	C	S	.	.	H	α-helix	trans	-64.4	-39.4	174	-72	-62.1	-74	0	0	111.4	L114 F115 I128 I136 N160 K165 L166 A167	L114-M163 HydrophobicContact CB-CE 4.34Å; L114-M163 WeakPolarHBondContact O-CE 3.42Å; F115-M163 HydrophobicContact CD1-CE 3.71Å; F115-M163 HydrophobicContact CD2-CE 4.1Å; F115-M163 HydrophobicContact CE1-CB 4.24Å; F115-M163 HydrophobicContact CE1-CE 3.51Å; F115-M163 VanDerWaalsContact CE1-O 3.28Å; F115-M163 WeakPolarHBondContact CE1-O 3.28Å; F115-M163 HydrophobicContact CE1-SD 4.46Å; F115-M163 HydrophobicContact CE2-CE 3.93Å; F115-M163 HydrophobicContact CG-CE 3.99Å; F115-M163 HydrophobicContact CZ-CE 3.64Å; F115-M163 HydrophobicContact CZ-SD 4.42Å; I128-M163 HydrophobicContact CD1-CB 3.81Å; I128-M163 HydrophobicContact CG2-CB 4.41Å; I136-M163 HydrophobicContact CD1-CE 4.14Å; I136-M163 HydrophobicContact CG2-CG 4.41Å; N160-M163 HydrophobicContact CB-CB 4.12Å; N160-M163 HydrophobicContact CB-CG 4.38Å; N160-M163 VanDerWaalsContact CG-CG 3.46Å; N160-M163 VanDerWaalsContact ND2-CG 3.28Å; N160-M163 WeakPolarHBondContact ND2-CG 3.45Å; N160-M163 PolarHBondContact O-N 3.21Å; N160-M163 PolarHBondContact OD1-N 2.81Å; M163-K165 VanDerWaalsContact C-N 3.27Å; M163-K165 PolarHBondContact O-N 2.88Å; M163-L166 CarbonylContact O-C 3.57Å; M163-L166 PolarHBondContact O-N 2.85Å; M163-L166 VanDerWaalsContact O-N 3.09Å; M163-L166 HydrophobicContact SD-CD1 3.95Å; M163-A167 PolarHBondContact O-N 3.42Å
164	E	96.9	Very high	94.7	Very high	23 Å²	23	62.2 Å²	62.2	11%	0.107	34%	0.335	C	S	.	.	H	α-helix	trans	-60	-38.8	175	-67.9	177.5	-170.7	0	0	112.2	P126 P127 I128 R159 N160 A162 A167	P126-E164 HydrophobicContact CB-CB 4.32Å; P126-E164 HydrophobicContact CB-CG 3.93Å; P126-E164 HydrophobicContact CG-CB 4.05Å; P126-E164 HydrophobicContact CG-CG 3.99Å; P127-E164 VanDerWaalsContact CA-OE1 3.26Å; P127-E164 WeakPolarHBondContact CA-OE1 3.02Å; I128-E164 HydrophobicContact CB-CG 4.04Å; I128-E164 HydrophobicContact CD1-CG 4.18Å; I128-E164 HydrophobicContact CG1-CG 3.91Å; I128-E164 PolarHBondContact N-OE1 3.34Å; R159-E164 IonicContact CZ-OE1 3.46Å; R159-E164 IonicContact CZ-OE2 3.52Å; R159-E164 IonicContact NE-OE1 2.91Å; R159-E164 PolarHBondContact NE-OE1 3.4Å; R159-E164 IonicContact NE-OE2 3.68Å; R159-E164 VanDerWaalsContact NH2-CD 3.3Å; R159-E164 IonicContact NH2-OE1 3.17Å; R159-E164 PolarHBondContact NH2-OE1 3.26Å; R159-E164 IonicContact NH2-OE2 2.67Å; R159-E164 PolarHBondContact NH2-OE2 3.36Å; N160-E164 WeakPolarHBondContact O-CG 3.48Å; N160-E164 PolarHBondContact O-N 3.01Å; A162-E164 VanDerWaalsContact C-N 3.34Å; E164-A167 WeakPolarHBondContact O-CB 3.36Å; E164-A167 PolarHBondContact O-N 3.04Å
165	K	95.8	Very high	94.7	Very high	163 Å²	163	61.1 Å²	61.1	71%	0.709	33%	0.326	S	S	*	.	H	α-helix	trans	-70.2	-33.1	173.9	-172.4	175.4	-178.6	-179.6	0	112.8	L161 A162 M163 S168	L161-K165 WeakPolarHBondContact O-CB 3.48Å; L161-K165 PolarHBondContact O-N 3.21Å; A162-K165 PolarHBondContact O-N 3.15Å; M163-K165 VanDerWaalsContact C-N 3.27Å; M163-K165 PolarHBondContact O-N 2.88Å; K165-S168 PolarHBondContact O-OG 3.31Å
166	L	95.1	Very high	94.8	Very high	99 Å²	99	62.5 Å²	62.5	52%	0.518	33%	0.331	S	S	.	.	H	α-helix	trans	-71	-36.6	173.7	-71.9	172.6	0	0	0	111.5	F115 A162 M163 S168 S169	F115-L166 HydrophobicContact CZ-CB 3.86Å; A162-L166 WeakPolarHBondContact O-CG 3.43Å; A162-L166 PolarHBondContact O-N 2.97Å; M163-L166 CarbonylContact O-C 3.57Å; M163-L166 PolarHBondContact O-N 2.85Å; M163-L166 VanDerWaalsContact O-N 3.09Å; M163-L166 HydrophobicContact SD-CD1 3.95Å; L166-S168 PolarHBondContact O-N 3.01Å; L166-S168 VanDerWaalsContact O-N 3.12Å; L166-S169 PolarHBondContact O-N 3.28Å
167	A	95.7	Very high	95	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-57.5	-27.9	177	0	0	0	0	0	112.2	F115 P126 M163 E164 S169 V170 F172 Y187	F115-A167 HydrophobicContact CD1-CB 4.3Å; F115-A167 HydrophobicContact CE1-CB 3.61Å; F115-A167 HydrophobicContact CZ-CB 4.12Å; P126-A167 HydrophobicContact CG-CB 4.06Å; M163-A167 PolarHBondContact O-N 3.42Å; E164-A167 WeakPolarHBondContact O-CB 3.36Å; E164-A167 PolarHBondContact O-N 3.04Å; A167-S169 PolarHBondContact O-N 3.18Å; A167-V170 PolarHBondContact O-N 3.41Å; A167-F172 HydrophobicContact CB-CE2 4.24Å; A167-F172 HydrophobicContact CB-CZ 4.07Å; A167-Y187 HydrophobicContact CB-CD1 4.15Å
168	S	92.8	Very high	95	Very high	59 Å²	59	62.3 Å²	62.3	41%	0.413	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-14.6	177.3	66.5	0	0	0	0	114.7	K165 L166 H186	K165-S168 PolarHBondContact O-OG 3.31Å; L166-S168 PolarHBondContact O-N 3.01Å; L166-S168 VanDerWaalsContact O-N 3.12Å; S168-H186 VanDerWaalsContact CA-NE2 3.26Å; S168-H186 WeakPolarHBondContact CA-NE2 3.13Å; S168-H186 PolarHBondContact O-CD2 3.32Å; S168-H186 PolarHBondContact O-NE2 3.02Å
169	S	92.6	Very high	94.8	Very high	104 Å²	104	62.1 Å²	62.1	73%	0.727	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.1	1.3	-179.4	-56	0	0	0	0	113	L166 A167	L166-S169 PolarHBondContact O-N 3.28Å; A167-S169 PolarHBondContact O-N 3.18Å
170	V	94.5	Very high	94.6	Very high	12 Å²	12	57.9 Å²	57.9	7%	0.073	34%	0.339	C	S	.	.			trans	-113.4	138.6	-176.5	178.2	0	0	0	0	109.4	L111 A112 F115 A167 F172	L111-V170 HydrophobicContact CB-CG1 4.26Å; L111-V170 HydrophobicContact CB-CG2 3.91Å; L111-V170 HydrophobicContact CD1-CG2 4.27Å; A112-V170 HydrophobicContact CB-CG1 4.14Å; F115-V170 HydrophobicContact CE2-CG2 4.1Å; A167-V170 PolarHBondContact O-N 3.41Å; V170-F172 HydrophobicContact CB-CE2 4.12Å; V170-F172 HydrophobicContact CB-CZ 4.02Å; V170-F172 HydrophobicContact CG1-CD1 4.49Å; V170-F172 HydrophobicContact CG1-CE1 4.09Å; V170-F172 HydrophobicContact CG1-CE2 4.23Å; V170-F172 HydrophobicContact CG1-CZ 3.96Å; V170-F172 WeakPolarHBondContact O-CE2 3.48Å
171	L	95.3	Very high	94.5	Very high	104 Å²	104	57.3 Å²	57.3	55%	0.545	34%	0.336	S	S	.	.			trans	-93.3	132.3	167.7	-61.6	178.1	0	0	0	108.7	H186	L171-H186 HydrophobicContact CD2-CB 4.47Å
172	F	95.5	Very high	94.4	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	129.7	-179.3	-62.2	-85.5	0	0	0	109.2	A112 F115 Y123 L125 A167 V170 T184 F185 K190	A112-F172 HydrophobicContact CB-CD1 4.04Å; A112-F172 HydrophobicContact CB-CE1 4.39Å; F115-F172 HydrophobicContact CB-CE1 3.75Å; F115-F172 HydrophobicContact CB-CZ 4.44Å; F115-F172 HydrophobicContact CD1-CE1 4.21Å; F115-F172 HydrophobicContact CD1-CZ 4.06Å; F115-F172 AromaticContact CD2-CE1 3.73Å; F115-F172 HydrophobicContact CD2-CE1 3.73Å; F115-F172 AromaticContact CD2-CZ 3.98Å; F115-F172 HydrophobicContact CD2-CZ 3.98Å; F115-F172 HydrophobicContact CE1-CZ 4.33Å; F115-F172 HydrophobicContact CE2-CE1 4.42Å; F115-F172 HydrophobicContact CE2-CZ 4.26Å; F115-F172 AromaticContact CG-CE1 3.62Å; F115-F172 HydrophobicContact CG-CE1 3.62Å; F115-F172 AromaticContact CG-CZ 3.89Å; F115-F172 HydrophobicContact CG-CZ 3.89Å; F115-F172 HydrophobicContact CZ-CZ 4.43Å; Y123-F172 AromaticContact CD1-CD1 3.84Å; Y123-F172 HydrophobicContact CD1-CD1 3.84Å; Y123-F172 HydrophobicContact CD1-CE1 4.26Å; Y123-F172 HydrophobicContact CD2-CB 4.33Å; Y123-F172 HydrophobicContact CD2-CD1 4.13Å; Y123-F172 HydrophobicContact CE1-CD1 4.39Å; Y123-F172 AromaticContact CG-CD1 3.68Å; Y123-F172 HydrophobicContact CG-CD1 3.68Å; Y123-F172 HydrophobicContact CG-CE1 4.33Å; L125-F172 HydrophobicContact CD2-CD1 3.97Å; L125-F172 HydrophobicContact CD2-CD2 3.92Å; L125-F172 HydrophobicContact CD2-CE1 3.9Å; L125-F172 HydrophobicContact CD2-CE2 3.85Å; L125-F172 HydrophobicContact CD2-CG 3.98Å; L125-F172 HydrophobicContact CD2-CZ 3.84Å; A167-F172 HydrophobicContact CB-CE2 4.24Å; A167-F172 HydrophobicContact CB-CZ 4.07Å; V170-F172 HydrophobicContact CB-CE2 4.12Å; V170-F172 HydrophobicContact CB-CZ 4.02Å; V170-F172 HydrophobicContact CG1-CD1 4.49Å; V170-F172 HydrophobicContact CG1-CE1 4.09Å; V170-F172 HydrophobicContact CG1-CE2 4.23Å; V170-F172 HydrophobicContact CG1-CZ 3.96Å; V170-F172 WeakPolarHBondContact O-CE2 3.48Å; F172-T184 CarbonylContact O-C 3.6Å; F172-T184 WeakPolarHBondContact O-CA 3.48Å; F172-F185 PolarHBondContact N-O 3.49Å; F172-F185 PolarHBondContact O-N 3.08Å; F172-K190 HydrophobicContact CB-CD 3.79Å
173	P	95.5	Very high	94.3	Very high	27 Å²	27	58.1 Å²	58.1	18%	0.175	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	152.4	174.6	27.5	-33.2	0	0	0	110.7	Y123 T184 K190	Y123-P173 HydrophobicContact CE2-CG 3.74Å; Y123-P173 WeakPolarHBondContact OH-CD 3.37Å; Y123-P173 WeakPolarHBondContact OH-CG 3.5Å; P173-T184 HydrophobicContact CB-CG2 4.25Å; P173-K190 PolarHBondContact O-NZ 2.77Å
174	C	95.3	Very high	94.3	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	35%	0.349	C	S	.	.			trans	-54.3	142.5	170.7	-178.3	0	0	0	0	110.6	Y176 S177 C181 E183 H193	C174-Y176 PolarHBondContact O-N 2.72Å; C174-Y176 VanDerWaalsContact O-N 3.1Å; C174-Y176 PolarHBondContact SG-N 2.78Å; C174-S177 WeakPolarHBondContact O-CB 3.33Å; C174-S177 PolarHBondContact O-N 2.72Å; C174-S177 PolarHBondContact O-OG 2.8Å; C174-C181 HydrophobicContact CB-CB 3.93Å; C174-C181 VanDerWaalsContact CB-SG 3.57Å; C174-E183 PolarHBondContact N-O 3Å; C174-H193 PolarHBondContact SG-CD2 2.83Å; C174-H193 PolarHBondContact SG-NE2 2.62Å
175	K	93.1	Very high	94.2	Very high	81 Å²	81	61.1 Å²	61.1	35%	0.352	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-18.9	176.4	72.5	-173.7	172.6	-141.2	0	113.3	S177 E194	K175-S177 VanDerWaalsContact C-N 3.32Å; K175-E194 WeakPolarHBondContact CB-OE1 3.43Å; K175-E194 VanDerWaalsContact CD-CD 3.48Å; K175-E194 HydrophobicContact CD-CG 4.28Å; K175-E194 VanDerWaalsContact CD-OE2 3.28Å; K175-E194 WeakPolarHBondContact CD-OE2 3.38Å; K175-E194 WeakPolarHBondContact CE-OE2 3.25Å; K175-E194 HydrophobicContact CG-CG 4.08Å; K175-E194 WeakPolarHBondContact CG-OE1 3.29Å; K175-E194 PolarHBondContact N-OE1 2.88Å; K175-E194 VanDerWaalsContact N-OE1 3.09Å; K175-E194 IonicContact NZ-OE2 2.79Å; K175-E194 PolarHBondContact NZ-OE2 3.4Å
176	Y	93.3	Very high	94.1	Very high	35 Å²	35	56 Å²	56	14%	0.137	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	18.3	174.9	-48.6	-61.3	0	0	0	112.7	C174 T178 S179 G180 C181 E194 C197 R200 P201	C174-Y176 PolarHBondContact O-N 2.72Å; C174-Y176 VanDerWaalsContact O-N 3.1Å; C174-Y176 PolarHBondContact SG-N 2.78Å; Y176-T178 PolarHBondContact O-N 3.25Å; Y176-S179 CarbonylContact O-C 3.58Å; Y176-S179 WeakPolarHBondContact O-CA 3.39Å; Y176-S179 WeakPolarHBondContact O-CB 3.38Å; Y176-S179 PolarHBondContact O-N 2.98Å; Y176-G180 PolarHBondContact O-N 2.57Å; Y176-C181 WeakPolarHBondContact O-CB 3.26Å; Y176-C181 PolarHBondContact O-N 3.03Å; Y176-C181 VanDerWaalsContact O-N 3.15Å; Y176-E194 HydrophobicContact CE2-CB 4.25Å; Y176-E194 HydrophobicContact CE2-CG 4.47Å; Y176-E194 WeakPolarHBondContact CE2-O 3.36Å; Y176-C197 HydrophobicContact CD2-CB 3.84Å; Y176-C197 HydrophobicContact CE2-CB 4.21Å; Y176-R200 HydrophobicContact CD2-CB 3.97Å; Y176-R200 HydrophobicContact CE1-CB 4.21Å; Y176-R200 HydrophobicContact CE1-CG 4.1Å; Y176-R200 HydrophobicContact CE2-CB 3.52Å; Y176-R200 HydrophobicContact CE2-CG 3.82Å; Y176-R200 HydrophobicContact CG-CB 4.47Å; Y176-R200 VanDerWaalsContact CZ-CG 3.46Å; Y176-R200 WeakPolarHBondContact OH-CD 3.45Å; Y176-R200 VanDerWaalsContact OH-CG 3.25Å; Y176-R200 WeakPolarHBondContact OH-CG 3.45Å; Y176-P201 HydrophobicContact CE1-CG 4.34Å
177	S	93.9	Very high	94.1	Very high	51 Å²	51	54.5 Å²	54.5	36%	0.357	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	-59.1	-35.5	174.5	50.5	0	0	0	0	112.4	C174 K175 S179 G180 C181	C174-S177 WeakPolarHBondContact O-CB 3.33Å; C174-S177 PolarHBondContact O-N 2.72Å; C174-S177 PolarHBondContact O-OG 2.8Å; K175-S177 VanDerWaalsContact C-N 3.32Å; S177-S179 PolarHBondContact O-N 2.82Å; S177-G180 PolarHBondContact O-N 3Å; S177-C181 VanDerWaalsContact CA-O 3.32Å; S177-C181 WeakPolarHBondContact CA-O 3.34Å
178	T	91	Very high	94	Very high	133 Å²	133	58.3 Å²	58.3	82%	0.816	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-64	-25.5	172.8	52.2	0	0	0	0	113.4	Y176 G180	Y176-T178 PolarHBondContact O-N 3.25Å; T178-G180 VanDerWaalsContact C-N 3.35Å
179	S	90.6	Very high	94	Very high	59 Å²	59	58 Å²	58	41%	0.413	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-88.2	-2.3	173.6	-57.2	0	0	0	0	113	Y176 S177 Y199	Y176-S179 CarbonylContact O-C 3.58Å; Y176-S179 WeakPolarHBondContact O-CA 3.39Å; Y176-S179 WeakPolarHBondContact O-CB 3.38Å; Y176-S179 PolarHBondContact O-N 2.98Å; S177-S179 PolarHBondContact O-N 2.82Å; S179-Y199 WeakPolarHBondContact O-CD1 3.42Å
180	G	93.1	Very high	94.1	Very high	39 Å²	39	53.1 Å²	53.1	40%	0.402	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	113.5	3.4	174.5	0	0	0	0	0	115.8	Y176 S177 T178 P182 Y199	Y176-G180 PolarHBondContact O-N 2.57Å; S177-G180 PolarHBondContact O-N 3Å; T178-G180 VanDerWaalsContact C-N 3.35Å; G180-P182 VanDerWaalsContact O-CD 3.25Å; G180-P182 WeakPolarHBondContact O-CD 3.39Å; G180-Y199 WeakPolarHBondContact O-CE1 3.4Å; G180-Y199 VanDerWaalsContact O-CZ 3.31Å
181	C	93.9	Very high	94	Very high	6 Å²	6	56.5 Å²	56.5	4%	0.041	33%	0.33	C	S	.	.			trans	-69.6	115.6	175.7	-172.5	0	0	0	0	111.2	C174 Y176 S177 E183 H193 Y199	C174-C181 HydrophobicContact CB-CB 3.93Å; C174-C181 VanDerWaalsContact CB-SG 3.57Å; Y176-C181 WeakPolarHBondContact O-CB 3.26Å; Y176-C181 PolarHBondContact O-N 3.03Å; Y176-C181 VanDerWaalsContact O-N 3.15Å; S177-C181 VanDerWaalsContact CA-O 3.32Å; S177-C181 WeakPolarHBondContact CA-O 3.34Å; C181-E183 VanDerWaalsContact C-N 3.29Å; C181-E183 PolarHBondContact O-N 2.95Å; C181-H193 PolarHBondContact SG-NE2 3.49Å; C181-Y199 VanDerWaalsContact CA-CD2 3.4Å; C181-Y199 HydrophobicContact CB-CD2 3.48Å; C181-Y199 VanDerWaalsContact CB-CD2 3.48Å; C181-Y199 HydrophobicContact CB-CE2 4.16Å; C181-Y199 HydrophobicContact CB-CG 3.89Å
182	P	95.2	Very high	93.9	Very high	98 Å²	98	58.7 Å²	58.7	64%	0.636	34%	0.337	S	S	*	.			trans	-83.3	-7.7	-177.4	35.3	-35.7	0	0	0	113.2	G180	G180-P182 VanDerWaalsContact O-CD 3.25Å; G180-P182 WeakPolarHBondContact O-CD 3.39Å
183	E	95.1	Very high	93.9	Very high	99 Å²	99	60.6 Å²	60.6	46%	0.463	35%	0.346	S	S	.	.			trans	-79	143	-167.5	-60.6	-62.6	146.7	0	0	112.9	C174 C181 F185	C174-E183 PolarHBondContact N-O 3Å; C181-E183 VanDerWaalsContact C-N 3.29Å; C181-E183 PolarHBondContact O-N 2.95Å; E183-F185 HydrophobicContact CB-CD2 4.36Å; E183-F185 HydrophobicContact CB-CE2 3.32Å; E183-F185 HydrophobicContact CB-CZ 3.5Å; E183-F185 VanDerWaalsContact CB-CZ 3.5Å; E183-F185 HydrophobicContact CG-CE2 4.39Å; E183-F185 HydrophobicContact CG-CZ 4.16Å
184	T	95.6	Very high	93.8	Very high	71 Å²	71	60.1 Å²	60.1	44%	0.436	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	139.3	176.8	65.4	0	0	0	0	110.3	F172 P173	F172-T184 CarbonylContact O-C 3.6Å; F172-T184 WeakPolarHBondContact O-CA 3.48Å; P173-T184 HydrophobicContact CB-CG2 4.25Å
185	F	94.5	Very high	93.5	Very high	44 Å²	44	63.6 Å²	63.6	19%	0.193	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	153.9	-171.2	-61	-84.9	0	0	0	112.6	F172 E183 K190 H193	F172-F185 PolarHBondContact N-O 3.49Å; F172-F185 PolarHBondContact O-N 3.08Å; E183-F185 HydrophobicContact CB-CD2 4.36Å; E183-F185 HydrophobicContact CB-CE2 3.32Å; E183-F185 HydrophobicContact CB-CZ 3.5Å; E183-F185 VanDerWaalsContact CB-CZ 3.5Å; E183-F185 HydrophobicContact CG-CE2 4.39Å; E183-F185 HydrophobicContact CG-CZ 4.16Å; F185-K190 HydrophobicContact CB-CB 4.03Å; F185-H193 HydrophobicContact CD1-CB 4.4Å; F185-H193 HydrophobicContact CD2-CB 4.15Å; F185-H193 AromaticContact CD2-CD2 3.98Å; F185-H193 HydrophobicContact CE1-CB 3.96Å; F185-H193 HydrophobicContact CE2-CB 3.68Å; F185-H193 AromaticContact CE2-CD2 3.23Å; F185-H193 WeakPolarHBondContact CE2-CD2 3.23Å; F185-H193 AromaticContact CE2-CE1 3.81Å; F185-H193 AromaticContact CE2-CG 3.19Å; F185-H193 AromaticContact CE2-ND1 3.59Å; F185-H193 AromaticContact CE2-NE2 3.64Å; F185-H193 HydrophobicContact CG-CB 4.49Å; F185-H193 HydrophobicContact CZ-CB 3.58Å; F185-H193 AromaticContact CZ-CD2 3.79Å; F185-H193 AromaticContact CZ-CE1 3.82Å; F185-H193 AromaticContact CZ-CG 3.25Å; F185-H193 AromaticContact CZ-ND1 3.3Å; F185-H193 VanDerWaalsContact CZ-ND1 3.3Å; F185-H193 WeakPolarHBondContact CZ-ND1 3.18Å
186	H	95	Very high	93.3	Very high	54 Å²	54	62.1 Å²	62.1	25%	0.25	37%	0.373	C	S	.	.			trans	-63.4	147.5	160.8	-175	-102.6	0	0	0	110.1	S168 L171 T188 S189 K190	S168-H186 VanDerWaalsContact CA-NE2 3.26Å; S168-H186 WeakPolarHBondContact CA-NE2 3.13Å; S168-H186 PolarHBondContact O-CD2 3.32Å; S168-H186 PolarHBondContact O-NE2 3.02Å; L171-H186 HydrophobicContact CD2-CB 4.47Å; H186-T188 PolarHBondContact ND1-N 3.46Å; H186-T188 PolarHBondContact ND1-OG1 3.03Å; H186-T188 PolarHBondContact O-N 3.17Å; H186-S189 PolarHBondContact O-N 2.86Å; H186-K190 PolarHBondContact O-N 3.37Å; H186-K190 VanDerWaalsContact O-N 3.09Å
187	Y	93.8	Very high	93.2	Very high	68 Å²	68	60.7 Å²	60.7	27%	0.267	37%	0.368	S	S	.	.	H	α-helix	trans	-57.3	-28.8	-172.5	78.4	-94.1	0	0	0	113.8	P126 A167 S189	P126-Y187 HydrophobicContact CB-CD2 4.44Å; P126-Y187 HydrophobicContact CB-CE2 3.97Å; P126-Y187 HydrophobicContact CG-CD1 4.35Å; P126-Y187 HydrophobicContact CG-CD2 4Å; P126-Y187 HydrophobicContact CG-CE1 4.12Å; P126-Y187 HydrophobicContact CG-CE2 3.76Å; P126-Y187 HydrophobicContact CG-CG 4.3Å; A167-Y187 HydrophobicContact CB-CD1 4.15Å; Y187-S189 VanDerWaalsContact C-N 3.33Å; Y187-S189 PolarHBondContact O-N 2.83Å
188	T	94.1	Very high	93	Very high	81 Å²	81	62 Å²	62	50%	0.497	37%	0.369	S	S	.	.	H	α-helix	trans	-70.5	-26.4	179.1	56.2	0	0	0	0	113.7	H186	H186-T188 PolarHBondContact ND1-N 3.46Å; H186-T188 PolarHBondContact ND1-OG1 3.03Å; H186-T188 PolarHBondContact O-N 3.17Å
189	S	93.8	Very high	93	Very high	51 Å²	51	60.8 Å²	60.8	36%	0.357	35%	0.35	S	S	.	.	H	α-helix	trans	-107.1	-15.2	-174.8	-55.5	0	0	0	0	112.2	H186 Y187 S191 E192 H193	H186-S189 PolarHBondContact O-N 2.86Å; Y187-S189 VanDerWaalsContact C-N 3.33Å; Y187-S189 PolarHBondContact O-N 2.83Å; S189-S191 VanDerWaalsContact C-N 3.34Å; S189-S191 PolarHBondContact O-N 2.85Å; S189-E192 PolarHBondContact O-N 2.91Å; S189-H193 PolarHBondContact O-N 2.98Å
190	K	94	Very high	93.1	Very high	3 Å²	3	60.1 Å²	60.1	1%	0.013	34%	0.339	C	S	.	.	H	α-helix	trans	-56	-43	-179.4	177.2	166.9	155.3	69.9	0	113.2	L125 F172 P173 F185 H186 E192 H193 E194	L125-K190 HydrophobicContact CD1-CD 4.01Å; F172-K190 HydrophobicContact CB-CD 3.79Å; P173-K190 PolarHBondContact O-NZ 2.77Å; F185-K190 HydrophobicContact CB-CB 4.03Å; H186-K190 PolarHBondContact O-N 3.37Å; H186-K190 VanDerWaalsContact O-N 3.09Å; K190-E192 VanDerWaalsContact C-N 3.33Å; K190-E192 PolarHBondContact O-N 2.99Å; K190-H193 PolarHBondContact O-N 3.23Å; K190-E194 VanDerWaalsContact CE-OE1 3.29Å; K190-E194 WeakPolarHBondContact CE-OE1 3.3Å; K190-E194 HydrophobicContact CG-CG 4.38Å; K190-E194 IonicContact NZ-OE1 2.61Å; K190-E194 PolarHBondContact NZ-OE1 3.03Å; K190-E194 VanDerWaalsContact O-CG 3.31Å; K190-E194 WeakPolarHBondContact O-CG 3.44Å; K190-E194 PolarHBondContact O-N 2.96Å
191	S	92.3	Very high	93.1	Very high	83 Å²	83	60.4 Å²	60.4	58%	0.58	33%	0.333	S	S	*	.	H	α-helix	trans	-67.3	-33.3	-177.7	58.2	0	0	0	0	113.4	S189 A195	S189-S191 VanDerWaalsContact C-N 3.34Å; S189-S191 PolarHBondContact O-N 2.85Å; S191-A195 PolarHBondContact O-N 2.9Å
192	E	94.1	Very high	93	Very high	149 Å²	149	60.8 Å²	60.8	70%	0.696	33%	0.334	S	S	*	.	H	α-helix	trans	-66.3	-48.3	177.3	-177.4	178.7	-173.1	0	0	110.4	S189 K190 E194 A195	S189-E192 PolarHBondContact O-N 2.91Å; K190-E192 VanDerWaalsContact C-N 3.33Å; K190-E192 PolarHBondContact O-N 2.99Å; E192-E194 PolarHBondContact O-N 3.5Å; E192-A195 PolarHBondContact O-N 2.92Å
193	H	94.6	Very high	92.9	Very high	41 Å²	41	59.8 Å²	59.8	19%	0.19	32%	0.323	C	S	.	.	H	α-helix	trans	-59.2	-48.5	174.3	166.5	80.7	0	0	0	111.7	C174 C181 F185 S189 K190 A195 A196 C197	C174-H193 PolarHBondContact SG-CD2 2.83Å; C174-H193 PolarHBondContact SG-NE2 2.62Å; C181-H193 PolarHBondContact SG-NE2 3.49Å; F185-H193 HydrophobicContact CD1-CB 4.4Å; F185-H193 HydrophobicContact CD2-CB 4.15Å; F185-H193 AromaticContact CD2-CD2 3.98Å; F185-H193 HydrophobicContact CE1-CB 3.96Å; F185-H193 HydrophobicContact CE2-CB 3.68Å; F185-H193 AromaticContact CE2-CD2 3.23Å; F185-H193 WeakPolarHBondContact CE2-CD2 3.23Å; F185-H193 AromaticContact CE2-CE1 3.81Å; F185-H193 AromaticContact CE2-CG 3.19Å; F185-H193 AromaticContact CE2-ND1 3.59Å; F185-H193 AromaticContact CE2-NE2 3.64Å; F185-H193 HydrophobicContact CG-CB 4.49Å; F185-H193 HydrophobicContact CZ-CB 3.58Å; F185-H193 AromaticContact CZ-CD2 3.79Å; F185-H193 AromaticContact CZ-CE1 3.82Å; F185-H193 AromaticContact CZ-CG 3.25Å; F185-H193 AromaticContact CZ-ND1 3.3Å; F185-H193 VanDerWaalsContact CZ-ND1 3.3Å; F185-H193 WeakPolarHBondContact CZ-ND1 3.18Å; S189-H193 PolarHBondContact O-N 2.98Å; K190-H193 PolarHBondContact O-N 3.23Å; H193-A195 PolarHBondContact O-N 2.94Å; H193-A196 CarbonylContact O-C 3.37Å; H193-A196 PolarHBondContact O-N 2.86Å; H193-C197 PolarHBondContact NE2-SG 2.8Å; H193-C197 VanDerWaalsContact NE2-SG 3.43Å; H193-C197 WeakPolarHBondContact O-CA 3.25Å; H193-C197 WeakPolarHBondContact O-CB 3.44Å; H193-C197 PolarHBondContact O-N 2.82Å
194	E	93.7	Very high	92.9	Very high	16 Å²	16	56 Å²	56	8%	0.075	31%	0.307	C	S	.	.	H	α-helix	trans	-62.2	-27.8	-177.1	-75.5	179.6	174.2	0	0	114	K175 Y176 K190 E192 A196	K175-E194 WeakPolarHBondContact CB-OE1 3.43Å; K175-E194 VanDerWaalsContact CD-CD 3.48Å; K175-E194 HydrophobicContact CD-CG 4.28Å; K175-E194 VanDerWaalsContact CD-OE2 3.28Å; K175-E194 WeakPolarHBondContact CD-OE2 3.38Å; K175-E194 WeakPolarHBondContact CE-OE2 3.25Å; K175-E194 HydrophobicContact CG-CG 4.08Å; K175-E194 WeakPolarHBondContact CG-OE1 3.29Å; K175-E194 PolarHBondContact N-OE1 2.88Å; K175-E194 VanDerWaalsContact N-OE1 3.09Å; K175-E194 IonicContact NZ-OE2 2.79Å; K175-E194 PolarHBondContact NZ-OE2 3.4Å; Y176-E194 HydrophobicContact CE2-CB 4.25Å; Y176-E194 HydrophobicContact CE2-CG 4.47Å; Y176-E194 WeakPolarHBondContact CE2-O 3.36Å; K190-E194 VanDerWaalsContact CE-OE1 3.29Å; K190-E194 WeakPolarHBondContact CE-OE1 3.3Å; K190-E194 HydrophobicContact CG-CG 4.38Å; K190-E194 IonicContact NZ-OE1 2.61Å; K190-E194 PolarHBondContact NZ-OE1 3.03Å; K190-E194 VanDerWaalsContact O-CG 3.31Å; K190-E194 WeakPolarHBondContact O-CG 3.44Å; K190-E194 PolarHBondContact O-N 2.96Å; E192-E194 PolarHBondContact O-N 3.5Å; E194-A196 VanDerWaalsContact C-N 3.26Å; E194-A196 PolarHBondContact O-N 2.9Å
195	A	89.3	Confident	92.8	Very high	73 Å²	73	53.3 Å²	53.3	60%	0.603	29%	0.291	S	S	*	.	H	α-helix	trans	-68.4	-27.6	174.5	0	0	0	0	0	112.3	S191 E192 H193	S191-A195 PolarHBondContact O-N 2.9Å; E192-A195 PolarHBondContact O-N 2.92Å; H193-A195 PolarHBondContact O-N 2.94Å
196	A	88.4	Confident	92.5	Very high	51 Å²	51	51.7 Å²	51.7	42%	0.421	29%	0.285	S	S	.	.	H	α-helix	trans	-115.2	3.4	-175.5	0	0	0	0	0	114.5	H193 E194 E198 R290	H193-A196 CarbonylContact O-C 3.37Å; H193-A196 PolarHBondContact O-N 2.86Å; E194-A196 VanDerWaalsContact C-N 3.26Å; E194-A196 PolarHBondContact O-N 2.9Å; A196-E198 PolarHBondContact O-N 3.08Å; A196-R290 PolarHBondContact O-NH1 2.98Å
197	C	92.1	Very high	91.9	Very high	4 Å²	4	49.7 Å²	49.7	3%	0.027	28%	0.277	C	S	.	.			trans	-66.9	123.7	-172.9	177.6	0	0	0	0	111.6	Y176 H193 Y199 R200 H319	Y176-C197 HydrophobicContact CD2-CB 3.84Å; Y176-C197 HydrophobicContact CE2-CB 4.21Å; H193-C197 PolarHBondContact NE2-SG 2.8Å; H193-C197 VanDerWaalsContact NE2-SG 3.43Å; H193-C197 WeakPolarHBondContact O-CA 3.25Å; H193-C197 WeakPolarHBondContact O-CB 3.44Å; H193-C197 PolarHBondContact O-N 2.82Å; C197-Y199 PolarHBondContact O-N 3.1Å; C197-Y199 VanDerWaalsContact O-N 3.08Å; C197-Y199 PolarHBondContact SG-N 3.04Å; C197-R200 WeakPolarHBondContact O-CB 3.35Å; C197-R200 PolarHBondContact O-N 2.84Å; C197-H319 PolarHBondContact O-CE1 2.65Å; C197-H319 PolarHBondContact O-NE2 3.22Å; C197-H319 VanDerWaalsContact O-NE2 3.16Å
198	E	89.1	Confident	90.7	Very high	80 Å²	80	48.2 Å²	48.2	37%	0.374	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-24.8	178.9	-66.3	-70.6	164	0	0	114.1	A196 R200 R290	A196-E198 PolarHBondContact O-N 3.08Å; E198-R200 VanDerWaalsContact C-N 3.32Å; E198-R290 WeakPolarHBondContact OE1-CD 3.43Å; E198-R290 IonicContact OE1-CZ 3.4Å; E198-R290 IonicContact OE1-NE 3.61Å; E198-R290 IonicContact OE1-NH1 2.65Å; E198-R290 PolarHBondContact OE1-NH1 3.49Å
199	Y	90.9	Very high	89.3	Confident	107 Å²	107	46.2 Å²	46.2	42%	0.42	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	0.6	179.8	-60.8	-85.5	0	0	0	113.5	S179 G180 C181 C197	S179-Y199 WeakPolarHBondContact O-CD1 3.42Å; G180-Y199 WeakPolarHBondContact O-CE1 3.4Å; G180-Y199 VanDerWaalsContact O-CZ 3.31Å; C181-Y199 VanDerWaalsContact CA-CD2 3.4Å; C181-Y199 HydrophobicContact CB-CD2 3.48Å; C181-Y199 VanDerWaalsContact CB-CD2 3.48Å; C181-Y199 HydrophobicContact CB-CE2 4.16Å; C181-Y199 HydrophobicContact CB-CG 3.89Å; C197-Y199 PolarHBondContact O-N 3.1Å; C197-Y199 VanDerWaalsContact O-N 3.08Å; C197-Y199 PolarHBondContact SG-N 3.04Å
200	R	92.4	Very high	88.7	Confident	45 Å²	45	49.6 Å²	49.6	17%	0.17	30%	0.298	C	S	.	.	S	Bend	trans	-63.4	137.7	174.3	175.1	171.2	85.8	83.8	-1.2	110.3	Y176 C197 E198 D203 H319	Y176-R200 HydrophobicContact CD2-CB 3.97Å; Y176-R200 HydrophobicContact CE1-CB 4.21Å; Y176-R200 HydrophobicContact CE1-CG 4.1Å; Y176-R200 HydrophobicContact CE2-CB 3.52Å; Y176-R200 HydrophobicContact CE2-CG 3.82Å; Y176-R200 HydrophobicContact CG-CB 4.47Å; Y176-R200 VanDerWaalsContact CZ-CG 3.46Å; Y176-R200 WeakPolarHBondContact OH-CD 3.45Å; Y176-R200 VanDerWaalsContact OH-CG 3.25Å; Y176-R200 WeakPolarHBondContact OH-CG 3.45Å; C197-R200 WeakPolarHBondContact O-CB 3.35Å; C197-R200 PolarHBondContact O-N 2.84Å; E198-R200 VanDerWaalsContact C-N 3.32Å; R200-D203 IonicContact CZ-OD2 3.51Å; R200-D203 IonicContact NH1-OD2 3.47Å; R200-D203 PolarHBondContact NH1-OD2 3.04Å; R200-D203 IonicContact NH2-OD2 2.73Å; R200-D203 PolarHBondContact NH2-OD2 3.02Å; R200-H319 PolarHBondContact NH2-O 2.92Å
201	P	93.1	Very high	88.6	Confident	44 Å²	44	51.4 Å²	51.4	29%	0.286	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-55.8	141.9	170.4	-25.2	34	0	0	0	112	Y176 G215	Y176-P201 HydrophobicContact CE1-CG 4.34Å; P201-G215 CarbonylContact C-O 3.59Å; P201-G215 WeakPolarHBondContact CA-O 3.39Å
202	Y	93	Very high	88.6	Confident	15 Å²	15	55.1 Å²	55.1	6%	0.059	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	134.3	178.1	-69.6	-95.1	0	0	0	110.5	L214 G215 L217 V220 I318 H319	Y202-L214 WeakPolarHBondContact O-CA 3.45Å; Y202-G215 PolarHBondContact N-O 3.25Å; Y202-G215 PolarHBondContact O-N 3.22Å; Y202-G215 VanDerWaalsContact O-N 3.07Å; Y202-L217 HydrophobicContact CD2-CB 4.07Å; Y202-L217 HydrophobicContact CE1-CD1 4.26Å; Y202-L217 HydrophobicContact CE2-CB 3.63Å; Y202-L217 HydrophobicContact CE2-CD1 4.19Å; Y202-L217 HydrophobicContact CE2-CG 4.38Å; Y202-V220 HydrophobicContact CG-CG2 4.35Å; Y202-I318 HydrophobicContact CD1-CB 4.44Å; Y202-I318 HydrophobicContact CD1-CD1 3.46Å; Y202-I318 VanDerWaalsContact CD1-CD1 3.46Å; Y202-I318 HydrophobicContact CD1-CG1 3.59Å; Y202-I318 HydrophobicContact CE1-CD1 3.83Å; Y202-I318 HydrophobicContact CE1-CG1 3.63Å; Y202-I318 HydrophobicContact CG-CD1 4.17Å; Y202-H319 HydrophobicContact CD1-CB 4.45Å; Y202-H319 HydrophobicContact CE1-CB 3.78Å; Y202-H319 AromaticContact CE1-ND1 3.89Å
203	D	92.2	Very high	88.6	Confident	77 Å²	77	50.7 Å²	50.7	41%	0.412	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	157.2	164.3	-57.8	-76.7	0	0	0	110.1	R200 P205 L214	R200-D203 IonicContact CZ-OD2 3.51Å; R200-D203 IonicContact NH1-OD2 3.47Å; R200-D203 PolarHBondContact NH1-OD2 3.04Å; R200-D203 IonicContact NH2-OD2 2.73Å; R200-D203 PolarHBondContact NH2-OD2 3.02Å; D203-P205 WeakPolarHBondContact O-CD 3.32Å; D203-L214 HydrophobicContact CB-CD2 4.44Å; D203-L214 WeakPolarHBondContact OD1-CD2 3.26Å
204	C	94.5	Very high	88.5	Confident	18 Å²	18	53.7 Å²	53.7	12%	0.122	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-55.9	123.2	169	176.7	0	0	0	0	110	C206 C211 W213 H223 H228	C204-C206 PolarHBondContact O-N 3.3Å; C204-C211 HydrophobicContact CB-CB 3.94Å; C204-W213 HydrophobicContact CB-CB 4.34Å; C204-W213 HydrophobicContact CB-CE3 4.35Å; C204-W213 PolarHBondContact N-O 2.73Å; C204-W213 VanDerWaalsContact N-O 3.15Å; C204-H223 PolarHBondContact SG-NE2 3.08Å; C204-H228 PolarHBondContact SG-NE2 2.78Å
205	P	93.1	Very high	88.5	Confident	15 Å²	15	53.4 Å²	53.4	10%	0.097	31%	0.311	C	S	.	.			trans	-78.3	-5.9	-175.6	30.8	-35.4	0	0	0	113.9	D203 P207 V220 L224 M266 I287 I318	D203-P205 WeakPolarHBondContact O-CD 3.32Å; P205-P207 WeakPolarHBondContact O-CD 3.44Å; P205-V220 HydrophobicContact CG-CG1 3.84Å; P205-L224 HydrophobicContact CG-CD1 3.94Å; P205-L224 HydrophobicContact CG-CD2 4.06Å; P205-L224 HydrophobicContact CG-CG 4.36Å; P205-M266 HydrophobicContact CB-CE 4.13Å; P205-M266 HydrophobicContact CB-SD 4.19Å; P205-M266 HydrophobicContact CG-CE 3.84Å; P205-M266 VanDerWaalsContact O-SD 3.38Å; P205-I287 HydrophobicContact CG-CD1 4.08Å; P205-I318 HydrophobicContact CB-CB 4.16Å; P205-I318 HydrophobicContact CB-CG2 3.55Å; P205-I318 HydrophobicContact CG-CG2 4.22Å
206	C	88.4	Confident	88.7	Confident	11 Å²	11	55.4 Å²	55.4	7%	0.074	31%	0.308	C	S	.	.			trans	-69.2	117.1	-177.1	-170.4	0	0	0	0	111.1	C204 A209 L224	C204-C206 PolarHBondContact O-N 3.3Å; C206-A209 HydrophobicContact CB-CB 4.18Å; C206-L224 HydrophobicContact CB-CD2 4.36Å
207	P	82.2	Confident	88.9	Confident	11 Å²	11	55.2 Å²	55.2	7%	0.071	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	152.9	176.6	31.4	-36.7	0	0	0	111.1	P205 A209 D253 V255 V268	P205-P207 WeakPolarHBondContact O-CD 3.44Å; P207-A209 PolarHBondContact O-N 3.41Å; P207-D253 HydrophobicContact CG-CB 4.47Å; P207-V255 HydrophobicContact CG-CG2 3.35Å; P207-V268 HydrophobicContact CB-CG1 4.48Å; P207-V268 HydrophobicContact CG-CG1 3.95Å; P207-V268 HydrophobicContact CG-CG2 4.14Å
208	G	69.4	Low	89	Confident	38 Å²	38	63.2 Å²	63.2	39%	0.392	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.7	-8	178.9	0	0	0	0	0	117.4	H43 D253	H43-G208 WeakPolarHBondContact NE2-CA 3.46Å; G208-D253 PolarHBondContact N-OD2 3.17Å
209	A	65.2	Low	89.3	Confident	38 Å²	38	63.7 Å²	63.7	31%	0.314	34%	0.339	S	S	.	.			trans	-76.8	135.5	176	0	0	0	0	0	110.7	C206 P207 C211	C206-A209 HydrophobicContact CB-CB 4.18Å; P207-A209 PolarHBondContact O-N 3.41Å; A209-C211 HydrophobicContact CB-CB 3.93Å; A209-C211 PolarHBondContact O-N 2.96Å
210	S	81.8	Confident	89.5	Confident	122 Å²	122	58.6 Å²	58.6	85%	0.853	32%	0.319	S	S	*	.			trans	-70.7	23.7	167.5	56.5	0	0	0	0	113	K212	S210-K212 PolarHBondContact O-N 2.86Å
211	C	90.8	Very high	89.6	Confident	42 Å²	42	58.9 Å²	58.9	28%	0.284	32%	0.323	S	S	.	.			trans	-75.9	118.4	-174	-166.5	0	0	0	0	110.4	C204 A209 H223	C204-C211 HydrophobicContact CB-CB 3.94Å; A209-C211 HydrophobicContact CB-CB 3.93Å; A209-C211 PolarHBondContact O-N 2.96Å; C211-H223 PolarHBondContact SG-CE1 3.44Å; C211-H223 PolarHBondContact SG-NE2 3.4Å
212	K	91.6	Very high	89.7	Confident	160 Å²	160	60 Å²	60	70%	0.696	33%	0.33	S	S	*	.			trans	-101.4	21.9	178.4	-58.4	-176.9	-178.3	176.8	0	112.4	P55 S210	P55-K212 HydrophobicContact CG-CD 4.47Å; S210-K212 PolarHBondContact O-N 2.86Å
213	W	94.8	Very high	89.8	Confident	57 Å²	57	59.7 Å²	59.7	22%	0.216	33%	0.329	C	S	.	.			trans	-69.4	139.1	-179.6	178.1	89	0	0	0	110.2	C204 Q219 V220 H223	C204-W213 HydrophobicContact CB-CB 4.34Å; C204-W213 HydrophobicContact CB-CE3 4.35Å; C204-W213 PolarHBondContact N-O 2.73Å; C204-W213 VanDerWaalsContact N-O 3.15Å; W213-Q219 HydrophobicContact CH2-CB 4.08Å; W213-Q219 HydrophobicContact CZ2-CB 3.67Å; W213-V220 HydrophobicContact CH2-CB 4.32Å; W213-V220 HydrophobicContact CH2-CG2 3.77Å; W213-V220 HydrophobicContact CZ3-CB 4.48Å; W213-V220 HydrophobicContact CZ3-CG2 3.88Å; W213-H223 WeakPolarHBondContact CB-CE1 3.15Å; W213-H223 AromaticContact CD1-CE1 3.88Å; W213-H223 AromaticContact CD1-CG 3.97Å; W213-H223 AromaticContact CD1-ND1 3.37Å; W213-H223 HydrophobicContact CD2-CB 3.96Å; W213-H223 AromaticContact CD2-CD2 3.82Å; W213-H223 AromaticContact CD2-CG 3.5Å; W213-H223 VanDerWaalsContact CD2-CG 3.5Å; W213-H223 AromaticContact CD2-ND1 3.65Å; W213-H223 AromaticContact CE2-CG 3.75Å; W213-H223 AromaticContact CE2-ND1 3.96Å; W213-H223 HydrophobicContact CE3-CB 4.37Å; W213-H223 AromaticContact CE3-CD2 3.86Å; W213-H223 AromaticContact CE3-CG 3.94Å; W213-H223 HydrophobicContact CG-CB 4.47Å; W213-H223 AromaticContact CG-CE1 3.44Å; W213-H223 VanDerWaalsContact CG-CE1 3.44Å; W213-H223 AromaticContact CG-CG 3.67Å; W213-H223 AromaticContact CG-ND1 3.27Å; W213-H223 VanDerWaalsContact CG-ND1 3.27Å; W213-H223 AromaticContact CG-NE2 3.92Å; W213-H223 HydrophobicContact CH2-CB 4.34Å; W213-H223 HydrophobicContact CZ2-CB 3.91Å; W213-H223 AromaticContact NE1-CG 3.99Å; W213-H223 AromaticContact NE1-ND1 3.76Å
214	L	93.5	Very high	89.9	Confident	103 Å²	103	56.3 Å²	56.3	54%	0.539	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	137.9	176.4	-69.9	171.3	0	0	0	107.7	Y202 D203	Y202-L214 WeakPolarHBondContact O-CA 3.45Å; D203-L214 HydrophobicContact CB-CD2 4.44Å; D203-L214 WeakPolarHBondContact OD1-CD2 3.26Å
215	G	93.6	Very high	89.8	Confident	10 Å²	10	59.9 Å²	59.9	10%	0.103	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-172.1	-176.3	177.2	0	0	0	0	0	114.4	P201 Y202	P201-G215 CarbonylContact C-O 3.59Å; P201-G215 WeakPolarHBondContact CA-O 3.39Å; Y202-G215 PolarHBondContact N-O 3.25Å; Y202-G215 PolarHBondContact O-N 3.22Å; Y202-G215 VanDerWaalsContact O-N 3.07Å
216	E	92.6	Very high	89.8	Confident	116 Å²	116	65.2 Å²	65.2	54%	0.542	36%	0.355	S	S	.	.			trans	-77.7	160	175.2	-65.4	176.9	176	0	0	111	E218 Q219 V220	E216-E218 VanDerWaalsContact C-N 3.26Å; E216-E218 PolarHBondContact O-N 3.18Å; E216-Q219 HydrophobicContact CB-CG 4.38Å; E216-Q219 VanDerWaalsContact N-OE1 3.16Å; E216-Q219 WeakPolarHBondContact O-CB 3.36Å; E216-Q219 PolarHBondContact O-N 3.35Å; E216-V220 PolarHBondContact O-N 2.82Å
217	L	92.8	Very high	90.1	Very high	46 Å²	46	71.2 Å²	71.2	24%	0.241	38%	0.382	C	S	.	.	H	α-helix	trans	-53.3	-43.1	-176.6	-180	57.8	0	0	0	112.7	Y202 Q219 V220 I287 T289 I318	Y202-L217 HydrophobicContact CD2-CB 4.07Å; Y202-L217 HydrophobicContact CE1-CD1 4.26Å; Y202-L217 HydrophobicContact CE2-CB 3.63Å; Y202-L217 HydrophobicContact CE2-CD1 4.19Å; Y202-L217 HydrophobicContact CE2-CG 4.38Å; L217-Q219 PolarHBondContact O-N 3.16Å; L217-V220 WeakPolarHBondContact O-CB 3.43Å; L217-V220 WeakPolarHBondContact O-CG2 3.31Å; L217-V220 PolarHBondContact O-N 2.73Å; L217-V220 VanDerWaalsContact O-N 3.16Å; L217-I287 HydrophobicContact CD1-CG2 4.37Å; L217-T289 HydrophobicContact CD2-CG2 4.14Å; L217-I318 HydrophobicContact CD1-CD1 3.91Å
218	E	93.6	Very high	90.5	Very high	172 Å²	172	71.9 Å²	71.9	80%	0.804	38%	0.384	S	S	*	.	H	α-helix	trans	-64	-22.2	-179.2	-60.7	-176.5	177.7	0	0	112.9	E216 P222	E216-E218 VanDerWaalsContact C-N 3.26Å; E216-E218 PolarHBondContact O-N 3.18Å; E218-P222 VanDerWaalsContact O-CD 3.25Å; E218-P222 WeakPolarHBondContact O-CD 3.36Å
219	Q	95.2	Very high	91.4	Very high	90 Å²	90	78.6 Å²	78.6	42%	0.421	40%	0.402	S	S	.	.	H	α-helix	trans	-89.8	-12.9	-178.5	-56.9	170.5	-9.3	0	0	112.5	W213 E216 L217 P222 H223	W213-Q219 HydrophobicContact CH2-CB 4.08Å; W213-Q219 HydrophobicContact CZ2-CB 3.67Å; E216-Q219 HydrophobicContact CB-CG 4.38Å; E216-Q219 VanDerWaalsContact N-OE1 3.16Å; E216-Q219 WeakPolarHBondContact O-CB 3.36Å; E216-Q219 PolarHBondContact O-N 3.35Å; L217-Q219 PolarHBondContact O-N 3.16Å; Q219-P222 WeakPolarHBondContact O-CD 3.5Å; Q219-H223 VanDerWaalsContact O-CB 3.32Å; Q219-H223 WeakPolarHBondContact O-CB 3.28Å; Q219-H223 PolarHBondContact O-N 3.08Å
220	V	95.4	Very high	92.5	Very high	0 Å²	0	81.1 Å²	81.1	0%	0	42%	0.418	C	S	.	.	H	α-helix	trans	-63.9	-51.5	-176.6	178.5	0	0	0	0	111.8	Y202 P205 W213 E216 L217 H223 L224 I287 I318	Y202-V220 HydrophobicContact CG-CG2 4.35Å; P205-V220 HydrophobicContact CG-CG1 3.84Å; W213-V220 HydrophobicContact CH2-CB 4.32Å; W213-V220 HydrophobicContact CH2-CG2 3.77Å; W213-V220 HydrophobicContact CZ3-CB 4.48Å; W213-V220 HydrophobicContact CZ3-CG2 3.88Å; E216-V220 PolarHBondContact O-N 2.82Å; L217-V220 WeakPolarHBondContact O-CB 3.43Å; L217-V220 WeakPolarHBondContact O-CG2 3.31Å; L217-V220 PolarHBondContact O-N 2.73Å; L217-V220 VanDerWaalsContact O-N 3.16Å; V220-H223 WeakPolarHBondContact O-CB 3.35Å; V220-H223 PolarHBondContact O-N 3.48Å; V220-L224 HydrophobicContact CG1-CD1 4.2Å; V220-L224 HydrophobicContact CG1-CG 4.47Å; V220-L224 WeakPolarHBondContact O-CG 3.45Å; V220-L224 PolarHBondContact O-N 3.41Å; V220-I287 HydrophobicContact CB-CG2 4.12Å; V220-I287 HydrophobicContact CG1-CG2 3.86Å; V220-I318 HydrophobicContact CB-CD1 4.42Å; V220-I318 HydrophobicContact CG1-CD1 3.99Å; V220-I318 HydrophobicContact CG2-CD1 3.98Å
221	M	94.8	Very high	92.9	Very high	52 Å²	52	76.4 Å²	76.4	26%	0.256	38%	0.383	S	S	.	.	H	α-helix	trans	-62.7	-47.3	179.7	-74.9	-57.6	-59.8	0	0	112.4	H223 L224 V225 M257 I287	M221-H223 VanDerWaalsContact C-N 3.28Å; M221-H223 PolarHBondContact O-N 3.16Å; M221-L224 PolarHBondContact O-N 3.02Å; M221-L224 HydrophobicContact SD-CD1 4.22Å; M221-V225 WeakPolarHBondContact O-CG2 3.44Å; M221-V225 PolarHBondContact O-N 2.95Å; M221-M257 HydrophobicContact CE-CE 4.36Å; M221-M257 HydrophobicContact SD-CE 4.02Å; M221-I287 HydrophobicContact CG-CG2 3.99Å; M221-I287 HydrophobicContact SD-CB 4.32Å; M221-I287 HydrophobicContact SD-CG1 3.89Å; M221-I287 HydrophobicContact SD-CG2 4.08Å
222	P	95.6	Very high	93	Very high	66 Å²	66	76 Å²	76	43%	0.429	38%	0.379	S	S	.	.	H	α-helix	trans	-52.6	-45.3	169.8	-28.3	34.5	0	0	0	112.7	E218 Q219 L224 V225 H226	E218-P222 VanDerWaalsContact O-CD 3.25Å; E218-P222 WeakPolarHBondContact O-CD 3.36Å; Q219-P222 WeakPolarHBondContact O-CD 3.5Å; P222-L224 PolarHBondContact O-N 3Å; P222-V225 PolarHBondContact O-N 3.48Å; P222-H226 PolarHBondContact O-N 2.96Å; P222-H226 VanDerWaalsContact O-N 3.08Å; P222-H226 PolarHBondContact O-ND1 3.47Å
223	H	95.9	Very high	93.1	Very high	9 Å²	9	71.7 Å²	71.7	4%	0.042	37%	0.366	C	S	.	.	H	α-helix	trans	-58.2	-49.4	177.5	169.3	71.4	0	0	0	112.3	C204 C211 W213 Q219 V220 M221 V225 H226 H227 H228	C204-H223 PolarHBondContact SG-NE2 3.08Å; C211-H223 PolarHBondContact SG-CE1 3.44Å; C211-H223 PolarHBondContact SG-NE2 3.4Å; W213-H223 WeakPolarHBondContact CB-CE1 3.15Å; W213-H223 AromaticContact CD1-CE1 3.88Å; W213-H223 AromaticContact CD1-CG 3.97Å; W213-H223 AromaticContact CD1-ND1 3.37Å; W213-H223 HydrophobicContact CD2-CB 3.96Å; W213-H223 AromaticContact CD2-CD2 3.82Å; W213-H223 AromaticContact CD2-CG 3.5Å; W213-H223 VanDerWaalsContact CD2-CG 3.5Å; W213-H223 AromaticContact CD2-ND1 3.65Å; W213-H223 AromaticContact CE2-CG 3.75Å; W213-H223 AromaticContact CE2-ND1 3.96Å; W213-H223 HydrophobicContact CE3-CB 4.37Å; W213-H223 AromaticContact CE3-CD2 3.86Å; W213-H223 AromaticContact CE3-CG 3.94Å; W213-H223 HydrophobicContact CG-CB 4.47Å; W213-H223 AromaticContact CG-CE1 3.44Å; W213-H223 VanDerWaalsContact CG-CE1 3.44Å; W213-H223 AromaticContact CG-CG 3.67Å; W213-H223 AromaticContact CG-ND1 3.27Å; W213-H223 VanDerWaalsContact CG-ND1 3.27Å; W213-H223 AromaticContact CG-NE2 3.92Å; W213-H223 HydrophobicContact CH2-CB 4.34Å; W213-H223 HydrophobicContact CZ2-CB 3.91Å; W213-H223 AromaticContact NE1-CG 3.99Å; W213-H223 AromaticContact NE1-ND1 3.76Å; Q219-H223 VanDerWaalsContact O-CB 3.32Å; Q219-H223 WeakPolarHBondContact O-CB 3.28Å; Q219-H223 PolarHBondContact O-N 3.08Å; V220-H223 WeakPolarHBondContact O-CB 3.35Å; V220-H223 PolarHBondContact O-N 3.48Å; M221-H223 VanDerWaalsContact C-N 3.28Å; M221-H223 PolarHBondContact O-N 3.16Å; H223-V225 PolarHBondContact O-N 3.38Å; H223-H226 PolarHBondContact O-N 3.03Å; H223-H227 AromaticContact CE1-CD2 3.82Å; H223-H227 AromaticContact CE1-CG 3.92Å; H223-H227 AromaticContact ND1-CD2 3.34Å; H223-H227 PolarHBondContact ND1-CD2 3.31Å; H223-H227 VanDerWaalsContact ND1-CD2 3.34Å; H223-H227 AromaticContact ND1-CG 3.9Å; H223-H227 WeakPolarHBondContact O-CB 3.21Å; H223-H227 PolarHBondContact O-N 3.33Å; H223-H228 AromaticContact CE1-NE2 3.83Å; H223-H228 AromaticContact NE2-CD2 3.52Å; H223-H228 AromaticContact NE2-NE2 3.1Å; H223-H228 PolarHBondContact NE2-NE2 3.42Å
224	L	93.9	Very high	93.2	Very high	7 Å²	7	70.1 Å²	70.1	4%	0.037	36%	0.362	C	S	.	.	H	α-helix	trans	-58.9	-46.8	179.6	-69.3	175.7	0	0	0	112.2	P205 C206 V220 M221 P222 H226 H228 I231 M257 M266 I287	P205-L224 HydrophobicContact CG-CD1 3.94Å; P205-L224 HydrophobicContact CG-CD2 4.06Å; P205-L224 HydrophobicContact CG-CG 4.36Å; C206-L224 HydrophobicContact CB-CD2 4.36Å; V220-L224 HydrophobicContact CG1-CD1 4.2Å; V220-L224 HydrophobicContact CG1-CG 4.47Å; V220-L224 WeakPolarHBondContact O-CG 3.45Å; V220-L224 PolarHBondContact O-N 3.41Å; M221-L224 PolarHBondContact O-N 3.02Å; M221-L224 HydrophobicContact SD-CD1 4.22Å; P222-L224 PolarHBondContact O-N 3Å; L224-H226 VanDerWaalsContact C-N 3.34Å; L224-H226 PolarHBondContact O-N 3.2Å; L224-H228 CarbonylContact O-C 3.59Å; L224-H228 VanDerWaalsContact O-CA 3.3Å; L224-H228 WeakPolarHBondContact O-CA 3.18Å; L224-H228 WeakPolarHBondContact O-CB 3.49Å; L224-H228 PolarHBondContact O-N 2.8Å; L224-I231 HydrophobicContact CD2-CD1 4.26Å; L224-M257 HydrophobicContact CD1-SD 4.45Å; L224-M266 HydrophobicContact CD1-CE 3.76Å; L224-M266 HydrophobicContact CD2-CE 4.1Å; L224-I287 HydrophobicContact CD1-CD1 4.28Å
225	V	92.4	Very high	93.3	Very high	92 Å²	92	71.9 Å²	71.9	56%	0.558	37%	0.368	S	S	*	.	H	α-helix	trans	-63.8	-38.9	-179.8	173.5	0	0	0	0	112.1	M221 P222 H223	M221-V225 WeakPolarHBondContact O-CG2 3.44Å; M221-V225 PolarHBondContact O-N 2.95Å; P222-V225 PolarHBondContact O-N 3.48Å; H223-V225 PolarHBondContact O-N 3.38Å
226	H	93.4	Very high	93.5	Very high	127 Å²	127	72.9 Å²	72.9	59%	0.588	38%	0.377	S	S	*	.	H	α-helix	trans	-81.7	-39.6	-175.8	-71.4	89.1	0	0	0	113.3	P222 H223 L224 K229	P222-H226 PolarHBondContact O-N 2.96Å; P222-H226 VanDerWaalsContact O-N 3.08Å; P222-H226 PolarHBondContact O-ND1 3.47Å; H223-H226 PolarHBondContact O-N 3.03Å; L224-H226 VanDerWaalsContact C-N 3.34Å; L224-H226 PolarHBondContact O-N 3.2Å; H226-K229 WeakPolarHBondContact O-CE 3.31Å
227	H	93.1	Very high	93.7	Very high	137 Å²	137	72.3 Å²	72.3	63%	0.634	38%	0.375	S	S	*	.	H	α-helix	trans	-103.8	-20.5	-171.1	-65.9	-79.2	0	0	0	114.1	H223	H223-H227 AromaticContact CE1-CD2 3.82Å; H223-H227 AromaticContact CE1-CG 3.92Å; H223-H227 AromaticContact ND1-CD2 3.34Å; H223-H227 PolarHBondContact ND1-CD2 3.31Å; H223-H227 VanDerWaalsContact ND1-CD2 3.34Å; H223-H227 AromaticContact ND1-CG 3.9Å; H223-H227 WeakPolarHBondContact O-CB 3.21Å; H223-H227 PolarHBondContact O-N 3.33Å
228	H	92.2	Very high	93.9	Very high	25 Å²	25	73.7 Å²	73.7	12%	0.116	38%	0.382	C	S	.	.			trans	-122.8	53.8	-177.5	-57.3	-88.7	0	0	0	111.5	C204 H223 L224 S230 I231	C204-H228 PolarHBondContact SG-NE2 2.78Å; H223-H228 AromaticContact CE1-NE2 3.83Å; H223-H228 AromaticContact NE2-CD2 3.52Å; H223-H228 AromaticContact NE2-NE2 3.1Å; H223-H228 PolarHBondContact NE2-NE2 3.42Å; L224-H228 CarbonylContact O-C 3.59Å; L224-H228 VanDerWaalsContact O-CA 3.3Å; L224-H228 WeakPolarHBondContact O-CA 3.18Å; L224-H228 WeakPolarHBondContact O-CB 3.49Å; L224-H228 PolarHBondContact O-N 2.8Å; H228-S230 PolarHBondContact O-N 2.85Å; H228-I231 HydrophobicContact CB-CD1 3.56Å; H228-I231 HydrophobicContact CB-CG1 3.99Å; H228-I231 WeakPolarHBondContact O-CG1 3.45Å; H228-I231 PolarHBondContact O-N 3.32Å
229	K	87.5	Confident	94.1	Very high	179 Å²	179	66.1 Å²	66.1	78%	0.778	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-17.2	-174.2	-62.9	-178.1	-179.4	-178.9	0	115.2	H226 I231	H226-K229 WeakPolarHBondContact O-CE 3.31Å; K229-I231 VanDerWaalsContact C-N 3.29Å
230	S	87.7	Confident	94.2	Very high	92 Å²	92	64.3 Å²	64.3	64%	0.643	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.1	-17	176.8	52.9	0	0	0	0	113.3	H228 T232	H228-S230 PolarHBondContact O-N 2.85Å; S230-T232 PolarHBondContact O-N 3.39Å
231	I	90.6	Very high	94.2	Very high	22 Å²	22	64.5 Å²	64.5	11%	0.113	34%	0.343	C	S	.	.			trans	-75.2	112.4	-179	-55.5	176.5	0	0	0	109	L224 H228 K229 V255 M257	L224-I231 HydrophobicContact CD2-CD1 4.26Å; H228-I231 HydrophobicContact CB-CD1 3.56Å; H228-I231 HydrophobicContact CB-CG1 3.99Å; H228-I231 WeakPolarHBondContact O-CG1 3.45Å; H228-I231 PolarHBondContact O-N 3.32Å; K229-I231 VanDerWaalsContact C-N 3.29Å; I231-V255 HydrophobicContact CD1-CG1 4.3Å; I231-V255 HydrophobicContact CG1-CG1 4.5Å; I231-V255 HydrophobicContact CG2-CG1 4.27Å; I231-M257 HydrophobicContact CG2-CB 4.44Å; I231-M257 HydrophobicContact CG2-CG 3.63Å
232	T	92.5	Very high	94.3	Very high	35 Å²	35	63.7 Å²	63.7	22%	0.215	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	140.4	177.2	-56.6	0	0	0	0	109.9	M36 L38 S230 L234 M256 M257	M36-T232 HydrophobicContact CB-CG2 4.29Å; M36-T232 HydrophobicContact SD-CG2 3.87Å; L38-T232 WeakPolarHBondContact CD2-OG1 3.33Å; S230-T232 PolarHBondContact O-N 3.39Å; T232-L234 HydrophobicContact CG2-CD2 4.42Å; T232-M256 WeakPolarHBondContact O-CG 3.45Å; T232-M257 PolarHBondContact O-N 3.43Å
233	T	94.3	Very high	94.3	Very high	68 Å²	68	60.5 Å²	60.5	42%	0.417	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	123.9	173.7	-55.5	0	0	0	0	110.3	M257	T233-M257 CarbonylContact C-O 3.57Å; T233-M257 VanDerWaalsContact CA-O 3.28Å; T233-M257 WeakPolarHBondContact CA-O 3.46Å; T233-M257 HydrophobicContact CG2-CB 3.98Å; T233-M257 WeakPolarHBondContact OG1-CB 3.39Å
234	L	95.7	Very high	94.3	Very high	25 Å²	25	60.7 Å²	60.7	13%	0.131	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	151.1	170.6	-63.2	-175.4	0	0	0	110.6	T232 I239 M256 M257 Q258 S259	T232-L234 HydrophobicContact CG2-CD2 4.42Å; L234-I239 HydrophobicContact CB-CD1 4.14Å; L234-I239 HydrophobicContact CB-CG2 4.39Å; L234-I239 HydrophobicContact CD1-CD1 4.25Å; L234-M256 HydrophobicContact CD1-CE 3.95Å; L234-M256 HydrophobicContact CD1-SD 3.59Å; L234-M256 VanDerWaalsContact CD1-SD 3.59Å; L234-M256 HydrophobicContact CG-SD 3.92Å; L234-M257 PolarHBondContact N-O 3.4Å; L234-Q258 CarbonylContact O-C 3.49Å; L234-Q258 WeakPolarHBondContact O-CA 3.14Å; L234-S259 PolarHBondContact O-N 3.48Å
235	Q	96.8	Very high	94.3	Very high	140 Å²	140	63.9 Å²	63.9	65%	0.654	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107	143.4	178.9	-65.4	-68.9	-35.2	0	0	109.6
236	G	96.8	Very high	94.4	Very high	30 Å²	30	59.6 Å²	59.6	31%	0.309	31%	0.312	S	S	.	.	S	Bend	trans	114.7	156.1	177.4	0	0	0	0	0	113	Q258 S259	G236-Q258 WeakPolarHBondContact O-CG 3.33Å; G236-Q258 PolarHBondContact O-NE2 2.93Å; G236-S259 PolarHBondContact N-O 3.24Å
237	E	97.2	Very high	94.3	Very high	105 Å²	105	57 Å²	57	49%	0.491	31%	0.308	S	S	.	.	S	Bend	trans	-81.2	-21.4	-179.2	64.6	-142.2	-142	0	0	113.7	Q258 C260 F261 T353 I354	E237-Q258 VanDerWaalsContact C-NE2 3.32Å; E237-Q258 PolarHBondContact O-NE2 3.41Å; E237-Q258 VanDerWaalsContact O-NE2 3.07Å; E237-C260 HydrophobicContact CB-CB 4.16Å; E237-F261 HydrophobicContact CB-CE2 3.84Å; E237-F261 HydrophobicContact CB-CZ 3.88Å; E237-T353 CarbonylContact O-C 3.43Å; E237-T353 VanDerWaalsContact O-CA 3.25Å; E237-T353 WeakPolarHBondContact O-CA 3.21Å; E237-I354 PolarHBondContact O-N 2.85Å
238	D	97.4	Very high	94.2	Very high	74 Å²	74	53.6 Å²	53.6	40%	0.396	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	113	177.6	-163.2	29.3	0	0	0	110.2	V352 T353	D238-V352 WeakPolarHBondContact CA-O 3.43Å; D238-T353 HydrophobicContact CB-CG2 4.44Å; D238-T353 PolarHBondContact OD1-OG1 3.24Å
239	I	97.7	Very high	94.1	Very high	14 Å²	14	57.5 Å²	57.5	7%	0.072	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	168.3	-175.1	67.2	169.9	0	0	0	111.4	L234 M256 Q258 L267 V352	L234-I239 HydrophobicContact CB-CD1 4.14Å; L234-I239 HydrophobicContact CB-CG2 4.39Å; L234-I239 HydrophobicContact CD1-CD1 4.25Å; I239-M256 HydrophobicContact CD1-CE 3.45Å; I239-M256 VanDerWaalsContact CD1-CE 3.45Å; I239-M256 HydrophobicContact CG1-CE 4.45Å; I239-Q258 HydrophobicContact CD1-CB 3.68Å; I239-Q258 VanDerWaalsContact CD1-CD 3.49Å; I239-Q258 HydrophobicContact CD1-CG 3.66Å; I239-Q258 HydrophobicContact CG1-CG 4.31Å; I239-L267 HydrophobicContact CD1-CD2 4.4Å; I239-V352 HydrophobicContact CG1-CB 4.19Å; I239-V352 PolarHBondContact N-O 3.22Å; I239-V352 PolarHBondContact O-N 3.49Å
240	V	97.2	Very high	94.1	Very high	52 Å²	52	49.5 Å²	49.5	32%	0.315	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	118.4	170.4	-174.6	0	0	0	0	109.6
241	F	96.7	Very high	94.3	Very high	4 Å²	4	46.9 Å²	46.9	2%	0.018	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	106.1	169.7	176	-160.4	0	0	0	109.3	L38 W254 M256 L267 L269 I350 V352	L38-F241 HydrophobicContact CD1-CD2 3.72Å; L38-F241 HydrophobicContact CD1-CE2 3.36Å; L38-F241 HydrophobicContact CD1-CZ 4.44Å; F241-W254 HydrophobicContact CE2-CB 3.91Å; F241-W254 HydrophobicContact CZ-CB 3.59Å; F241-M256 HydrophobicContact CB-CE 3.61Å; F241-M256 HydrophobicContact CD2-CB 4.28Å; F241-M256 HydrophobicContact CD2-CE 3.99Å; F241-M256 HydrophobicContact CD2-SD 4.33Å; F241-M256 HydrophobicContact CE2-CB 4.38Å; F241-M256 HydrophobicContact CG-CE 3.97Å; F241-L267 HydrophobicContact CB-CD2 4.22Å; F241-L267 HydrophobicContact CD1-CB 3.98Å; F241-L267 HydrophobicContact CD1-CD2 4.27Å; F241-L267 HydrophobicContact CE1-CB 4.1Å; F241-L267 HydrophobicContact CG-CD2 4.48Å; F241-L269 HydrophobicContact CE1-CB 3.8Å; F241-L269 HydrophobicContact CZ-CB 3.95Å; F241-I350 HydrophobicContact CB-CB 4.33Å; F241-I350 HydrophobicContact CD1-CD1 4.32Å; F241-I350 PolarHBondContact N-O 2.88Å; F241-I350 PolarHBondContact O-N 3.43Å; F241-V352 HydrophobicContact CB-CG2 4.04Å
242	L	96.3	Very high	94.3	Very high	34 Å²	34	46 Å²	46	18%	0.178	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	104.8	-179.7	-172.1	69.6	0	0	0	111.2	T35 A37 L38 N347	T35-L242 HydrophobicContact CG2-CB 3.94Å; T35-L242 HydrophobicContact CG2-CD2 3.69Å; T35-L242 HydrophobicContact CG2-CG 4.36Å; A37-L242 HydrophobicContact CB-CD2 4.2Å; L38-L242 PolarHBondContact N-O 3.16Å; L242-N347 HydrophobicContact CD1-CB 3.78Å; L242-N347 HydrophobicContact CG-CB 4.3Å
243	A	96	Very high	94.3	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	117.1	171.2	0	0	0	0	0	110	I246 W254 L269 N347 L348	A243-I246 HydrophobicContact CB-CG2 4.19Å; A243-W254 HydrophobicContact CB-CB 4.34Å; A243-W254 HydrophobicContact CB-CD2 4Å; A243-W254 HydrophobicContact CB-CG 3.81Å; A243-L269 HydrophobicContact CB-CD2 3.45Å; A243-L269 VanDerWaalsContact CB-CD2 3.45Å; A243-N347 CarbonylContact O-C 3.55Å; A243-N347 VanDerWaalsContact O-CA 3.3Å; A243-N347 WeakPolarHBondContact O-CA 3.23Å; A243-L348 HydrophobicContact CB-CB 4.49Å; A243-L348 PolarHBondContact N-O 3.15Å; A243-L348 PolarHBondContact O-N 3.19Å
244	T	94.4	Very high	94.4	Very high	12 Å²	12	41.1 Å²	41.1	7%	0.074	24%	0.24	C	C	.	.			trans	-90.9	153.7	179.1	68.5	0	0	0	0	112.7	A37 L38 I246 W254 N347	A37-T244 HydrophobicContact CB-CG2 3.5Å; A37-T244 VanDerWaalsContact CB-CG2 3.5Å; L38-T244 PolarHBondContact O-OG1 3.18Å; T244-I246 PolarHBondContact O-N 3.21Å; T244-W254 VanDerWaalsContact O-CZ2 3.26Å; T244-W254 WeakPolarHBondContact O-CZ2 3.41Å; T244-W254 PolarHBondContact O-NE1 2.94Å; T244-N347 VanDerWaalsContact CA-OD1 3.25Å; T244-N347 WeakPolarHBondContact CA-OD1 3.43Å; T244-N347 VanDerWaalsContact CB-OD1 3.25Å; T244-N347 WeakPolarHBondContact CB-OD1 3.35Å; T244-N347 WeakPolarHBondContact CG2-OD1 3.32Å
245	D	93.9	Very high	94.3	Very high	75 Å²	75	40.2 Å²	40.2	40%	0.401	24%	0.235	S	C	.	.			trans	54.8	46.4	173.5	-54.5	-59.4	0	0	0	113.5	S247 L248 G346	D245-S247 PolarHBondContact O-N 2.94Å; D245-L248 HydrophobicContact CB-CD1 3.6Å; D245-L248 HydrophobicContact CB-CG 3.79Å; D245-L248 WeakPolarHBondContact O-CB 3.45Å; D245-L248 WeakPolarHBondContact O-CG 3.21Å; D245-L248 PolarHBondContact O-N 3.19Å; D245-G346 PolarHBondContact N-O 2.83Å; D245-G346 VanDerWaalsContact N-O 3.14Å
246	I	94.5	Very high	94.3	Very high	1 Å²	1	33.5 Å²	33.5	1%	0.005	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-20.5	-176	65.1	165.9	0	0	0	113.4	A243 T244 L248 K271 F280 A339 A343 G346 L348	A243-I246 HydrophobicContact CB-CG2 4.19Å; T244-I246 PolarHBondContact O-N 3.21Å; I246-L248 VanDerWaalsContact C-N 3.31Å; I246-L248 PolarHBondContact O-N 3.47Å; I246-K271 PolarHBondContact O-NZ 3.07Å; I246-F280 HydrophobicContact CB-CE1 4.21Å; I246-F280 HydrophobicContact CB-CZ 4.26Å; I246-A339 HydrophobicContact CD1-CB 3.88Å; I246-A343 HydrophobicContact CD1-CB 3.6Å; I246-G346 WeakPolarHBondContact CG1-O 3.4Å; I246-G346 PolarHBondContact N-O 3.48Å; I246-L348 HydrophobicContact CD1-CB 4.35Å; I246-L348 HydrophobicContact CG2-CB 3.75Å
247	S	91.5	Very high	94.2	Very high	73 Å²	73	32.3 Å²	32.3	51%	0.51	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	0.8	178.8	60.4	0	0	0	0	114.2	D245	D245-S247 PolarHBondContact O-N 2.94Å
248	L	91.7	Very high	94.3	Very high	66 Å²	66	27.3 Å²	27.3	35%	0.346	17%	0.167	S	C	.	.			trans	-57.3	134.4	178.9	-82.1	168.2	0	0	0	111.9	P40 D245 I246 V252 K271	P40-L248 HydrophobicContact CB-CD1 4.19Å; P40-L248 HydrophobicContact CG-CD1 3.52Å; D245-L248 HydrophobicContact CB-CD1 3.6Å; D245-L248 HydrophobicContact CB-CG 3.79Å; D245-L248 WeakPolarHBondContact O-CB 3.45Å; D245-L248 WeakPolarHBondContact O-CG 3.21Å; D245-L248 PolarHBondContact O-N 3.19Å; I246-L248 VanDerWaalsContact C-N 3.31Å; I246-L248 PolarHBondContact O-N 3.47Å; L248-V252 HydrophobicContact CB-CG2 4.45Å; L248-K271 PolarHBondContact O-NZ 3.22Å
249	P	89.4	Confident	94.3	Very high	106 Å²	106	24.9 Å²	24.9	69%	0.688	16%	0.156	S	C	*	.	S	Bend	trans	-62	146.6	-179.7	-19.1	29.6	0	0	0	113
250	G	88.9	Confident	94.3	Very high	11 Å²	11	24.7 Å²	24.7	11%	0.113	16%	0.155	C	C	.	.	S	Bend	trans	87.6	-171.3	173	0	0	0	0	0	115	K271	G250-K271 WeakPolarHBondContact O-CE 3.4Å
251	A	90.6	Very high	94.2	Very high	38 Å²	38	25.5 Å²	25.5	31%	0.314	16%	0.155	S	C	.	.			trans	-82	126.5	178.9	0	0	0	0	0	111.4	H43 K271	H43-A251 PolarHBondContact ND1-O 3.15Å; A251-K271 WeakPolarHBondContact CA-O 3.2Å
252	V	91.8	Very high	94.2	Very high	2 Å²	2	29.1 Å²	29.1	1%	0.012	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142	137.4	-169.4	-179.1	0	0	0	0	110.3	P40 L248 W254 K271	P40-V252 HydrophobicContact CB-CG1 3.18Å; P40-V252 HydrophobicContact CG-CG1 4.5Å; L248-V252 HydrophobicContact CB-CG2 4.45Å; V252-W254 HydrophobicContact CB-CH2 3.74Å; V252-W254 HydrophobicContact CB-CZ2 4.45Å; V252-W254 HydrophobicContact CB-CZ3 3.82Å; V252-W254 HydrophobicContact CG1-CD2 4.27Å; V252-W254 HydrophobicContact CG1-CE3 4.04Å; V252-W254 HydrophobicContact CG1-CH2 3.4Å; V252-W254 HydrophobicContact CG1-CZ2 3.65Å; V252-W254 HydrophobicContact CG1-CZ3 3.61Å; V252-W254 WeakPolarHBondContact O-CZ3 3.1Å; V252-K271 PolarHBondContact N-O 3.5Å; V252-K271 WeakPolarHBondContact O-CB 3.41Å; V252-K271 PolarHBondContact O-N 3Å
253	D	92.4	Very high	94.2	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.005	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	143	174.6	-61.2	-19.6	0	0	0	111.8	I41 H43 P207 G208 L269 E270	I41-D253 HydrophobicContact CB-CB 4.48Å; I41-D253 PolarHBondContact N-O 3.49Å; I41-D253 PolarHBondContact O-N 3.27Å; H43-D253 IonicContact CE1-OD1 2.93Å; H43-D253 IonicContact CE1-OD2 2.72Å; H43-D253 PolarHBondContact CE1-OD2 2.79Å; H43-D253 IonicContact NE2-OD2 3.57Å; H43-D253 PolarHBondContact NE2-OD2 2.94Å; P207-D253 HydrophobicContact CG-CB 4.47Å; G208-D253 PolarHBondContact N-OD2 3.17Å; D253-L269 CarbonylContact C-O 3.53Å; D253-L269 WeakPolarHBondContact CA-O 3.32Å; D253-E270 WeakPolarHBondContact OD1-CG 3.48Å
254	W	94.7	Very high	94.3	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	133.5	164.6	-62.3	-102.6	0	0	0	108.9	L38 P40 F241 A243 T244 V252 L269 K271 F280	L38-W254 VanDerWaalsContact O-CD1 3.28Å; P40-W254 HydrophobicContact CB-CZ2 4.28Å; F241-W254 HydrophobicContact CE2-CB 3.91Å; F241-W254 HydrophobicContact CZ-CB 3.59Å; A243-W254 HydrophobicContact CB-CB 4.34Å; A243-W254 HydrophobicContact CB-CD2 4Å; A243-W254 HydrophobicContact CB-CG 3.81Å; T244-W254 VanDerWaalsContact O-CZ2 3.26Å; T244-W254 WeakPolarHBondContact O-CZ2 3.41Å; T244-W254 PolarHBondContact O-NE1 2.94Å; V252-W254 HydrophobicContact CB-CH2 3.74Å; V252-W254 HydrophobicContact CB-CZ2 4.45Å; V252-W254 HydrophobicContact CB-CZ3 3.82Å; V252-W254 HydrophobicContact CG1-CD2 4.27Å; V252-W254 HydrophobicContact CG1-CE3 4.04Å; V252-W254 HydrophobicContact CG1-CH2 3.4Å; V252-W254 HydrophobicContact CG1-CZ2 3.65Å; V252-W254 HydrophobicContact CG1-CZ3 3.61Å; V252-W254 WeakPolarHBondContact O-CZ3 3.1Å; W254-L269 HydrophobicContact CB-CB 4.27Å; W254-L269 HydrophobicContact CD2-CD2 4.3Å; W254-L269 HydrophobicContact CE3-CB 4.4Å; W254-L269 HydrophobicContact CE3-CD2 3.87Å; W254-L269 HydrophobicContact CE3-CG 4.05Å; W254-L269 HydrophobicContact CZ3-CD2 4.4Å; W254-L269 PolarHBondContact N-O 3.46Å; W254-L269 PolarHBondContact O-N 3.26Å; W254-K271 HydrophobicContact CZ3-CB 4.02Å; W254-F280 HydrophobicContact CZ3-CE1 4.44Å
255	V	95.1	Very high	94.5	Very high	6 Å²	6	30.1 Å²	30.1	4%	0.036	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	131.2	-175.5	-172.3	0	0	0	0	110.2	L38 I41 P207 I231 M266 L267	L38-V255 VanDerWaalsContact CD1-O 3.31Å; L38-V255 WeakPolarHBondContact CD1-O 3.46Å; I41-V255 HydrophobicContact CD1-CG2 4.09Å; P207-V255 HydrophobicContact CG-CG2 3.35Å; I231-V255 HydrophobicContact CD1-CG1 4.3Å; I231-V255 HydrophobicContact CG1-CG1 4.5Å; I231-V255 HydrophobicContact CG2-CG1 4.27Å; V255-M266 HydrophobicContact CG1-CE 4.35Å; V255-M266 HydrophobicContact CG1-CG 3.72Å; V255-M266 HydrophobicContact CG1-SD 3.87Å; V255-L267 WeakPolarHBondContact CA-O 3.25Å
256	M	95.3	Very high	94.6	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	154	173.3	-156	162.5	56.4	0	0	110.5	L38 T232 L234 I239 F241 M266 L267	L38-M256 HydrophobicContact CD1-CB 3.44Å; L38-M256 VanDerWaalsContact CD1-CB 3.44Å; L38-M256 HydrophobicContact CD1-CG 3.68Å; L38-M256 HydrophobicContact CD1-SD 3.76Å; T232-M256 WeakPolarHBondContact O-CG 3.45Å; L234-M256 HydrophobicContact CD1-CE 3.95Å; L234-M256 HydrophobicContact CD1-SD 3.59Å; L234-M256 VanDerWaalsContact CD1-SD 3.59Å; L234-M256 HydrophobicContact CG-SD 3.92Å; I239-M256 HydrophobicContact CD1-CE 3.45Å; I239-M256 VanDerWaalsContact CD1-CE 3.45Å; I239-M256 HydrophobicContact CG1-CE 4.45Å; F241-M256 HydrophobicContact CB-CE 3.61Å; F241-M256 HydrophobicContact CD2-CB 4.28Å; F241-M256 HydrophobicContact CD2-CE 3.99Å; F241-M256 HydrophobicContact CD2-SD 4.33Å; F241-M256 HydrophobicContact CE2-CB 4.38Å; F241-M256 HydrophobicContact CG-CE 3.97Å; M256-M266 CarbonylContact O-C 3.42Å; M256-M266 WeakPolarHBondContact O-CA 3.48Å; M256-L267 HydrophobicContact CB-CB 4.24Å; M256-L267 HydrophobicContact CB-CD1 4.09Å; M256-L267 HydrophobicContact CE-CD1 4.29Å; M256-L267 HydrophobicContact CE-CD2 4.22Å; M256-L267 PolarHBondContact N-O 3.46Å; M256-L267 WeakPolarHBondContact O-CD1 3.45Å; M256-L267 PolarHBondContact O-N 3.3Å
257	M	96.5	Very high	94.8	Very high	5 Å²	5	26.6 Å²	26.6	3%	0.025	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	136.9	163.5	-65.9	-56.8	-59.9	0	0	110.2	M221 L224 I231 T232 T233 L234 F265 M266 I287	M221-M257 HydrophobicContact CE-CE 4.36Å; M221-M257 HydrophobicContact SD-CE 4.02Å; L224-M257 HydrophobicContact CD1-SD 4.45Å; I231-M257 HydrophobicContact CG2-CB 4.44Å; I231-M257 HydrophobicContact CG2-CG 3.63Å; T232-M257 PolarHBondContact O-N 3.43Å; T233-M257 CarbonylContact C-O 3.57Å; T233-M257 VanDerWaalsContact CA-O 3.28Å; T233-M257 WeakPolarHBondContact CA-O 3.46Å; T233-M257 HydrophobicContact CG2-CB 3.98Å; T233-M257 WeakPolarHBondContact OG1-CB 3.39Å; L234-M257 PolarHBondContact N-O 3.4Å; M257-F265 CarbonylContact C-O 3.56Å; M257-F265 WeakPolarHBondContact CA-O 3Å; M257-M266 HydrophobicContact CE-CB 4.35Å; M257-M266 HydrophobicContact SD-CB 3.67Å; M257-M266 HydrophobicContact SD-CE 3.71Å; M257-M266 HydrophobicContact SD-CG 3.97Å; M257-I287 HydrophobicContact CE-CD1 4.18Å; M257-I287 HydrophobicContact CE-CG1 3.66Å
258	Q	97.6	Very high	95	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	130.2	167.5	176.5	175	10.3	0	0	108.4	L234 G236 E237 I239 F265 L267 I354	L234-Q258 CarbonylContact O-C 3.49Å; L234-Q258 WeakPolarHBondContact O-CA 3.14Å; G236-Q258 WeakPolarHBondContact O-CG 3.33Å; G236-Q258 PolarHBondContact O-NE2 2.93Å; E237-Q258 VanDerWaalsContact C-NE2 3.32Å; E237-Q258 PolarHBondContact O-NE2 3.41Å; E237-Q258 VanDerWaalsContact O-NE2 3.07Å; I239-Q258 HydrophobicContact CD1-CB 3.68Å; I239-Q258 VanDerWaalsContact CD1-CD 3.49Å; I239-Q258 HydrophobicContact CD1-CG 3.66Å; I239-Q258 HydrophobicContact CG1-CG 4.31Å; Q258-F265 HydrophobicContact CB-CB 4.49Å; Q258-F265 PolarHBondContact N-O 3.05Å; Q258-F265 PolarHBondContact O-N 2.88Å; Q258-L267 HydrophobicContact CB-CD1 3.47Å; Q258-L267 VanDerWaalsContact CB-CD1 3.47Å; Q258-I354 HydrophobicContact CG-CD1 4.21Å; Q258-I354 VanDerWaalsContact OE1-CD1 3.3Å
259	S	97.5	Very high	95.2	Very high	22 Å²	22	20 Å²	20	15%	0.154	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	123	175.4	-169.3	0	0	0	0	110.3	L234 G236 H263	L234-S259 PolarHBondContact O-N 3.48Å; G236-S259 PolarHBondContact N-O 3.24Å; S259-H263 WeakPolarHBondContact CA-O 3.3Å; S259-H263 PolarHBondContact OG-O 2.99Å
260	C	97.6	Very high	95.5	Very high	10 Å²	10	15.7 Å²	15.7	7%	0.068	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	159.1	177.4	57.5	0	0	0	0	109.6	E237 G262 H263 F265	E237-C260 HydrophobicContact CB-CB 4.16Å; C260-G262 PolarHBondContact O-N 3.36Å; C260-H263 PolarHBondContact N-O 3.43Å; C260-H263 VanDerWaalsContact N-O 3.15Å; C260-H263 PolarHBondContact O-N 3.08Å; C260-H263 VanDerWaalsContact O-O 3.1Å; C260-F265 VanDerWaalsContact SG-CE2 3.52Å
261	F	96.9	Very high	95.8	Very high	70 Å²	70	15.2 Å²	15.2	31%	0.307	10%	0.104	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.5	25.7	-179.1	-50.5	-71	0	0	0	115.5	E237 H263 F296 I354 Q356	E237-F261 HydrophobicContact CB-CE2 3.84Å; E237-F261 HydrophobicContact CB-CZ 3.88Å; F261-H263 PolarHBondContact O-CD2 3.31Å; F261-H263 VanDerWaalsContact O-CD2 3.26Å; F261-H263 PolarHBondContact O-N 2.92Å; F261-F296 HydrophobicContact CB-CE1 3.72Å; F261-F296 HydrophobicContact CB-CZ 4.17Å; F261-F296 HydrophobicContact CD2-CD1 4.18Å; F261-F296 AromaticContact CD2-CE1 3.77Å; F261-F296 HydrophobicContact CD2-CE1 3.77Å; F261-F296 AromaticContact CG-CE1 3.89Å; F261-F296 HydrophobicContact CG-CE1 3.89Å; F261-I354 HydrophobicContact CD2-CG2 4.26Å; F261-I354 HydrophobicContact CE2-CB 4.5Å; F261-I354 HydrophobicContact CE2-CG2 4.12Å; F261-I354 WeakPolarHBondContact CE2-O 3.28Å; F261-Q356 HydrophobicContact CD1-CG 3.9Å; F261-Q356 HydrophobicContact CD2-CG 4.37Å; F261-Q356 HydrophobicContact CE1-CG 4.16Å; F261-Q356 HydrophobicContact CG-CG 4.03Å
262	G	95.6	Very high	95.9	Very high	79 Å²	79	15.2 Å²	15.2	81%	0.814	10%	0.098	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.5	8.3	-175.8	0	0	0	0	0	114.8	C260	C260-G262 PolarHBondContact O-N 3.36Å
263	H	97.1	Very high	95.7	Very high	44 Å²	44	21.4 Å²	21.4	20%	0.204	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	164.3	179	-69.4	-77.4	0	0	0	111.7	S259 C260 F261 F265 L286 F296	S259-H263 WeakPolarHBondContact CA-O 3.3Å; S259-H263 PolarHBondContact OG-O 2.99Å; C260-H263 PolarHBondContact N-O 3.43Å; C260-H263 VanDerWaalsContact N-O 3.15Å; C260-H263 PolarHBondContact O-N 3.08Å; C260-H263 VanDerWaalsContact O-O 3.1Å; F261-H263 PolarHBondContact O-CD2 3.31Å; F261-H263 VanDerWaalsContact O-CD2 3.26Å; F261-H263 PolarHBondContact O-N 2.92Å; H263-F265 HydrophobicContact CB-CD2 4.48Å; H263-F265 HydrophobicContact CB-CE2 3.72Å; H263-F265 HydrophobicContact CB-CZ 4Å; H263-L286 HydrophobicContact CB-CD1 3.7Å; H263-F296 AromaticContact CD2-CE2 3.83Å; H263-F296 AromaticContact CD2-CZ 3.45Å; H263-F296 VanDerWaalsContact CD2-CZ 3.45Å; H263-F296 WeakPolarHBondContact CD2-CZ 3.06Å
264	S	97.4	Very high	95.3	Very high	23 Å²	23	26.3 Å²	26.3	16%	0.161	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	128.8	176.1	-63.7	0	0	0	0	109.1	I287	S264-I287 WeakPolarHBondContact O-CB 3.23Å; S264-I287 WeakPolarHBondContact O-CG1 3.31Å; S264-I287 PolarHBondContact O-N 3.41Å
265	F	97.9	Very high	94.4	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	127.9	-179.2	-59.6	-95.3	0	0	0	109.1	M257 Q258 C260 H263 V284 Q285 L286 F296 P315 I354	M257-F265 CarbonylContact C-O 3.56Å; M257-F265 WeakPolarHBondContact CA-O 3Å; Q258-F265 HydrophobicContact CB-CB 4.49Å; Q258-F265 PolarHBondContact N-O 3.05Å; Q258-F265 PolarHBondContact O-N 2.88Å; C260-F265 VanDerWaalsContact SG-CE2 3.52Å; H263-F265 HydrophobicContact CB-CD2 4.48Å; H263-F265 HydrophobicContact CB-CE2 3.72Å; H263-F265 HydrophobicContact CB-CZ 4Å; F265-V284 HydrophobicContact CB-CG1 3.84Å; F265-V284 HydrophobicContact CD1-CG1 4.08Å; F265-V284 HydrophobicContact CG-CG1 4.39Å; F265-Q285 CarbonylContact C-O 3.37Å; F265-Q285 WeakPolarHBondContact CA-O 3.34Å; F265-L286 HydrophobicContact CD1-CB 4.13Å; F265-L286 HydrophobicContact CD1-CD1 3.93Å; F265-L286 HydrophobicContact CE1-CB 4.16Å; F265-L286 HydrophobicContact CE1-CD1 3.59Å; F265-L286 HydrophobicContact CE1-CG 4.38Å; F265-L286 HydrophobicContact CE2-CD1 4.39Å; F265-L286 HydrophobicContact CG-CD1 4.48Å; F265-L286 HydrophobicContact CZ-CD1 3.84Å; F265-F296 HydrophobicContact CE1-CB 4.26Å; F265-F296 HydrophobicContact CE1-CD2 4.17Å; F265-F296 HydrophobicContact CE1-CG 4.06Å; F265-F296 HydrophobicContact CZ-CB 4.45Å; F265-F296 AromaticContact CZ-CD1 3.88Å; F265-F296 HydrophobicContact CZ-CD1 3.88Å; F265-F296 AromaticContact CZ-CD2 3.99Å; F265-F296 HydrophobicContact CZ-CD2 3.99Å; F265-F296 HydrophobicContact CZ-CE1 4.08Å; F265-F296 HydrophobicContact CZ-CE2 4.21Å; F265-F296 AromaticContact CZ-CG 3.83Å; F265-F296 HydrophobicContact CZ-CG 3.83Å; F265-F296 HydrophobicContact CZ-CZ 4.27Å; F265-P315 HydrophobicContact CD1-CB 4.35Å; F265-P315 HydrophobicContact CD1-CG 4.47Å; F265-P315 HydrophobicContact CE1-CB 4.48Å; F265-P315 HydrophobicContact CE1-CG 4.11Å; F265-I354 HydrophobicContact CB-CD1 3.6Å; F265-I354 HydrophobicContact CD1-CD1 3.72Å; F265-I354 HydrophobicContact CD2-CD1 3.47Å; F265-I354 VanDerWaalsContact CD2-CD1 3.47Å; F265-I354 HydrophobicContact CE1-CD1 4.2Å; F265-I354 HydrophobicContact CE1-CG2 4.08Å; F265-I354 HydrophobicContact CE2-CD1 4Å; F265-I354 HydrophobicContact CE2-CG2 4.05Å; F265-I354 HydrophobicContact CG-CD1 3.31Å; F265-I354 HydrophobicContact CZ-CD1 4.34Å; F265-I354 HydrophobicContact CZ-CG2 3.78Å
266	M	97	Very high	93.7	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	121.2	174.3	-174.2	173.8	-73.5	0	0	109.5	P205 L224 V255 M256 M257 V268 V284 Q285 I287	P205-M266 HydrophobicContact CB-CE 4.13Å; P205-M266 HydrophobicContact CB-SD 4.19Å; P205-M266 HydrophobicContact CG-CE 3.84Å; P205-M266 VanDerWaalsContact O-SD 3.38Å; L224-M266 HydrophobicContact CD1-CE 3.76Å; L224-M266 HydrophobicContact CD2-CE 4.1Å; V255-M266 HydrophobicContact CG1-CE 4.35Å; V255-M266 HydrophobicContact CG1-CG 3.72Å; V255-M266 HydrophobicContact CG1-SD 3.87Å; M256-M266 CarbonylContact O-C 3.42Å; M256-M266 WeakPolarHBondContact O-CA 3.48Å; M257-M266 HydrophobicContact CE-CB 4.35Å; M257-M266 HydrophobicContact SD-CB 3.67Å; M257-M266 HydrophobicContact SD-CE 3.71Å; M257-M266 HydrophobicContact SD-CG 3.97Å; M266-V268 HydrophobicContact CG-CG2 3.96Å; M266-V268 HydrophobicContact SD-CG2 4.31Å; M266-V284 CarbonylContact O-C 3.52Å; M266-V284 WeakPolarHBondContact O-CA 3.36Å; M266-Q285 HydrophobicContact CB-CB 4.4Å; M266-Q285 PolarHBondContact N-O 3.43Å; M266-Q285 PolarHBondContact O-N 2.79Å; M266-I287 HydrophobicContact CB-CD1 4.37Å; M266-I287 HydrophobicContact CE-CD1 4.49Å
267	L	97.4	Very high	93.2	Very high	2 Å²	2	42 Å²	42	1%	0.01	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	128	174.9	-56.9	91.9	0	0	0	108.1	I239 F241 V255 M256 Q258 V352	I239-L267 HydrophobicContact CD1-CD2 4.4Å; F241-L267 HydrophobicContact CB-CD2 4.22Å; F241-L267 HydrophobicContact CD1-CB 3.98Å; F241-L267 HydrophobicContact CD1-CD2 4.27Å; F241-L267 HydrophobicContact CE1-CB 4.1Å; F241-L267 HydrophobicContact CG-CD2 4.48Å; V255-L267 WeakPolarHBondContact CA-O 3.25Å; M256-L267 HydrophobicContact CB-CB 4.24Å; M256-L267 HydrophobicContact CB-CD1 4.09Å; M256-L267 HydrophobicContact CE-CD1 4.29Å; M256-L267 HydrophobicContact CE-CD2 4.22Å; M256-L267 PolarHBondContact N-O 3.46Å; M256-L267 WeakPolarHBondContact O-CD1 3.45Å; M256-L267 PolarHBondContact O-N 3.3Å; Q258-L267 HydrophobicContact CB-CD1 3.47Å; Q258-L267 VanDerWaalsContact CB-CD1 3.47Å; L267-V352 HydrophobicContact CD2-CB 3.76Å; L267-V352 HydrophobicContact CD2-CG1 3.58Å; L267-V352 HydrophobicContact CD2-CG2 3.55Å
268	V	96.3	Very high	92.9	Very high	1 Å²	1	44 Å²	44	1%	0.006	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	127.5	-178.2	179.1	0	0	0	0	108.8	P207 M266 E270 A282 L283 V322	P207-V268 HydrophobicContact CB-CG1 4.48Å; P207-V268 HydrophobicContact CG-CG1 3.95Å; P207-V268 HydrophobicContact CG-CG2 4.14Å; M266-V268 HydrophobicContact CG-CG2 3.96Å; M266-V268 HydrophobicContact SD-CG2 4.31Å; V268-E270 HydrophobicContact CG1-CB 4.44Å; V268-A282 VanDerWaalsContact O-CA 3.29Å; V268-A282 WeakPolarHBondContact O-CA 3.25Å; V268-L283 HydrophobicContact CB-CD2 4.15Å; V268-L283 HydrophobicContact CG1-CD2 4.35Å; V268-L283 PolarHBondContact N-O 3.15Å; V268-L283 PolarHBondContact O-N 2.72Å; V268-V322 HydrophobicContact CB-CG1 4.47Å; V268-V322 HydrophobicContact CG2-CG1 4.1Å
269	L	96.7	Very high	92.8	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	110.1	162.7	177.1	70.8	0	0	0	107.1	F241 A243 D253 W254 F280 F281 A282 F334 L348 I350	F241-L269 HydrophobicContact CE1-CB 3.8Å; F241-L269 HydrophobicContact CZ-CB 3.95Å; A243-L269 HydrophobicContact CB-CD2 3.45Å; A243-L269 VanDerWaalsContact CB-CD2 3.45Å; D253-L269 CarbonylContact C-O 3.53Å; D253-L269 WeakPolarHBondContact CA-O 3.32Å; W254-L269 HydrophobicContact CB-CB 4.27Å; W254-L269 HydrophobicContact CD2-CD2 4.3Å; W254-L269 HydrophobicContact CE3-CB 4.4Å; W254-L269 HydrophobicContact CE3-CD2 3.87Å; W254-L269 HydrophobicContact CE3-CG 4.05Å; W254-L269 HydrophobicContact CZ3-CD2 4.4Å; W254-L269 PolarHBondContact N-O 3.46Å; W254-L269 PolarHBondContact O-N 3.26Å; L269-F280 HydrophobicContact CD1-CB 4.12Å; L269-F280 HydrophobicContact CD1-CD1 4.02Å; L269-F280 HydrophobicContact CD2-CD1 4.33Å; L269-F280 HydrophobicContact CG-CD1 4.27Å; L269-F281 CarbonylContact C-O 3.55Å; L269-F281 WeakPolarHBondContact CA-O 3.3Å; L269-A282 HydrophobicContact CD1-CB 3.89Å; L269-F334 HydrophobicContact CD1-CE1 4.46Å; L269-F334 HydrophobicContact CD1-CZ 3.92Å; L269-L348 HydrophobicContact CD2-CD2 4.44Å; L269-I350 HydrophobicContact CD1-CD1 4.25Å; L269-I350 HydrophobicContact CD2-CD1 4.39Å
270	E	95.1	Very high	92.8	Very high	16 Å²	16	44.9 Å²	44.9	8%	0.075	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	129.1	177.5	173.2	170.9	153.7	0	0	109.2	D253 V268 Q272 F280 F281 Q323 I326	D253-E270 WeakPolarHBondContact OD1-CG 3.48Å; V268-E270 HydrophobicContact CG1-CB 4.44Å; E270-Q272 HydrophobicContact CG-CG 4.1Å; E270-Q272 WeakPolarHBondContact OE1-CG 3.38Å; E270-Q272 PolarHBondContact OE1-NE2 3.32Å; E270-F280 CarbonylContact O-C 3.38Å; E270-F280 WeakPolarHBondContact O-CA 3.35Å; E270-F281 PolarHBondContact N-O 3.18Å; E270-F281 PolarHBondContact O-N 3.48Å; E270-Q323 PolarHBondContact OE1-NE2 3.33Å; E270-Q323 PolarHBondContact OE2-NE2 2.94Å; E270-I326 HydrophobicContact CB-CD1 4.21Å; E270-I326 HydrophobicContact CG-CD1 4.44Å; E270-I326 WeakPolarHBondContact OE2-CD1 3.13Å
271	K	94.8	Very high	92.8	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	118.4	172.2	-173.3	174.5	75.9	165.4	0	110.3	I246 L248 G250 A251 V252 W254 Q278 I279 F280	I246-K271 PolarHBondContact O-NZ 3.07Å; L248-K271 PolarHBondContact O-NZ 3.22Å; G250-K271 WeakPolarHBondContact O-CE 3.4Å; A251-K271 WeakPolarHBondContact CA-O 3.2Å; V252-K271 PolarHBondContact N-O 3.5Å; V252-K271 WeakPolarHBondContact O-CB 3.41Å; V252-K271 PolarHBondContact O-N 3Å; W254-K271 HydrophobicContact CZ3-CB 4.02Å; K271-Q278 HydrophobicContact CD-CB 4.27Å; K271-Q278 HydrophobicContact CG-CB 4.22Å; K271-I279 WeakPolarHBondContact CA-O 3.43Å; K271-F280 HydrophobicContact CB-CD1 4.06Å; K271-F280 HydrophobicContact CB-CE1 4.03Å; K271-F280 HydrophobicContact CD-CD1 4.26Å; K271-F280 HydrophobicContact CD-CE1 3.51Å; K271-F280 HydrophobicContact CD-CE2 3.93Å; K271-F280 HydrophobicContact CD-CZ 3.31Å; K271-F280 HydrophobicContact CG-CD1 4.17Å; K271-F280 HydrophobicContact CG-CE1 3.92Å; K271-F280 HydrophobicContact CG-CE2 4.27Å; K271-F280 HydrophobicContact CG-CZ 3.97Å
272	Q	92.8	Very high	92.8	Very high	39 Å²	39	41.2 Å²	41.2	18%	0.182	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	139.7	175.8	-62.9	-174.1	-6.6	0	0	111.1	E270 R274 Q278 I279 F281	E270-Q272 HydrophobicContact CG-CG 4.1Å; E270-Q272 WeakPolarHBondContact OE1-CG 3.38Å; E270-Q272 PolarHBondContact OE1-NE2 3.32Å; Q272-R274 HydrophobicContact CB-CG 4.48Å; Q272-R274 PolarHBondContact O-N 3.1Å; Q272-Q278 WeakPolarHBondContact O-CA 3.48Å; Q272-I279 PolarHBondContact N-O 2.99Å; Q272-I279 PolarHBondContact O-N 2.84Å; Q272-F281 HydrophobicContact CB-CE2 4.19Å; Q272-F281 HydrophobicContact CG-CD2 4.18Å; Q272-F281 HydrophobicContact CG-CE2 3.99Å
273	E	88.8	Confident	92.9	Very high	131 Å²	131	37.5 Å²	37.5	61%	0.612	20%	0.198	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-83.7	112.7	170.9	-168.9	167.9	-153.6	0	0	109.4
274	R	82.7	Confident	92.9	Very high	104 Å²	104	35.4 Å²	35.4	39%	0.392	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	92.4	178.5	-67.3	-158.6	-170.3	171.7	-2.4	110.1	Q272 D277 I279 F281	Q272-R274 HydrophobicContact CB-CG 4.48Å; Q272-R274 PolarHBondContact O-N 3.1Å; R274-D277 CarbonylContact C-O 3.55Å; R274-D277 WeakPolarHBondContact CA-O 3.32Å; R274-D277 PolarHBondContact N-O 3.34Å; R274-D277 CarbonylContact O-C 3.58Å; R274-D277 PolarHBondContact O-N 2.8Å; R274-I279 HydrophobicContact CB-CD1 4.38Å; R274-I279 HydrophobicContact CB-CG1 4.37Å; R274-I279 HydrophobicContact CG-CD1 4.4Å; R274-I279 HydrophobicContact CG-CG1 4.49Å; R274-F281 VanDerWaalsContact NH2-CZ 3.32Å
275	V	76.5	Confident	92.9	Very high	140 Å²	140	34.4 Å²	34.4	85%	0.848	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-44.2	123.2	-177.7	-175.6	0	0	0	0	111.5
276	P	80.9	Confident	92.9	Very high	140 Å²	140	34.4 Å²	34.4	91%	0.909	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	cis	-93.3	-0.1	10.2	37.3	-36.4	0	0	0	116.5
277	D	84.4	Confident	92.9	Very high	56 Å²	56	35.1 Å²	35.1	30%	0.299	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	178.1	-172.2	-148.7	-23.3	0	0	0	112.5	R274 S336	R274-D277 CarbonylContact C-O 3.55Å; R274-D277 WeakPolarHBondContact CA-O 3.32Å; R274-D277 PolarHBondContact N-O 3.34Å; R274-D277 CarbonylContact O-C 3.58Å; R274-D277 PolarHBondContact O-N 2.8Å; D277-S336 VanDerWaalsContact OD1-CB 3.26Å; D277-S336 WeakPolarHBondContact OD1-CB 3.26Å; D277-S336 PolarHBondContact OD1-OG 3.18Å
278	Q	91	Very high	92.8	Very high	48 Å²	48	35 Å²	35	22%	0.224	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	140.3	167.8	-52.1	171.3	8	0	0	107.9	K271 Q272 S336	K271-Q278 HydrophobicContact CD-CB 4.27Å; K271-Q278 HydrophobicContact CG-CB 4.22Å; Q272-Q278 WeakPolarHBondContact O-CA 3.48Å; Q278-S336 WeakPolarHBondContact CB-OG 3.36Å; Q278-S336 PolarHBondContact N-OG 3.46Å; Q278-S336 PolarHBondContact O-N 3.33Å; Q278-S336 PolarHBondContact O-OG 3.39Å
279	I	94.9	Very high	92.6	Very high	39 Å²	39	37 Å²	37	20%	0.2	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	135	177.9	-55.2	-169.7	0	0	0	108.7	K271 Q272 R274 F281 V333	K271-I279 WeakPolarHBondContact CA-O 3.43Å; Q272-I279 PolarHBondContact N-O 2.99Å; Q272-I279 PolarHBondContact O-N 2.84Å; R274-I279 HydrophobicContact CB-CD1 4.38Å; R274-I279 HydrophobicContact CB-CG1 4.37Å; R274-I279 HydrophobicContact CG-CD1 4.4Å; R274-I279 HydrophobicContact CG-CG1 4.49Å; I279-F281 HydrophobicContact CB-CE2 3.86Å; I279-F281 HydrophobicContact CB-CZ 4.16Å; I279-F281 HydrophobicContact CG2-CD2 4.21Å; I279-F281 HydrophobicContact CG2-CE1 4.2Å; I279-F281 HydrophobicContact CG2-CE2 3.5Å; I279-F281 VanDerWaalsContact CG2-CE2 3.5Å; I279-F281 HydrophobicContact CG2-CZ 3.47Å; I279-F281 VanDerWaalsContact CG2-CZ 3.47Å; I279-V333 HydrophobicContact CG2-CG1 3.48Å; I279-V333 VanDerWaalsContact CG2-CG1 3.48Å
280	F	96.9	Very high	92.4	Very high	1 Å²	1	40.1 Å²	40.1	0%	0.004	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	137.6	174.9	-66.3	-99.1	0	0	0	110	I246 W254 L269 E270 K271 V333 F334 A339	I246-F280 HydrophobicContact CB-CE1 4.21Å; I246-F280 HydrophobicContact CB-CZ 4.26Å; W254-F280 HydrophobicContact CZ3-CE1 4.44Å; L269-F280 HydrophobicContact CD1-CB 4.12Å; L269-F280 HydrophobicContact CD1-CD1 4.02Å; L269-F280 HydrophobicContact CD2-CD1 4.33Å; L269-F280 HydrophobicContact CG-CD1 4.27Å; E270-F280 CarbonylContact O-C 3.38Å; E270-F280 WeakPolarHBondContact O-CA 3.35Å; K271-F280 HydrophobicContact CB-CD1 4.06Å; K271-F280 HydrophobicContact CB-CE1 4.03Å; K271-F280 HydrophobicContact CD-CD1 4.26Å; K271-F280 HydrophobicContact CD-CE1 3.51Å; K271-F280 HydrophobicContact CD-CE2 3.93Å; K271-F280 HydrophobicContact CD-CZ 3.31Å; K271-F280 HydrophobicContact CG-CD1 4.17Å; K271-F280 HydrophobicContact CG-CE1 3.92Å; K271-F280 HydrophobicContact CG-CE2 4.27Å; K271-F280 HydrophobicContact CG-CZ 3.97Å; F280-V333 WeakPolarHBondContact O-CA 3.5Å; F280-F334 HydrophobicContact CB-CD1 4.33Å; F280-F334 HydrophobicContact CB-CD2 3.71Å; F280-F334 HydrophobicContact CB-CE1 4.02Å; F280-F334 HydrophobicContact CB-CE2 3.35Å; F280-F334 HydrophobicContact CB-CG 4.19Å; F280-F334 HydrophobicContact CB-CZ 3.52Å; F280-F334 HydrophobicContact CD1-CE2 4.16Å; F280-F334 HydrophobicContact CD1-CZ 4.49Å; F280-F334 HydrophobicContact CD2-CD2 4.09Å; F280-F334 AromaticContact CD2-CE2 3.95Å; F280-F334 HydrophobicContact CD2-CE2 3.95Å; F280-F334 HydrophobicContact CG-CD2 4.07Å; F280-F334 AromaticContact CG-CE2 3.57Å; F280-F334 HydrophobicContact CG-CE2 3.57Å; F280-F334 HydrophobicContact CG-CZ 4.09Å; F280-F334 PolarHBondContact N-O 3.31Å; F280-F334 PolarHBondContact O-N 2.87Å; F280-F334 VanDerWaalsContact O-N 3.12Å; F280-A339 HydrophobicContact CD2-CB 4.01Å; F280-A339 HydrophobicContact CE2-CB 3.71Å; F280-A339 HydrophobicContact CZ-CB 4.06Å
281	F	97.2	Very high	92.3	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	120.4	175.6	-61.2	-91.1	0	0	0	108.6	L269 E270 Q272 R274 I279 I326 L332 V333	L269-F281 CarbonylContact C-O 3.55Å; L269-F281 WeakPolarHBondContact CA-O 3.3Å; E270-F281 PolarHBondContact N-O 3.18Å; E270-F281 PolarHBondContact O-N 3.48Å; Q272-F281 HydrophobicContact CB-CE2 4.19Å; Q272-F281 HydrophobicContact CG-CD2 4.18Å; Q272-F281 HydrophobicContact CG-CE2 3.99Å; R274-F281 VanDerWaalsContact NH2-CZ 3.32Å; I279-F281 HydrophobicContact CB-CE2 3.86Å; I279-F281 HydrophobicContact CB-CZ 4.16Å; I279-F281 HydrophobicContact CG2-CD2 4.21Å; I279-F281 HydrophobicContact CG2-CE1 4.2Å; I279-F281 HydrophobicContact CG2-CE2 3.5Å; I279-F281 VanDerWaalsContact CG2-CE2 3.5Å; I279-F281 HydrophobicContact CG2-CZ 3.47Å; I279-F281 VanDerWaalsContact CG2-CZ 3.47Å; F281-I326 HydrophobicContact CB-CD1 4.18Å; F281-I326 HydrophobicContact CB-CG1 3.99Å; F281-I326 HydrophobicContact CD1-CB 4.42Å; F281-I326 HydrophobicContact CD1-CG1 4.35Å; F281-I326 HydrophobicContact CD1-CG2 3.86Å; F281-I326 HydrophobicContact CD2-CG2 4.11Å; F281-I326 HydrophobicContact CE1-CG2 4.07Å; F281-I326 HydrophobicContact CE2-CG2 4.3Å; F281-I326 HydrophobicContact CG-CG1 4.22Å; F281-I326 HydrophobicContact CG-CG2 3.91Å; F281-I326 HydrophobicContact CZ-CG2 4.3Å; F281-L332 WeakPolarHBondContact CA-O 3.36Å; F281-V333 HydrophobicContact CD1-CB 4.47Å; F281-V333 HydrophobicContact CD1-CG1 4.17Å; F281-V333 HydrophobicContact CD1-CG2 3.62Å; F281-V333 HydrophobicContact CE1-CB 4.47Å; F281-V333 HydrophobicContact CE1-CG1 3.81Å; F281-V333 HydrophobicContact CE1-CG2 3.78Å; F281-V333 HydrophobicContact CZ-CG1 4.29Å
282	A	98	Very high	92.3	Very high	2 Å²	2	49.9 Å²	49.9	2%	0.017	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	125.9	178.8	0	0	0	0	0	111.4	V268 L269 L300 C331 L332 F334 I350	V268-A282 VanDerWaalsContact O-CA 3.29Å; V268-A282 WeakPolarHBondContact O-CA 3.25Å; L269-A282 HydrophobicContact CD1-CB 3.89Å; A282-L300 HydrophobicContact CB-CD1 3.77Å; A282-L300 WeakPolarHBondContact O-CD1 3.43Å; A282-C331 WeakPolarHBondContact O-CB 3.4Å; A282-L332 HydrophobicContact CB-CB 4.15Å; A282-L332 HydrophobicContact CB-CD2 4.28Å; A282-L332 HydrophobicContact CB-CG 4.42Å; A282-L332 PolarHBondContact N-O 3.2Å; A282-L332 PolarHBondContact O-N 3.35Å; A282-F334 HydrophobicContact CB-CE1 4.42Å; A282-I350 HydrophobicContact CB-CD1 4.35Å
283	L	97.6	Very high	92.4	Very high	2 Å²	2	48.1 Å²	48.1	1%	0.01	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	165.7	-179.8	67.8	159.6	0	0	0	112.3	V268 Q285 V322 A325 I326 C331	V268-L283 HydrophobicContact CB-CD2 4.15Å; V268-L283 HydrophobicContact CG1-CD2 4.35Å; V268-L283 PolarHBondContact N-O 3.15Å; V268-L283 PolarHBondContact O-N 2.72Å; L283-Q285 HydrophobicContact CD1-CG 4.48Å; L283-V322 HydrophobicContact CD1-CB 4.12Å; L283-V322 HydrophobicContact CD1-CG1 4.05Å; L283-V322 HydrophobicContact CD2-CB 4.47Å; L283-V322 HydrophobicContact CD2-CG1 4.47Å; L283-V322 HydrophobicContact CG-CG1 4.45Å; L283-A325 HydrophobicContact CD1-CB 4.07Å; L283-I326 HydrophobicContact CD2-CD1 4.28Å; L283-I326 HydrophobicContact CD2-CG1 4.3Å; L283-C331 HydrophobicContact CB-CB 3.81Å
284	V	97.8	Very high	92.7	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	131.9	175.4	-178.4	0	0	0	0	109.2	F265 M266 Y298 L300 P315 R316 V352 I354	F265-V284 HydrophobicContact CB-CG1 3.84Å; F265-V284 HydrophobicContact CD1-CG1 4.08Å; F265-V284 HydrophobicContact CG-CG1 4.39Å; M266-V284 CarbonylContact O-C 3.52Å; M266-V284 WeakPolarHBondContact O-CA 3.36Å; V284-Y298 HydrophobicContact CB-CD1 3.8Å; V284-Y298 HydrophobicContact CB-CD2 3.93Å; V284-Y298 HydrophobicContact CB-CE1 4.12Å; V284-Y298 HydrophobicContact CB-CE2 4.23Å; V284-Y298 HydrophobicContact CB-CG 3.7Å; V284-Y298 HydrophobicContact CG1-CG 4.49Å; V284-Y298 HydrophobicContact CG2-CD1 4.24Å; V284-Y298 HydrophobicContact CG2-CD2 3.42Å; V284-Y298 VanDerWaalsContact CG2-CD2 3.42Å; V284-Y298 HydrophobicContact CG2-CE2 3.87Å; V284-Y298 HydrophobicContact CG2-CG 3.63Å; V284-L300 HydrophobicContact CG2-CD2 4.03Å; V284-P315 HydrophobicContact CB-CB 4.5Å; V284-P315 HydrophobicContact CG1-CB 4.19Å; V284-P315 WeakPolarHBondContact O-CA 3.43Å; V284-R316 PolarHBondContact O-N 2.82Å; V284-V352 HydrophobicContact CG2-CG1 4.24Å; V284-I354 HydrophobicContact CG1-CD1 4.35Å
285	Q	96.9	Very high	93.4	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.005	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	139.2	170.7	-56.7	-168.9	-68.3	0	0	110.9	F265 M266 L283 R316 I318 V322	F265-Q285 CarbonylContact C-O 3.37Å; F265-Q285 WeakPolarHBondContact CA-O 3.34Å; M266-Q285 HydrophobicContact CB-CB 4.4Å; M266-Q285 PolarHBondContact N-O 3.43Å; M266-Q285 PolarHBondContact O-N 2.79Å; L283-Q285 HydrophobicContact CD1-CG 4.48Å; Q285-R316 CarbonylContact C-O 3.47Å; Q285-R316 WeakPolarHBondContact CA-O 3.45Å; Q285-R316 HydrophobicContact CG-CB 4.27Å; Q285-I318 HydrophobicContact CB-CG2 4.21Å; Q285-V322 HydrophobicContact CG-CG1 3.87Å
286	L	97.6	Very high	94.4	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	130.3	167.8	173.7	68.2	0	0	0	109.8	H263 F265 G288 Q292 A293 P315 R316 I318	H263-L286 HydrophobicContact CB-CD1 3.7Å; F265-L286 HydrophobicContact CD1-CB 4.13Å; F265-L286 HydrophobicContact CD1-CD1 3.93Å; F265-L286 HydrophobicContact CE1-CB 4.16Å; F265-L286 HydrophobicContact CE1-CD1 3.59Å; F265-L286 HydrophobicContact CE1-CG 4.38Å; F265-L286 HydrophobicContact CE2-CD1 4.39Å; F265-L286 HydrophobicContact CG-CD1 4.48Å; F265-L286 HydrophobicContact CZ-CD1 3.84Å; L286-G288 PolarHBondContact O-N 3.09Å; L286-Q292 VanDerWaalsContact CD2-C 3.49Å; L286-Q292 HydrophobicContact CD2-CB 3.57Å; L286-A293 HydrophobicContact CB-CB 4.28Å; L286-A293 HydrophobicContact CD2-CB 3.95Å; L286-A293 VanDerWaalsContact CD2-N 3.3Å; L286-P315 HydrophobicContact CB-CB 4.38Å; L286-P315 HydrophobicContact CB-CG 4.44Å; L286-R316 PolarHBondContact N-O 3.13Å; L286-I318 WeakPolarHBondContact O-CG2 3.34Å; L286-I318 PolarHBondContact O-N 2.8Å; L286-I318 VanDerWaalsContact O-N 3.1Å
287	I	96.7	Very high	95.2	Very high	15 Å²	15	34.8 Å²	34.8	8%	0.077	17%	0.17	C	C	.	.	S	Bend	trans	-72.6	82.5	163.2	-48.9	-55.5	0	0	0	108	P205 L217 V220 M221 L224 M257 S264 M266 I318	P205-I287 HydrophobicContact CG-CD1 4.08Å; L217-I287 HydrophobicContact CD1-CG2 4.37Å; V220-I287 HydrophobicContact CB-CG2 4.12Å; V220-I287 HydrophobicContact CG1-CG2 3.86Å; M221-I287 HydrophobicContact CG-CG2 3.99Å; M221-I287 HydrophobicContact SD-CB 4.32Å; M221-I287 HydrophobicContact SD-CG1 3.89Å; M221-I287 HydrophobicContact SD-CG2 4.08Å; L224-I287 HydrophobicContact CD1-CD1 4.28Å; M257-I287 HydrophobicContact CE-CD1 4.18Å; M257-I287 HydrophobicContact CE-CG1 3.66Å; S264-I287 WeakPolarHBondContact O-CB 3.23Å; S264-I287 WeakPolarHBondContact O-CG1 3.31Å; S264-I287 PolarHBondContact O-N 3.41Å; M266-I287 HydrophobicContact CB-CD1 4.37Å; M266-I287 HydrophobicContact CE-CD1 4.49Å; I287-I318 HydrophobicContact CD1-CD1 4.44Å; I287-I318 HydrophobicContact CD1-CG2 3.51Å; I287-I318 HydrophobicContact CG2-CD1 3.99Å
288	G	94.7	Very high	95.9	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.156	C	C	.	.	S	Bend	trans	-176.6	-169.9	-170.9	0	0	0	0	0	113.2	L286 S317	L286-G288 PolarHBondContact O-N 3.09Å; G288-S317 PolarHBondContact O-OG 3.25Å
289	T	93	Very high	96.2	Very high	42 Å²	42	33.8 Å²	33.8	26%	0.258	16%	0.16	S	C	.	.			trans	-86.2	164.2	174.5	61.2	0	0	0	0	111.7	L217 K291 Q292 A293	L217-T289 HydrophobicContact CD2-CG2 4.14Å; T289-K291 VanDerWaalsContact C-N 3.32Å; T289-K291 PolarHBondContact O-N 3.42Å; T289-Q292 PolarHBondContact O-N 3.42Å; T289-Q292 VanDerWaalsContact OG1-CG 3.31Å; T289-Q292 WeakPolarHBondContact OG1-CG 3.25Å; T289-Q292 PolarHBondContact OG1-N 2.81Å; T289-Q292 PolarHBondContact OG1-OE1 2.94Å; T289-A293 PolarHBondContact O-N 2.72Å
290	R	92.8	Very high	96.4	Very high	67 Å²	67	32.2 Å²	32.2	25%	0.253	15%	0.152	S	C	.	.	H	α-helix	trans	-56.9	-45	174.2	-62	-173.4	-178.1	127.8	-8	111.9	A196 E198 Q292 A293 D294 H319 D320	A196-R290 PolarHBondContact O-NH1 2.98Å; E198-R290 WeakPolarHBondContact OE1-CD 3.43Å; E198-R290 IonicContact OE1-CZ 3.4Å; E198-R290 IonicContact OE1-NE 3.61Å; E198-R290 IonicContact OE1-NH1 2.65Å; E198-R290 PolarHBondContact OE1-NH1 3.49Å; R290-Q292 VanDerWaalsContact C-N 3.3Å; R290-Q292 PolarHBondContact O-N 3.02Å; R290-A293 WeakPolarHBondContact O-CA 3.05Å; R290-A293 WeakPolarHBondContact O-CB 3.47Å; R290-A293 PolarHBondContact O-N 3.37Å; R290-D294 PolarHBondContact O-N 3.32Å; R290-H319 PolarHBondContact NH2-CD2 3.09Å; R290-H319 VanDerWaalsContact NH2-CD2 3.33Å; R290-D320 IonicContact CZ-OD1 3.45Å; R290-D320 IonicContact NE-OD1 2.8Å; R290-D320 PolarHBondContact NE-OD1 3.33Å; R290-D320 IonicContact NE-OD2 3.56Å; R290-D320 IonicContact NH2-OD1 3.2Å; R290-D320 PolarHBondContact NH2-OD1 3.03Å
291	K	92.5	Very high	96.5	Very high	162 Å²	162	33.4 Å²	33.4	70%	0.704	16%	0.157	S	C	*	.	H	α-helix	trans	-61.1	-34.2	177.3	-175.9	179.2	179.2	-178.8	0	113.7	T289 Q295	T289-K291 VanDerWaalsContact C-N 3.32Å; T289-K291 PolarHBondContact O-N 3.42Å; K291-Q295 PolarHBondContact O-NE2 2.94Å
292	Q	94.6	Very high	96.5	Very high	59 Å²	59	33.4 Å²	33.4	28%	0.276	16%	0.157	S	C	.	.	H	α-helix	trans	-73	-37.8	173.6	-72.4	166.7	-46.1	0	0	110.7	L286 T289 R290 D294 Q295 F296	L286-Q292 VanDerWaalsContact CD2-C 3.49Å; L286-Q292 HydrophobicContact CD2-CB 3.57Å; T289-Q292 PolarHBondContact O-N 3.42Å; T289-Q292 VanDerWaalsContact OG1-CG 3.31Å; T289-Q292 WeakPolarHBondContact OG1-CG 3.25Å; T289-Q292 PolarHBondContact OG1-N 2.81Å; T289-Q292 PolarHBondContact OG1-OE1 2.94Å; R290-Q292 VanDerWaalsContact C-N 3.3Å; R290-Q292 PolarHBondContact O-N 3.02Å; Q292-D294 VanDerWaalsContact C-N 3.31Å; Q292-D294 PolarHBondContact O-N 3.01Å; Q292-Q295 WeakPolarHBondContact O-CB 3.46Å; Q292-Q295 PolarHBondContact O-N 3.34Å; Q292-Q295 VanDerWaalsContact O-N 3.15Å; Q292-F296 VanDerWaalsContact O-CD2 3.23Å; Q292-F296 WeakPolarHBondContact O-CD2 3.37Å; Q292-F296 WeakPolarHBondContact O-CE2 3.44Å
293	A	95.8	Very high	96.4	Very high	2 Å²	2	36.6 Å²	36.6	2%	0.017	17%	0.174	C	C	.	.	H	α-helix	trans	-62.8	-37.7	179.6	0	0	0	0	0	112.3	L286 T289 R290 Q295 F296 P315	L286-A293 HydrophobicContact CB-CB 4.28Å; L286-A293 HydrophobicContact CD2-CB 3.95Å; L286-A293 VanDerWaalsContact CD2-N 3.3Å; T289-A293 PolarHBondContact O-N 2.72Å; R290-A293 WeakPolarHBondContact O-CA 3.05Å; R290-A293 WeakPolarHBondContact O-CB 3.47Å; R290-A293 PolarHBondContact O-N 3.37Å; A293-Q295 PolarHBondContact O-N 2.9Å; A293-F296 PolarHBondContact O-N 3.1Å; A293-F296 VanDerWaalsContact O-N 3.1Å; A293-P315 HydrophobicContact CB-CG 4.39Å; A293-P315 WeakPolarHBondContact CB-O 3.48Å; A293-P315 WeakPolarHBondContact O-CD 3.44Å
294	D	94.9	Very high	96.1	Very high	106 Å²	106	37.7 Å²	37.7	57%	0.567	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-14.2	176	-66.5	-26.1	0	0	0	114.4	R290 Q292 F296	R290-D294 PolarHBondContact O-N 3.32Å; Q292-D294 VanDerWaalsContact C-N 3.31Å; Q292-D294 PolarHBondContact O-N 3.01Å; D294-F296 VanDerWaalsContact C-N 3.29Å
295	Q	96.4	Very high	95.8	Very high	88 Å²	88	45.2 Å²	45.2	41%	0.411	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-1.9	178.5	-59.3	173	18.8	0	0	112.8	K291 Q292 A293 Q356 V357	K291-Q295 PolarHBondContact O-NE2 2.94Å; Q292-Q295 WeakPolarHBondContact O-CB 3.46Å; Q292-Q295 PolarHBondContact O-N 3.34Å; Q292-Q295 VanDerWaalsContact O-N 3.15Å; A293-Q295 PolarHBondContact O-N 2.9Å; Q295-Q356 CarbonylContact O-C 3.6Å; Q295-Q356 WeakPolarHBondContact O-CA 3.15Å; Q295-V357 PolarHBondContact O-N 3.46Å
296	F	98	Very high	95.6	Very high	1 Å²	1	56.1 Å²	56.1	0%	0.004	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	152.9	-176	-60	-82.4	0	0	0	111.7	F261 H263 F265 Q292 A293 D294 P315 I354 S355 Q356	F261-F296 HydrophobicContact CB-CE1 3.72Å; F261-F296 HydrophobicContact CB-CZ 4.17Å; F261-F296 HydrophobicContact CD2-CD1 4.18Å; F261-F296 AromaticContact CD2-CE1 3.77Å; F261-F296 HydrophobicContact CD2-CE1 3.77Å; F261-F296 AromaticContact CG-CE1 3.89Å; F261-F296 HydrophobicContact CG-CE1 3.89Å; H263-F296 AromaticContact CD2-CE2 3.83Å; H263-F296 AromaticContact CD2-CZ 3.45Å; H263-F296 VanDerWaalsContact CD2-CZ 3.45Å; H263-F296 WeakPolarHBondContact CD2-CZ 3.06Å; F265-F296 HydrophobicContact CE1-CB 4.26Å; F265-F296 HydrophobicContact CE1-CD2 4.17Å; F265-F296 HydrophobicContact CE1-CG 4.06Å; F265-F296 HydrophobicContact CZ-CB 4.45Å; F265-F296 AromaticContact CZ-CD1 3.88Å; F265-F296 HydrophobicContact CZ-CD1 3.88Å; F265-F296 AromaticContact CZ-CD2 3.99Å; F265-F296 HydrophobicContact CZ-CD2 3.99Å; F265-F296 HydrophobicContact CZ-CE1 4.08Å; F265-F296 HydrophobicContact CZ-CE2 4.21Å; F265-F296 AromaticContact CZ-CG 3.83Å; F265-F296 HydrophobicContact CZ-CG 3.83Å; F265-F296 HydrophobicContact CZ-CZ 4.27Å; Q292-F296 VanDerWaalsContact O-CD2 3.23Å; Q292-F296 WeakPolarHBondContact O-CD2 3.37Å; Q292-F296 WeakPolarHBondContact O-CE2 3.44Å; A293-F296 PolarHBondContact O-N 3.1Å; A293-F296 VanDerWaalsContact O-N 3.1Å; D294-F296 VanDerWaalsContact C-N 3.29Å; F296-P315 HydrophobicContact CB-CG 3.87Å; F296-P315 WeakPolarHBondContact O-CD 3.37Å; F296-I354 HydrophobicContact CB-CG2 4.46Å; F296-I354 HydrophobicContact CD1-CG2 4.12Å; F296-S355 CarbonylContact C-O 3.54Å; F296-S355 VanDerWaalsContact CA-O 3.23Å; F296-S355 WeakPolarHBondContact CA-O 3.44Å; F296-Q356 HydrophobicContact CD1-CG 3.9Å; F296-Q356 HydrophobicContact CE1-CG 3.52Å; F296-Q356 HydrophobicContact CZ-CG 4.42Å
297	V	98	Very high	95.5	Very high	39 Å²	39	63.2 Å²	63.2	24%	0.236	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	133.4	166.4	171.7	0	0	0	0	107.5	E312 A313 S355 V357	V297-E312 HydrophobicContact CG1-CB 4.5Å; V297-A313 WeakPolarHBondContact CA-O 3.2Å; V297-S355 PolarHBondContact N-O 3.35Å; V297-S355 PolarHBondContact O-N 2.96Å; V297-S355 PolarHBondContact O-OG 3.14Å; V297-V357 HydrophobicContact CG2-CG2 3.68Å
298	Y	98.3	Very high	95.5	Very high	4 Å²	4	69.9 Å²	69.9	2%	0.016	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	148.2	171.8	76.7	-89.2	0	0	0	110.4	V284 L300 W311 E312 A313 C314 P315 T353	V284-Y298 HydrophobicContact CB-CD1 3.8Å; V284-Y298 HydrophobicContact CB-CD2 3.93Å; V284-Y298 HydrophobicContact CB-CE1 4.12Å; V284-Y298 HydrophobicContact CB-CE2 4.23Å; V284-Y298 HydrophobicContact CB-CG 3.7Å; V284-Y298 HydrophobicContact CG1-CG 4.49Å; V284-Y298 HydrophobicContact CG2-CD1 4.24Å; V284-Y298 HydrophobicContact CG2-CD2 3.42Å; V284-Y298 VanDerWaalsContact CG2-CD2 3.42Å; V284-Y298 HydrophobicContact CG2-CE2 3.87Å; V284-Y298 HydrophobicContact CG2-CG 3.63Å; Y298-L300 HydrophobicContact CD2-CD1 4.27Å; Y298-L300 HydrophobicContact CD2-CD2 4.04Å; Y298-L300 HydrophobicContact CD2-CG 3.7Å; Y298-L300 HydrophobicContact CE2-CD1 3.65Å; Y298-L300 HydrophobicContact CE2-CD2 4.26Å; Y298-L300 HydrophobicContact CE2-CG 3.56Å; Y298-W311 AromaticContact CE2-CD1 3.65Å; Y298-W311 AromaticContact CE2-NE1 3.91Å; Y298-W311 AromaticContact CZ-CD1 3.85Å; Y298-W311 AromaticContact CZ-NE1 3.59Å; Y298-W311 PolarHBondContact OH-NE1 3.45Å; Y298-E312 VanDerWaalsContact O-CA 3.27Å; Y298-E312 WeakPolarHBondContact O-CA 3.32Å; Y298-A313 WeakPolarHBondContact CD1-O 3.39Å; Y298-A313 HydrophobicContact CE1-CB 3.74Å; Y298-A313 WeakPolarHBondContact CE1-O 3.21Å; Y298-A313 PolarHBondContact N-O 3.08Å; Y298-A313 PolarHBondContact O-N 2.88Å; Y298-A313 VanDerWaalsContact O-N 3.11Å; Y298-C314 WeakPolarHBondContact CE1-O 3.24Å; Y298-P315 HydrophobicContact CD1-CB 4.17Å; Y298-T353 CarbonylContact C-O 3.59Å; Y298-T353 VanDerWaalsContact CA-O 3.28Å; Y298-T353 WeakPolarHBondContact CA-O 3.41Å
299	R	98.6	Very high	95.6	Very high	80 Å²	80	72.6 Å²	72.6	30%	0.302	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	125.9	169.6	-179.3	173.3	54	-110.7	-2.8	109.2	T310 W311 E312 V352 T353	R299-T310 HydrophobicContact CG-CG2 3.6Å; R299-W311 CarbonylContact C-O 3.07Å; R299-W311 WeakPolarHBondContact CA-O 3.33Å; R299-E312 HydrophobicContact CB-CG 3.73Å; R299-E312 WeakPolarHBondContact CD-OE1 3.24Å; R299-E312 HydrophobicContact CG-CG 3.64Å; R299-E312 IonicContact NH1-OE1 3.16Å; R299-E312 PolarHBondContact NH1-OE1 3.43Å; R299-E312 VanDerWaalsContact NH1-OE1 3.16Å; R299-V352 WeakPolarHBondContact O-CA 3.33Å; R299-T353 PolarHBondContact N-O 3.46Å; R299-T353 PolarHBondContact NH2-OG1 2.73Å; R299-T353 PolarHBondContact O-N 3.32Å
300	L	98.6	Very high	95.9	Very high	5 Å²	5	73.3 Å²	73.3	3%	0.026	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	131.5	167.1	-58.3	177.4	0	0	0	108.9	A282 V284 Y298 T310 W311 L332 I350 N351 V352	A282-L300 HydrophobicContact CB-CD1 3.77Å; A282-L300 WeakPolarHBondContact O-CD1 3.43Å; V284-L300 HydrophobicContact CG2-CD2 4.03Å; Y298-L300 HydrophobicContact CD2-CD1 4.27Å; Y298-L300 HydrophobicContact CD2-CD2 4.04Å; Y298-L300 HydrophobicContact CD2-CG 3.7Å; Y298-L300 HydrophobicContact CE2-CD1 3.65Å; Y298-L300 HydrophobicContact CE2-CD2 4.26Å; Y298-L300 HydrophobicContact CE2-CG 3.56Å; L300-T310 CarbonylContact O-C 3.57Å; L300-T310 WeakPolarHBondContact O-CA 3.48Å; L300-W311 PolarHBondContact N-O 2.79Å; L300-W311 PolarHBondContact O-N 2.79Å; L300-L332 HydrophobicContact CB-CD2 3.8Å; L300-L332 HydrophobicContact CD1-CB 4.02Å; L300-L332 HydrophobicContact CD1-CD2 4.22Å; L300-I350 HydrophobicContact CB-CG2 4.04Å; L300-I350 HydrophobicContact CD2-CG2 4.12Å; L300-N351 WeakPolarHBondContact CA-O 3.39Å; L300-V352 HydrophobicContact CD2-CB 4.17Å; L300-V352 HydrophobicContact CD2-CG1 3.78Å; L300-V352 HydrophobicContact CD2-CG2 3.55Å
301	E	98.4	Very high	96.1	Very high	27 Å²	27	73.5 Å²	73.5	13%	0.126	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	123.4	-178.4	-175.4	176.3	123.7	0	0	111.7	N303 R308 L309 N351	E301-N303 PolarHBondContact OE1-ND2 3.41Å; E301-N303 PolarHBondContact OE1-OD1 2.61Å; E301-R308 HydrophobicContact CG-CG 3.69Å; E301-R308 VanDerWaalsContact OE1-CD 3.29Å; E301-R308 WeakPolarHBondContact OE1-CD 3.28Å; E301-R308 WeakPolarHBondContact OE2-CD 3.29Å; E301-R308 IonicContact OE2-NH1 3.81Å; E301-L309 CarbonylContact C-O 3.59Å; E301-L309 WeakPolarHBondContact CA-O 3.26Å; E301-N351 HydrophobicContact CB-CB 4.18Å; E301-N351 PolarHBondContact N-O 3.14Å; E301-N351 PolarHBondContact O-N 2.64Å
302	L	98.1	Very high	96.4	Very high	0 Å²	0	71.2 Å²	71.2	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	126.1	168.2	-54.7	-178	0	0	0	108.6	R308 L309 L332 F334 F342 L348 I350	L302-R308 VanDerWaalsContact O-CA 3.31Å; L302-R308 WeakPolarHBondContact O-CA 3.36Å; L302-L309 HydrophobicContact CB-CB 4.31Å; L302-L309 HydrophobicContact CD1-CD2 4.2Å; L302-L309 PolarHBondContact N-O 3.12Å; L302-L309 PolarHBondContact O-N 3.09Å; L302-L332 HydrophobicContact CG-CD2 4.48Å; L302-F334 HydrophobicContact CD1-CD1 4.16Å; L302-F334 HydrophobicContact CD1-CD2 4.45Å; L302-F334 HydrophobicContact CD1-CE1 4.04Å; L302-F334 HydrophobicContact CD1-CE2 4.32Å; L302-F334 HydrophobicContact CD1-CG 4.37Å; L302-F334 HydrophobicContact CD1-CZ 4.12Å; L302-F342 HydrophobicContact CB-CB 4.19Å; L302-F342 HydrophobicContact CB-CD1 3.78Å; L302-F342 HydrophobicContact CB-CD2 3.94Å; L302-F342 HydrophobicContact CB-CE1 4.07Å; L302-F342 HydrophobicContact CB-CE2 4.23Å; L302-F342 HydrophobicContact CB-CG 3.72Å; L302-F342 HydrophobicContact CB-CZ 4.3Å; L302-F342 HydrophobicContact CD1-CD2 3.85Å; L302-F342 HydrophobicContact CD1-CE2 4.33Å; L302-F342 HydrophobicContact CD1-CG 4.28Å; L302-F342 WeakPolarHBondContact O-CE1 3.33Å; L302-L348 HydrophobicContact CD2-CD1 4.04Å; L302-L348 HydrophobicContact CD2-CD2 4.24Å; L302-L348 HydrophobicContact CD2-CG 4.14Å; L302-I350 HydrophobicContact CD2-CB 4.18Å; L302-I350 HydrophobicContact CD2-CD1 4.21Å; L302-I350 HydrophobicContact CD2-CG1 3.64Å; L302-I350 HydrophobicContact CD2-CG2 4.11Å
303	N	95.6	Very high	96.5	Very high	68 Å²	68	69.5 Å²	69.5	36%	0.364	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	132	180	-78.7	-58.3	0	0	0	110.8	E301 F342 N351	E301-N303 PolarHBondContact OE1-ND2 3.41Å; E301-N303 PolarHBondContact OE1-OD1 2.61Å; N303-F342 VanDerWaalsContact C-CD1 3.48Å; N303-N351 PolarHBondContact ND2-ND2 2.86Å
304	G	91.8	Very high	96.6	Very high	25 Å²	25	72.3 Å²	72.3	26%	0.258	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	177.6	177.2	0	0	0	0	0	110.4	R306 R307	G304-R306 PolarHBondContact O-N 2.95Å; G304-R307 PolarHBondContact N-O 3.3Å; G304-R307 PolarHBondContact O-N 3.41Å; G304-R307 VanDerWaalsContact O-N 3.1Å
305	H	90	Very high	96.7	Very high	159 Å²	159	67.5 Å²	67.5	74%	0.736	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	108.8	-177.7	-178.8	-100.7	0	0	0	111.7	R307	H305-R307 PolarHBondContact O-N 3.29Å
306	R	93.5	Very high	96.6	Very high	230 Å²	230	66.9 Å²	66.9	87%	0.868	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	25.4	-177.1	-56.4	178.6	62.2	-167.5	-1.5	114.3	G304	G304-R306 PolarHBondContact O-N 2.95Å
307	R	94.7	Very high	96.5	Very high	149 Å²	149	66.9 Å²	66.9	56%	0.562	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-139.1	144.6	-178.3	-62.1	172.9	-169.9	147.7	-0.8	109.5	G304 H305 F342	G304-R307 PolarHBondContact N-O 3.3Å; G304-R307 PolarHBondContact O-N 3.41Å; G304-R307 VanDerWaalsContact O-N 3.1Å; H305-R307 PolarHBondContact O-N 3.29Å; R307-F342 HydrophobicContact CB-CE1 3.93Å; R307-F342 HydrophobicContact CB-CZ 4.13Å
308	R	96.9	Very high	96.3	Very high	154 Å²	154	65.6 Å²	65.6	58%	0.581	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-146.5	135.5	174.8	179.3	172.9	57.8	179.7	-0.4	109.4	E301 L302	E301-R308 HydrophobicContact CG-CG 3.69Å; E301-R308 VanDerWaalsContact OE1-CD 3.29Å; E301-R308 WeakPolarHBondContact OE1-CD 3.28Å; E301-R308 WeakPolarHBondContact OE2-CD 3.29Å; E301-R308 IonicContact OE2-NH1 3.81Å; L302-R308 VanDerWaalsContact O-CA 3.31Å; L302-R308 WeakPolarHBondContact O-CA 3.36Å
309	L	97.7	Very high	96	Very high	57 Å²	57	65.7 Å²	65.7	30%	0.298	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	126	169.7	-179.7	62.3	0	0	0	108.2	E301 L302 L332 F334 T338 F342	E301-L309 CarbonylContact C-O 3.59Å; E301-L309 WeakPolarHBondContact CA-O 3.26Å; L302-L309 HydrophobicContact CB-CB 4.31Å; L302-L309 HydrophobicContact CD1-CD2 4.2Å; L302-L309 PolarHBondContact N-O 3.12Å; L302-L309 PolarHBondContact O-N 3.09Å; L309-L332 HydrophobicContact CD2-CD1 3.87Å; L309-L332 HydrophobicContact CG-CD1 4.03Å; L309-F334 HydrophobicContact CD2-CB 4.42Å; L309-T338 HydrophobicContact CD2-CG2 4.16Å; L309-F342 HydrophobicContact CB-CE2 4.06Å; L309-F342 HydrophobicContact CB-CZ 3.91Å
310	T	98.1	Very high	95.5	Very high	57 Å²	57	64.3 Å²	64.3	35%	0.35	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	137	-174.5	-53	0	0	0	0	110.1	R299 L300 E312	R299-T310 HydrophobicContact CG-CG2 3.6Å; L300-T310 CarbonylContact O-C 3.57Å; L300-T310 WeakPolarHBondContact O-CA 3.48Å; T310-E312 HydrophobicContact CG2-CG 4.35Å
311	W	98.4	Very high	95	Very high	72 Å²	72	65.4 Å²	65.4	27%	0.273	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	134	171.6	170.1	-92.9	0	0	0	109.4	Y298 R299 L300 A313 L332	Y298-W311 AromaticContact CE2-CD1 3.65Å; Y298-W311 AromaticContact CE2-NE1 3.91Å; Y298-W311 AromaticContact CZ-CD1 3.85Å; Y298-W311 AromaticContact CZ-NE1 3.59Å; Y298-W311 PolarHBondContact OH-NE1 3.45Å; R299-W311 CarbonylContact C-O 3.07Å; R299-W311 WeakPolarHBondContact CA-O 3.33Å; L300-W311 PolarHBondContact N-O 2.79Å; L300-W311 PolarHBondContact O-N 2.79Å; W311-A313 HydrophobicContact CZ2-CB 3.91Å; W311-L332 HydrophobicContact CB-CB 3.72Å; W311-L332 HydrophobicContact CB-CD1 3.96Å; W311-L332 HydrophobicContact CB-CD2 4.49Å; W311-L332 HydrophobicContact CB-CG 4.24Å; W311-L332 HydrophobicContact CG-CB 3.86Å
312	E	98.1	Very high	94.6	Very high	113 Å²	113	64.7 Å²	64.7	53%	0.528	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	131.5	176.6	-67.5	-177.3	125.6	0	0	109.4	V297 Y298 R299 T310	V297-E312 HydrophobicContact CG1-CB 4.5Å; Y298-E312 VanDerWaalsContact O-CA 3.27Å; Y298-E312 WeakPolarHBondContact O-CA 3.32Å; R299-E312 HydrophobicContact CB-CG 3.73Å; R299-E312 WeakPolarHBondContact CD-OE1 3.24Å; R299-E312 HydrophobicContact CG-CG 3.64Å; R299-E312 IonicContact NH1-OE1 3.16Å; R299-E312 PolarHBondContact NH1-OE1 3.43Å; R299-E312 VanDerWaalsContact NH1-OE1 3.16Å; T310-E312 HydrophobicContact CG2-CG 4.35Å
313	A	97.4	Very high	94.2	Very high	23 Å²	23	69.4 Å²	69.4	19%	0.19	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	168.7	177.4	0	0	0	0	0	111.1	V297 Y298 W311	V297-A313 WeakPolarHBondContact CA-O 3.2Å; Y298-A313 WeakPolarHBondContact CD1-O 3.39Å; Y298-A313 HydrophobicContact CE1-CB 3.74Å; Y298-A313 WeakPolarHBondContact CE1-O 3.21Å; Y298-A313 PolarHBondContact N-O 3.08Å; Y298-A313 PolarHBondContact O-N 2.88Å; Y298-A313 VanDerWaalsContact O-N 3.11Å; W311-A313 HydrophobicContact CZ2-CB 3.91Å
314	C	96.5	Very high	94	Very high	61 Å²	61	69 Å²	69	41%	0.412	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-72	139.2	165.8	-58.9	0	0	0	0	109.2	Y298	Y298-C314 WeakPolarHBondContact CE1-O 3.24Å
315	P	97.3	Very high	94	Very high	6 Å²	6	67.8 Å²	67.8	4%	0.039	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-61.9	150.1	175.6	27.4	-32.2	0	0	0	109.8	F265 V284 L286 A293 F296 Y298	F265-P315 HydrophobicContact CD1-CB 4.35Å; F265-P315 HydrophobicContact CD1-CG 4.47Å; F265-P315 HydrophobicContact CE1-CB 4.48Å; F265-P315 HydrophobicContact CE1-CG 4.11Å; V284-P315 HydrophobicContact CB-CB 4.5Å; V284-P315 HydrophobicContact CG1-CB 4.19Å; V284-P315 WeakPolarHBondContact O-CA 3.43Å; L286-P315 HydrophobicContact CB-CB 4.38Å; L286-P315 HydrophobicContact CB-CG 4.44Å; A293-P315 HydrophobicContact CB-CG 4.39Å; A293-P315 WeakPolarHBondContact CB-O 3.48Å; A293-P315 WeakPolarHBondContact O-CD 3.44Å; F296-P315 HydrophobicContact CB-CG 3.87Å; F296-P315 WeakPolarHBondContact O-CD 3.37Å; Y298-P315 HydrophobicContact CD1-CB 4.17Å
316	R	95.1	Very high	94.2	Very high	74 Å²	74	60.3 Å²	60.3	28%	0.279	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	145.3	173.3	-65.2	-60.6	-171.4	179.5	1.2	110.5	V284 Q285 L286 A325 D330	V284-R316 PolarHBondContact O-N 2.82Å; Q285-R316 CarbonylContact C-O 3.47Å; Q285-R316 WeakPolarHBondContact CA-O 3.45Å; Q285-R316 HydrophobicContact CG-CB 4.27Å; L286-R316 PolarHBondContact N-O 3.13Å; R316-A325 HydrophobicContact CG-CB 4.42Å; R316-D330 IonicContact CZ-OD2 3.68Å; R316-D330 IonicContact NH2-OD1 3.9Å; R316-D330 IonicContact NH2-OD2 2.57Å; R316-D330 PolarHBondContact NH2-OD2 2.95Å
317	S	95.2	Very high	94.1	Very high	2 Å²	2	53.2 Å²	53.2	1%	0.014	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	142.6	164.2	174.5	0	0	0	0	109.4	G288 H319 D320	G288-S317 PolarHBondContact O-OG 3.25Å; S317-H319 PolarHBondContact O-N 3.16Å; S317-H319 WeakPolarHBondContact OG-CB 3.47Å; S317-H319 PolarHBondContact OG-N 3.43Å; S317-H319 VanDerWaalsContact OG-N 3.08Å; S317-D320 PolarHBondContact O-N 3.31Å
318	I	94.4	Very high	94.2	Very high	11 Å²	11	51.1 Å²	51.1	6%	0.056	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-17.1	167.6	50.2	162.8	0	0	0	113	Y202 P205 L217 V220 Q285 L286 I287 D320 G321	Y202-I318 HydrophobicContact CD1-CB 4.44Å; Y202-I318 HydrophobicContact CD1-CD1 3.46Å; Y202-I318 VanDerWaalsContact CD1-CD1 3.46Å; Y202-I318 HydrophobicContact CD1-CG1 3.59Å; Y202-I318 HydrophobicContact CE1-CD1 3.83Å; Y202-I318 HydrophobicContact CE1-CG1 3.63Å; Y202-I318 HydrophobicContact CG-CD1 4.17Å; P205-I318 HydrophobicContact CB-CB 4.16Å; P205-I318 HydrophobicContact CB-CG2 3.55Å; P205-I318 HydrophobicContact CG-CG2 4.22Å; L217-I318 HydrophobicContact CD1-CD1 3.91Å; V220-I318 HydrophobicContact CB-CD1 4.42Å; V220-I318 HydrophobicContact CG1-CD1 3.99Å; V220-I318 HydrophobicContact CG2-CD1 3.98Å; Q285-I318 HydrophobicContact CB-CG2 4.21Å; L286-I318 WeakPolarHBondContact O-CG2 3.34Å; L286-I318 PolarHBondContact O-N 2.8Å; L286-I318 VanDerWaalsContact O-N 3.1Å; I287-I318 HydrophobicContact CD1-CD1 4.44Å; I287-I318 HydrophobicContact CD1-CG2 3.51Å; I287-I318 HydrophobicContact CG2-CD1 3.99Å; I318-D320 VanDerWaalsContact C-N 3.26Å; I318-D320 PolarHBondContact O-N 3.04Å; I318-G321 PolarHBondContact O-N 2.7Å
319	H	91.1	Very high	94.1	Very high	6 Å²	6	46.7 Å²	46.7	3%	0.028	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-32.5	173.8	-162.4	86.6	0	0	0	113.1	C197 R200 Y202 R290 S317	C197-H319 PolarHBondContact O-CE1 2.65Å; C197-H319 PolarHBondContact O-NE2 3.22Å; C197-H319 VanDerWaalsContact O-NE2 3.16Å; R200-H319 PolarHBondContact NH2-O 2.92Å; Y202-H319 HydrophobicContact CD1-CB 4.45Å; Y202-H319 HydrophobicContact CE1-CB 3.78Å; Y202-H319 AromaticContact CE1-ND1 3.89Å; R290-H319 PolarHBondContact NH2-CD2 3.09Å; R290-H319 VanDerWaalsContact NH2-CD2 3.33Å; S317-H319 PolarHBondContact O-N 3.16Å; S317-H319 WeakPolarHBondContact OG-CB 3.47Å; S317-H319 PolarHBondContact OG-N 3.43Å; S317-H319 VanDerWaalsContact OG-N 3.08Å
320	D	88.9	Confident	94	Very high	52 Å²	52	47.3 Å²	47.3	28%	0.278	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-17.6	-176.6	-58.6	-42.9	0	0	0	113	R290 S317 I318 S324	R290-D320 IonicContact CZ-OD1 3.45Å; R290-D320 IonicContact NE-OD1 2.8Å; R290-D320 PolarHBondContact NE-OD1 3.33Å; R290-D320 IonicContact NE-OD2 3.56Å; R290-D320 IonicContact NH2-OD1 3.2Å; R290-D320 PolarHBondContact NH2-OD1 3.03Å; S317-D320 PolarHBondContact O-N 3.31Å; I318-D320 VanDerWaalsContact C-N 3.26Å; I318-D320 PolarHBondContact O-N 3.04Å; D320-S324 WeakPolarHBondContact O-CB 3.28Å; D320-S324 PolarHBondContact O-OG 3.24Å
321	G	87.2	Confident	94	Very high	27 Å²	27	44.8 Å²	44.8	28%	0.278	26%	0.26	S	S	.	.	H	α-helix	trans	68.7	166.3	-174.3	0	0	0	0	0	113.9	I318 S324	I318-G321 PolarHBondContact O-N 2.7Å; G321-S324 PolarHBondContact O-OG 2.99Å; G321-S324 VanDerWaalsContact O-OG 3.08Å
322	V	90.5	Very high	93.9	Very high	12 Å²	12	41.7 Å²	41.7	7%	0.073	25%	0.249	C	C	.	.	H	α-helix	trans	-75.8	-34.3	177.9	-64.8	0	0	0	0	112.5	V268 L283 Q285 S324 A325 I326	V268-V322 HydrophobicContact CB-CG1 4.47Å; V268-V322 HydrophobicContact CG2-CG1 4.1Å; L283-V322 HydrophobicContact CD1-CB 4.12Å; L283-V322 HydrophobicContact CD1-CG1 4.05Å; L283-V322 HydrophobicContact CD2-CB 4.47Å; L283-V322 HydrophobicContact CD2-CG1 4.47Å; L283-V322 HydrophobicContact CG-CG1 4.45Å; Q285-V322 HydrophobicContact CG-CG1 3.87Å; V322-S324 VanDerWaalsContact C-N 3.28Å; V322-S324 PolarHBondContact O-N 2.67Å; V322-A325 PolarHBondContact O-N 3.17Å; V322-A325 VanDerWaalsContact O-N 3.17Å; V322-I326 HydrophobicContact CB-CD1 4.31Å; V322-I326 HydrophobicContact CG2-CD1 4.44Å; V322-I326 WeakPolarHBondContact O-CG1 3.25Å; V322-I326 PolarHBondContact O-N 2.61Å; V322-I326 VanDerWaalsContact O-N 3.08Å
323	Q	90.5	Very high	93.9	Very high	100 Å²	100	38.9 Å²	38.9	47%	0.467	24%	0.24	S	C	.	.	H	α-helix	trans	-68	-28.6	-170.8	-69	-59.7	-26.1	0	0	112.8	E270 A325 I326 A327	E270-Q323 PolarHBondContact OE1-NE2 3.33Å; E270-Q323 PolarHBondContact OE2-NE2 2.94Å; Q323-A325 VanDerWaalsContact C-N 3.35Å; Q323-I326 PolarHBondContact O-N 3.05Å; Q323-A327 VanDerWaalsContact O-CB 3.23Å; Q323-A327 WeakPolarHBondContact O-CB 3.42Å; Q323-A327 PolarHBondContact O-N 3.45Å
324	S	89.8	Confident	93.9	Very high	58 Å²	58	38.2 Å²	38.2	41%	0.406	23%	0.233	S	C	.	.	H	α-helix	trans	-62.9	-41.4	174.9	58	0	0	0	0	111.6	D320 G321 V322	D320-S324 WeakPolarHBondContact O-CB 3.28Å; D320-S324 PolarHBondContact O-OG 3.24Å; G321-S324 PolarHBondContact O-OG 2.99Å; G321-S324 VanDerWaalsContact O-OG 3.08Å; V322-S324 VanDerWaalsContact C-N 3.28Å; V322-S324 PolarHBondContact O-N 2.67Å
325	A	92.8	Very high	93.8	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.008	23%	0.227	C	C	.	.	H	α-helix	trans	-72.7	-43	176.4	0	0	0	0	0	112.4	L283 R316 V322 Q323 A327 V328 S329 D330	L283-A325 HydrophobicContact CD1-CB 4.07Å; R316-A325 HydrophobicContact CG-CB 4.42Å; V322-A325 PolarHBondContact O-N 3.17Å; V322-A325 VanDerWaalsContact O-N 3.17Å; Q323-A325 VanDerWaalsContact C-N 3.35Å; A325-A327 VanDerWaalsContact C-N 3.35Å; A325-A327 PolarHBondContact O-N 2.91Å; A325-V328 PolarHBondContact O-N 3.09Å; A325-S329 PolarHBondContact O-N 3.09Å; A325-D330 PolarHBondContact O-N 3.16Å
326	I	93.6	Very high	93.6	Very high	2 Å²	2	38.2 Å²	38.2	1%	0.01	23%	0.229	C	C	.	.	H	α-helix	trans	-63.4	-40.1	179.5	-67.7	174.1	0	0	0	111.5	E270 F281 L283 V322 Q323 V328 S329	E270-I326 HydrophobicContact CB-CD1 4.21Å; E270-I326 HydrophobicContact CG-CD1 4.44Å; E270-I326 WeakPolarHBondContact OE2-CD1 3.13Å; F281-I326 HydrophobicContact CB-CD1 4.18Å; F281-I326 HydrophobicContact CB-CG1 3.99Å; F281-I326 HydrophobicContact CD1-CB 4.42Å; F281-I326 HydrophobicContact CD1-CG1 4.35Å; F281-I326 HydrophobicContact CD1-CG2 3.86Å; F281-I326 HydrophobicContact CD2-CG2 4.11Å; F281-I326 HydrophobicContact CE1-CG2 4.07Å; F281-I326 HydrophobicContact CE2-CG2 4.3Å; F281-I326 HydrophobicContact CG-CG1 4.22Å; F281-I326 HydrophobicContact CG-CG2 3.91Å; F281-I326 HydrophobicContact CZ-CG2 4.3Å; L283-I326 HydrophobicContact CD2-CD1 4.28Å; L283-I326 HydrophobicContact CD2-CG1 4.3Å; V322-I326 HydrophobicContact CB-CD1 4.31Å; V322-I326 HydrophobicContact CG2-CD1 4.44Å; V322-I326 WeakPolarHBondContact O-CG1 3.25Å; V322-I326 PolarHBondContact O-N 2.61Å; V322-I326 VanDerWaalsContact O-N 3.08Å; Q323-I326 PolarHBondContact O-N 3.05Å; I326-V328 PolarHBondContact O-N 3.15Å; I326-S329 PolarHBondContact O-N 3.13Å; I326-S329 VanDerWaalsContact O-N 3.16Å
327	A	93.1	Very high	93.6	Very high	81 Å²	81	39.8 Å²	39.8	67%	0.669	24%	0.243	S	C	*	.	H	α-helix	trans	-59.6	-31.9	-180	0	0	0	0	0	113.3	Q323 A325	Q323-A327 VanDerWaalsContact O-CB 3.23Å; Q323-A327 WeakPolarHBondContact O-CB 3.42Å; Q323-A327 PolarHBondContact O-N 3.45Å; A325-A327 VanDerWaalsContact C-N 3.35Å; A325-A327 PolarHBondContact O-N 2.91Å
328	V	95.1	Very high	93.6	Very high	105 Å²	105	41.7 Å²	41.7	64%	0.636	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.8	5.2	179.2	-59.3	0	0	0	0	113.5	A325 I326 D330	A325-V328 PolarHBondContact O-N 3.09Å; I326-V328 PolarHBondContact O-N 3.15Å; V328-D330 VanDerWaalsContact C-N 3.27Å; V328-D330 HydrophobicContact CG2-CB 3.87Å; V328-D330 PolarHBondContact O-N 2.82Å
329	S	94.6	Very high	93.6	Very high	61 Å²	61	41.1 Å²	41.1	43%	0.427	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.2	33.9	-177.2	-52.1	0	0	0	0	114.2	A325 I326 C331	A325-S329 PolarHBondContact O-N 3.09Å; I326-S329 PolarHBondContact O-N 3.13Å; I326-S329 VanDerWaalsContact O-N 3.16Å; S329-C331 VanDerWaalsContact C-N 3.27Å; S329-C331 PolarHBondContact O-N 3.4Å
330	D	96	Very high	93.7	Very high	69 Å²	69	46 Å²	46	37%	0.369	27%	0.274	S	S	.	.			trans	-90.9	63.8	175.3	-168.2	-1.2	0	0	0	110.6	R316 A325 V328	R316-D330 IonicContact CZ-OD2 3.68Å; R316-D330 IonicContact NH2-OD1 3.9Å; R316-D330 IonicContact NH2-OD2 2.57Å; R316-D330 PolarHBondContact NH2-OD2 2.95Å; A325-D330 PolarHBondContact O-N 3.16Å; V328-D330 VanDerWaalsContact C-N 3.27Å; V328-D330 HydrophobicContact CG2-CB 3.87Å; V328-D330 PolarHBondContact O-N 2.82Å
331	C	97.6	Very high	94	Very high	4 Å²	4	46.3 Å²	46.3	3%	0.027	28%	0.281	C	S	.	.	S	Bend	trans	-166	-179.4	178.5	59.1	0	0	0	0	110.2	A282 L283 S329 V333	A282-C331 WeakPolarHBondContact O-CB 3.4Å; L283-C331 HydrophobicContact CB-CB 3.81Å; S329-C331 VanDerWaalsContact C-N 3.27Å; S329-C331 PolarHBondContact O-N 3.4Å; C331-V333 PolarHBondContact O-N 2.91Å
332	L	98.1	Very high	94.5	Very high	7 Å²	7	46.1 Å²	46.1	4%	0.037	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	114.9	172.6	173.6	59.7	0	0	0	109.4	F281 A282 L300 L302 L309 W311 F334	F281-L332 WeakPolarHBondContact CA-O 3.36Å; A282-L332 HydrophobicContact CB-CB 4.15Å; A282-L332 HydrophobicContact CB-CD2 4.28Å; A282-L332 HydrophobicContact CB-CG 4.42Å; A282-L332 PolarHBondContact N-O 3.2Å; A282-L332 PolarHBondContact O-N 3.35Å; L300-L332 HydrophobicContact CB-CD2 3.8Å; L300-L332 HydrophobicContact CD1-CB 4.02Å; L300-L332 HydrophobicContact CD1-CD2 4.22Å; L302-L332 HydrophobicContact CG-CD2 4.48Å; L309-L332 HydrophobicContact CD2-CD1 3.87Å; L309-L332 HydrophobicContact CG-CD1 4.03Å; W311-L332 HydrophobicContact CB-CB 3.72Å; W311-L332 HydrophobicContact CB-CD1 3.96Å; W311-L332 HydrophobicContact CB-CD2 4.49Å; W311-L332 HydrophobicContact CB-CG 4.24Å; W311-L332 HydrophobicContact CG-CB 3.86Å; L332-F334 HydrophobicContact CD1-CD1 4.23Å; L332-F334 HydrophobicContact CD2-CD1 4.35Å; L332-F334 HydrophobicContact CD2-CE1 4.06Å; L332-F334 HydrophobicContact CG-CD1 3.87Å; L332-F334 HydrophobicContact CG-CE1 3.95Å
333	V	97.5	Very high	94.7	Very high	55 Å²	55	46.7 Å²	46.7	33%	0.333	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	132.7	-179.2	-172.4	0	0	0	0	110.7	I279 F280 F281 C331	I279-V333 HydrophobicContact CG2-CG1 3.48Å; I279-V333 VanDerWaalsContact CG2-CG1 3.48Å; F280-V333 WeakPolarHBondContact O-CA 3.5Å; F281-V333 HydrophobicContact CD1-CB 4.47Å; F281-V333 HydrophobicContact CD1-CG1 4.17Å; F281-V333 HydrophobicContact CD1-CG2 3.62Å; F281-V333 HydrophobicContact CE1-CB 4.47Å; F281-V333 HydrophobicContact CE1-CG1 3.81Å; F281-V333 HydrophobicContact CE1-CG2 3.78Å; F281-V333 HydrophobicContact CZ-CG1 4.29Å; C331-V333 PolarHBondContact O-N 2.91Å
334	F	96.9	Very high	94.9	Very high	9 Å²	9	49.2 Å²	49.2	4%	0.039	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	154.6	176.4	53.4	-86.1	0	0	0	112.2	L269 F280 A282 L302 L309 L332 T338 A339 L348	L269-F334 HydrophobicContact CD1-CE1 4.46Å; L269-F334 HydrophobicContact CD1-CZ 3.92Å; F280-F334 HydrophobicContact CB-CD1 4.33Å; F280-F334 HydrophobicContact CB-CD2 3.71Å; F280-F334 HydrophobicContact CB-CE1 4.02Å; F280-F334 HydrophobicContact CB-CE2 3.35Å; F280-F334 HydrophobicContact CB-CG 4.19Å; F280-F334 HydrophobicContact CB-CZ 3.52Å; F280-F334 HydrophobicContact CD1-CE2 4.16Å; F280-F334 HydrophobicContact CD1-CZ 4.49Å; F280-F334 HydrophobicContact CD2-CD2 4.09Å; F280-F334 AromaticContact CD2-CE2 3.95Å; F280-F334 HydrophobicContact CD2-CE2 3.95Å; F280-F334 HydrophobicContact CG-CD2 4.07Å; F280-F334 AromaticContact CG-CE2 3.57Å; F280-F334 HydrophobicContact CG-CE2 3.57Å; F280-F334 HydrophobicContact CG-CZ 4.09Å; F280-F334 PolarHBondContact N-O 3.31Å; F280-F334 PolarHBondContact O-N 2.87Å; F280-F334 VanDerWaalsContact O-N 3.12Å; A282-F334 HydrophobicContact CB-CE1 4.42Å; L302-F334 HydrophobicContact CD1-CD1 4.16Å; L302-F334 HydrophobicContact CD1-CD2 4.45Å; L302-F334 HydrophobicContact CD1-CE1 4.04Å; L302-F334 HydrophobicContact CD1-CE2 4.32Å; L302-F334 HydrophobicContact CD1-CG 4.37Å; L302-F334 HydrophobicContact CD1-CZ 4.12Å; L309-F334 HydrophobicContact CD2-CB 4.42Å; L332-F334 HydrophobicContact CD1-CD1 4.23Å; L332-F334 HydrophobicContact CD2-CD1 4.35Å; L332-F334 HydrophobicContact CD2-CE1 4.06Å; L332-F334 HydrophobicContact CG-CD1 3.87Å; L332-F334 HydrophobicContact CG-CE1 3.95Å; F334-T338 HydrophobicContact CB-CG2 3.76Å; F334-T338 HydrophobicContact CG-CG2 4.4Å; F334-A339 HydrophobicContact CD2-CB 3.91Å; F334-A339 HydrophobicContact CE2-CB 3.76Å; F334-L348 HydrophobicContact CE2-CD2 3.76Å; F334-L348 HydrophobicContact CZ-CD2 3.7Å
335	D	95.2	Very high	95	Very high	54 Å²	54	54 Å²	54	29%	0.289	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	174.3	179.7	68.8	-0.2	0	0	0	112.4	N337 T338 A339	D335-N337 VanDerWaalsContact C-N 3.28Å; D335-N337 PolarHBondContact O-N 3.45Å; D335-N337 PolarHBondContact OD1-N 2.95Å; D335-T338 PolarHBondContact O-N 3.2Å; D335-T338 WeakPolarHBondContact OD1-CB 3.26Å; D335-T338 PolarHBondContact OD1-N 3.37Å; D335-T338 PolarHBondContact OD1-OG1 2.93Å; D335-A339 PolarHBondContact O-N 3.2Å
336	S	93.5	Very high	95	Very high	13 Å²	13	55.3 Å²	55.3	9%	0.091	32%	0.324	C	S	.	.	H	α-helix	trans	-55.6	-41.8	175.7	-51.7	0	0	0	0	112.6	D277 Q278 T338 A339 H340	D277-S336 VanDerWaalsContact OD1-CB 3.26Å; D277-S336 WeakPolarHBondContact OD1-CB 3.26Å; D277-S336 PolarHBondContact OD1-OG 3.18Å; Q278-S336 WeakPolarHBondContact CB-OG 3.36Å; Q278-S336 PolarHBondContact N-OG 3.46Å; Q278-S336 PolarHBondContact O-N 3.33Å; Q278-S336 PolarHBondContact O-OG 3.39Å; S336-T338 VanDerWaalsContact C-N 3.34Å; S336-T338 PolarHBondContact O-N 3.23Å; S336-A339 WeakPolarHBondContact O-CB 3.37Å; S336-A339 PolarHBondContact O-N 3.28Å; S336-H340 PolarHBondContact O-N 3.16Å; S336-H340 PolarHBondContact O-ND1 3.41Å
337	N	93.5	Very high	95.1	Very high	106 Å²	106	57.3 Å²	57.3	57%	0.567	34%	0.335	S	S	*	.	H	α-helix	trans	-64.5	-41.2	-176.5	-65.1	-46.1	0	0	0	111.9	D335 S341	D335-N337 VanDerWaalsContact C-N 3.28Å; D335-N337 PolarHBondContact O-N 3.45Å; D335-N337 PolarHBondContact OD1-N 2.95Å; N337-S341 WeakPolarHBondContact O-CB 3.46Å; N337-S341 PolarHBondContact O-N 3.31Å; N337-S341 PolarHBondContact O-OG 2.8Å
338	T	95.3	Very high	95.3	Very high	42 Å²	42	53.5 Å²	53.5	26%	0.258	30%	0.303	S	S	.	.	H	α-helix	trans	-63.9	-47.5	174.4	-56.9	0	0	0	0	109.7	L309 F334 D335 S336 H340 S341 F342	L309-T338 HydrophobicContact CD2-CG2 4.16Å; F334-T338 HydrophobicContact CB-CG2 3.76Å; F334-T338 HydrophobicContact CG-CG2 4.4Å; D335-T338 PolarHBondContact O-N 3.2Å; D335-T338 WeakPolarHBondContact OD1-CB 3.26Å; D335-T338 PolarHBondContact OD1-N 3.37Å; D335-T338 PolarHBondContact OD1-OG1 2.93Å; S336-T338 VanDerWaalsContact C-N 3.34Å; S336-T338 PolarHBondContact O-N 3.23Å; T338-H340 PolarHBondContact O-N 2.96Å; T338-S341 WeakPolarHBondContact O-CB 3.26Å; T338-S341 PolarHBondContact O-N 3.03Å; T338-F342 HydrophobicContact CG2-CD2 3.86Å; T338-F342 HydrophobicContact CG2-CE2 3.7Å; T338-F342 WeakPolarHBondContact O-CD2 3.35Å; T338-F342 PolarHBondContact O-N 3.35Å
339	A	95.7	Very high	95.4	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-56	-46.9	177.5	0	0	0	0	0	112.2	I246 F280 F334 D335 S336 S341 F342 A343	I246-A339 HydrophobicContact CD1-CB 3.88Å; F280-A339 HydrophobicContact CD2-CB 4.01Å; F280-A339 HydrophobicContact CE2-CB 3.71Å; F280-A339 HydrophobicContact CZ-CB 4.06Å; F334-A339 HydrophobicContact CD2-CB 3.91Å; F334-A339 HydrophobicContact CE2-CB 3.76Å; D335-A339 PolarHBondContact O-N 3.2Å; S336-A339 WeakPolarHBondContact O-CB 3.37Å; S336-A339 PolarHBondContact O-N 3.28Å; A339-S341 VanDerWaalsContact C-N 3.3Å; A339-S341 PolarHBondContact O-N 3.43Å; A339-F342 PolarHBondContact O-N 3.46Å; A339-A343 VanDerWaalsContact O-CB 3.31Å; A339-A343 WeakPolarHBondContact O-CB 3.28Å; A339-A343 PolarHBondContact O-N 3.37Å
340	H	93.5	Very high	95.5	Very high	107 Å²	107	46.7 Å²	46.7	50%	0.495	27%	0.265	S	S	.	.	H	α-helix	trans	-67.5	-27.5	177.4	-71.2	85.3	0	0	0	113.3	S336 T338 F342	S336-H340 PolarHBondContact O-N 3.16Å; S336-H340 PolarHBondContact O-ND1 3.41Å; T338-H340 PolarHBondContact O-N 2.96Å; H340-F342 PolarHBondContact O-N 3.36Å
341	S	94.6	Very high	95.7	Very high	60 Å²	60	45.9 Å²	45.9	42%	0.42	26%	0.26	S	S	.	.	H	α-helix	trans	-72.5	-18	176.5	-63.7	0	0	0	0	113.5	N337 T338 A339	N337-S341 WeakPolarHBondContact O-CB 3.46Å; N337-S341 PolarHBondContact O-N 3.31Å; N337-S341 PolarHBondContact O-OG 2.8Å; T338-S341 WeakPolarHBondContact O-CB 3.26Å; T338-S341 PolarHBondContact O-N 3.03Å; A339-S341 VanDerWaalsContact C-N 3.3Å; A339-S341 PolarHBondContact O-N 3.43Å
342	F	96.9	Very high	95.7	Very high	23 Å²	23	45.7 Å²	45.7	10%	0.101	26%	0.259	C	S	.	.	H	α-helix	trans	-111.1	-11.8	178.5	-71.6	-70.7	0	0	0	113.6	L302 N303 R307 L309 T338 A339 H340 L348	L302-F342 HydrophobicContact CB-CB 4.19Å; L302-F342 HydrophobicContact CB-CD1 3.78Å; L302-F342 HydrophobicContact CB-CD2 3.94Å; L302-F342 HydrophobicContact CB-CE1 4.07Å; L302-F342 HydrophobicContact CB-CE2 4.23Å; L302-F342 HydrophobicContact CB-CG 3.72Å; L302-F342 HydrophobicContact CB-CZ 4.3Å; L302-F342 HydrophobicContact CD1-CD2 3.85Å; L302-F342 HydrophobicContact CD1-CE2 4.33Å; L302-F342 HydrophobicContact CD1-CG 4.28Å; L302-F342 WeakPolarHBondContact O-CE1 3.33Å; N303-F342 VanDerWaalsContact C-CD1 3.48Å; R307-F342 HydrophobicContact CB-CE1 3.93Å; R307-F342 HydrophobicContact CB-CZ 4.13Å; L309-F342 HydrophobicContact CB-CE2 4.06Å; L309-F342 HydrophobicContact CB-CZ 3.91Å; T338-F342 HydrophobicContact CG2-CD2 3.86Å; T338-F342 HydrophobicContact CG2-CE2 3.7Å; T338-F342 WeakPolarHBondContact O-CD2 3.35Å; T338-F342 PolarHBondContact O-N 3.35Å; A339-F342 PolarHBondContact O-N 3.46Å; H340-F342 PolarHBondContact O-N 3.36Å; F342-L348 HydrophobicContact CB-CD1 3.72Å
343	A	95.8	Very high	95.7	Very high	24 Å²	24	46.5 Å²	46.5	20%	0.198	26%	0.264	C	S	.	.			trans	-84	145.6	-178.4	0	0	0	0	0	113	I246 A339 N347 L348	I246-A343 HydrophobicContact CD1-CB 3.6Å; A339-A343 VanDerWaalsContact O-CB 3.31Å; A339-A343 WeakPolarHBondContact O-CB 3.28Å; A339-A343 PolarHBondContact O-N 3.37Å; A343-N347 CarbonylContact C-O 3.52Å; A343-N347 VanDerWaalsContact CA-O 3.23Å; A343-N347 WeakPolarHBondContact CA-O 3.43Å; A343-N347 WeakPolarHBondContact CB-O 3.32Å; A343-L348 HydrophobicContact CB-CD1 4.5Å
344	E	94	Very high	95.8	Very high	153 Å²	153	44 Å²	44	72%	0.715	25%	0.249	S	C	*	.	B	Isolated β-bridge	trans	-119.5	123.9	172.1	-67.2	-173.6	178.2	0	0	109.3	G346 N347	E344-G346 PolarHBondContact O-N 2.93Å; E344-N347 PolarHBondContact N-O 2.82Å; E344-N347 PolarHBondContact O-N 3.32Å
345	N	92	Very high	95.8	Very high	159 Å²	159	46.1 Å²	46.1	85%	0.85	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	36.5	-178.3	-55.3	-39.9	0	0	0	113.9	N347	N345-N347 VanDerWaalsContact C-N 3.26Å; N345-N347 PolarHBondContact O-N 2.95Å; N345-N347 PolarHBondContact O-ND2 3.23Å
346	G	92.8	Very high	95.9	Very high	27 Å²	27	49 Å²	49	28%	0.278	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.2	2.8	-178.7	0	0	0	0	0	114.9	D245 I246 E344	D245-G346 PolarHBondContact N-O 2.83Å; D245-G346 VanDerWaalsContact N-O 3.14Å; I246-G346 WeakPolarHBondContact CG1-O 3.4Å; I246-G346 PolarHBondContact N-O 3.48Å; E344-G346 PolarHBondContact O-N 2.93Å
347	N	95.6	Very high	95.8	Very high	45 Å²	45	51.6 Å²	51.6	24%	0.241	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-106.5	135.9	177.8	-49.5	-55.8	0	0	0	110.5	L242 A243 T244 A343 E344 N345	L242-N347 HydrophobicContact CD1-CB 3.78Å; L242-N347 HydrophobicContact CG-CB 4.3Å; A243-N347 CarbonylContact O-C 3.55Å; A243-N347 VanDerWaalsContact O-CA 3.3Å; A243-N347 WeakPolarHBondContact O-CA 3.23Å; T244-N347 VanDerWaalsContact CA-OD1 3.25Å; T244-N347 WeakPolarHBondContact CA-OD1 3.43Å; T244-N347 VanDerWaalsContact CB-OD1 3.25Å; T244-N347 WeakPolarHBondContact CB-OD1 3.35Å; T244-N347 WeakPolarHBondContact CG2-OD1 3.32Å; A343-N347 CarbonylContact C-O 3.52Å; A343-N347 VanDerWaalsContact CA-O 3.23Å; A343-N347 WeakPolarHBondContact CA-O 3.43Å; A343-N347 WeakPolarHBondContact CB-O 3.32Å; E344-N347 PolarHBondContact N-O 2.82Å; E344-N347 PolarHBondContact O-N 3.32Å; N345-N347 VanDerWaalsContact C-N 3.26Å; N345-N347 PolarHBondContact O-N 2.95Å; N345-N347 PolarHBondContact O-ND2 3.23Å
348	L	97.1	Very high	95	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	114.1	176.1	-175.2	67.5	0	0	0	109.5	A243 I246 L269 L302 F334 F342 A343 I350	A243-L348 HydrophobicContact CB-CB 4.49Å; A243-L348 PolarHBondContact N-O 3.15Å; A243-L348 PolarHBondContact O-N 3.19Å; I246-L348 HydrophobicContact CD1-CB 4.35Å; I246-L348 HydrophobicContact CG2-CB 3.75Å; L269-L348 HydrophobicContact CD2-CD2 4.44Å; L302-L348 HydrophobicContact CD2-CD1 4.04Å; L302-L348 HydrophobicContact CD2-CD2 4.24Å; L302-L348 HydrophobicContact CD2-CG 4.14Å; F334-L348 HydrophobicContact CE2-CD2 3.76Å; F334-L348 HydrophobicContact CZ-CD2 3.7Å; F342-L348 HydrophobicContact CB-CD1 3.72Å; A343-L348 HydrophobicContact CB-CD1 4.5Å; L348-I350 HydrophobicContact CD2-CD1 4.37Å; L348-I350 HydrophobicContact CD2-CG1 4.41Å; L348-I350 HydrophobicContact CG-CG1 4.29Å
349	G	97	Very high	93.5	Very high	24 Å²	24	54.7 Å²	54.7	25%	0.247	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	121.7	171.5	0	0	0	0	0	110.8
350	I	98.2	Very high	91.5	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	116	173.7	-44.3	-172.4	0	0	0	107.4	F241 L269 A282 L300 L302 L348 V352	F241-I350 HydrophobicContact CB-CB 4.33Å; F241-I350 HydrophobicContact CD1-CD1 4.32Å; F241-I350 PolarHBondContact N-O 2.88Å; F241-I350 PolarHBondContact O-N 3.43Å; L269-I350 HydrophobicContact CD1-CD1 4.25Å; L269-I350 HydrophobicContact CD2-CD1 4.39Å; A282-I350 HydrophobicContact CB-CD1 4.35Å; L300-I350 HydrophobicContact CB-CG2 4.04Å; L300-I350 HydrophobicContact CD2-CG2 4.12Å; L302-I350 HydrophobicContact CD2-CB 4.18Å; L302-I350 HydrophobicContact CD2-CD1 4.21Å; L302-I350 HydrophobicContact CD2-CG1 3.64Å; L302-I350 HydrophobicContact CD2-CG2 4.11Å; L348-I350 HydrophobicContact CD2-CD1 4.37Å; L348-I350 HydrophobicContact CD2-CG1 4.41Å; L348-I350 HydrophobicContact CG-CG1 4.29Å; I350-V352 HydrophobicContact CB-CG2 4.46Å; I350-V352 HydrophobicContact CG2-CG2 4.13Å; I350-V352 WeakPolarHBondContact O-CG2 3.23Å
351	N	98.2	Very high	88.9	Confident	52 Å²	52	62.9 Å²	62.9	28%	0.278	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	129.9	171.3	-68	-8.4	0	0	0	108.2	L300 E301 N303	L300-N351 WeakPolarHBondContact CA-O 3.39Å; E301-N351 HydrophobicContact CB-CB 4.18Å; E301-N351 PolarHBondContact N-O 3.14Å; E301-N351 PolarHBondContact O-N 2.64Å; N303-N351 PolarHBondContact ND2-ND2 2.86Å
352	V	98.6	Very high	86	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	111.5	-176.6	-170.8	0	0	0	0	109.7	D238 I239 F241 L267 V284 R299 L300 I350	D238-V352 WeakPolarHBondContact CA-O 3.43Å; I239-V352 HydrophobicContact CG1-CB 4.19Å; I239-V352 PolarHBondContact N-O 3.22Å; I239-V352 PolarHBondContact O-N 3.49Å; F241-V352 HydrophobicContact CB-CG2 4.04Å; L267-V352 HydrophobicContact CD2-CB 3.76Å; L267-V352 HydrophobicContact CD2-CG1 3.58Å; L267-V352 HydrophobicContact CD2-CG2 3.55Å; V284-V352 HydrophobicContact CG2-CG1 4.24Å; R299-V352 WeakPolarHBondContact O-CA 3.33Å; L300-V352 HydrophobicContact CD2-CB 4.17Å; L300-V352 HydrophobicContact CD2-CG1 3.78Å; L300-V352 HydrophobicContact CD2-CG2 3.55Å; I350-V352 HydrophobicContact CB-CG2 4.46Å; I350-V352 HydrophobicContact CG2-CG2 4.13Å; I350-V352 WeakPolarHBondContact O-CG2 3.23Å
353	T	98.5	Very high	85.5	Confident	24 Å²	24	71 Å²	71	15%	0.147	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	128.6	176	-44.5	0	0	0	0	109.4	E237 D238 Y298 R299	E237-T353 CarbonylContact O-C 3.43Å; E237-T353 VanDerWaalsContact O-CA 3.25Å; E237-T353 WeakPolarHBondContact O-CA 3.21Å; D238-T353 HydrophobicContact CB-CG2 4.44Å; D238-T353 PolarHBondContact OD1-OG1 3.24Å; Y298-T353 CarbonylContact C-O 3.59Å; Y298-T353 VanDerWaalsContact CA-O 3.28Å; Y298-T353 WeakPolarHBondContact CA-O 3.41Å; R299-T353 PolarHBondContact N-O 3.46Å; R299-T353 PolarHBondContact NH2-OG1 2.73Å; R299-T353 PolarHBondContact O-N 3.32Å
354	I	98.4	Very high	84.9	Confident	3 Å²	3	73.5 Å²	73.5	2%	0.015	44%	0.443	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	136.5	172.5	-60	-176.8	0	0	0	108.3	E237 Q258 F261 F265 V284 F296	E237-I354 PolarHBondContact O-N 2.85Å; Q258-I354 HydrophobicContact CG-CD1 4.21Å; Q258-I354 VanDerWaalsContact OE1-CD1 3.3Å; F261-I354 HydrophobicContact CD2-CG2 4.26Å; F261-I354 HydrophobicContact CE2-CB 4.5Å; F261-I354 HydrophobicContact CE2-CG2 4.12Å; F261-I354 WeakPolarHBondContact CE2-O 3.28Å; F265-I354 HydrophobicContact CB-CD1 3.6Å; F265-I354 HydrophobicContact CD1-CD1 3.72Å; F265-I354 HydrophobicContact CD2-CD1 3.47Å; F265-I354 VanDerWaalsContact CD2-CD1 3.47Å; F265-I354 HydrophobicContact CE1-CD1 4.2Å; F265-I354 HydrophobicContact CE1-CG2 4.08Å; F265-I354 HydrophobicContact CE2-CD1 4Å; F265-I354 HydrophobicContact CE2-CG2 4.05Å; F265-I354 HydrophobicContact CG-CD1 3.31Å; F265-I354 HydrophobicContact CZ-CD1 4.34Å; F265-I354 HydrophobicContact CZ-CG2 3.78Å; V284-I354 HydrophobicContact CG1-CD1 4.35Å; F296-I354 HydrophobicContact CB-CG2 4.46Å; F296-I354 HydrophobicContact CD1-CG2 4.12Å
355	S	97.8	Very high	84.4	Confident	52 Å²	52	69.1 Å²	69.1	36%	0.364	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	149.1	179.7	58.1	0	0	0	0	110.5	F296 V297	F296-S355 CarbonylContact C-O 3.54Å; F296-S355 VanDerWaalsContact CA-O 3.23Å; F296-S355 WeakPolarHBondContact CA-O 3.44Å; V297-S355 PolarHBondContact N-O 3.35Å; V297-S355 PolarHBondContact O-N 2.96Å; V297-S355 PolarHBondContact O-OG 3.14Å
356	Q	96.4	Very high	84	Confident	114 Å²	114	63.8 Å²	63.8	53%	0.533	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	137.3	170.8	-70.3	-178.5	-51.3	0	0	110	F261 Q295 F296 S358	F261-Q356 HydrophobicContact CD1-CG 3.9Å; F261-Q356 HydrophobicContact CD2-CG 4.37Å; F261-Q356 HydrophobicContact CE1-CG 4.16Å; F261-Q356 HydrophobicContact CG-CG 4.03Å; Q295-Q356 CarbonylContact O-C 3.6Å; Q295-Q356 WeakPolarHBondContact O-CA 3.15Å; F296-Q356 HydrophobicContact CD1-CG 3.9Å; F296-Q356 HydrophobicContact CE1-CG 3.52Å; F296-Q356 HydrophobicContact CZ-CG 4.42Å; Q356-S358 PolarHBondContact O-N 2.88Å
357	V	91.7	Very high	83.4	Confident	69 Å²	69	66.1 Å²	66.1	42%	0.418	41%	0.411	S	S	.	.			trans	-68.5	112	169.1	179.6	0	0	0	0	107.1	Q295 V297	Q295-V357 PolarHBondContact O-N 3.46Å; V297-V357 HydrophobicContact CG2-CG2 3.68Å
358	S	77.7	Confident	82.6	Confident	95 Å²	95	67.5 Å²	67.5	66%	0.664	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-57.1	126	171.1	46.6	0	0	0	0	108.4	Q356 S360	Q356-S358 PolarHBondContact O-N 2.88Å; S358-S360 PolarHBondContact O-N 3.04Å
359	P	63.4	Low	81.6	Confident	117 Å²	117	72.3 Å²	72.3	76%	0.76	45%	0.452	S	S	*	.	P	Polyproline II helix	trans	-55.7	117.6	174.4	20.7	-29	0	0	0	107.1	I361	P359-I361 PolarHBondContact O-N 3.25Å
360	S	54.2	Low	80.4	Confident	103 Å²	103	76 Å²	76	72%	0.72	47%	0.468	S	S	*	.	P	Polyproline II helix	trans	-56.3	120.1	169.4	34.1	0	0	0	0	106.1	S358 S362	S358-S360 PolarHBondContact O-N 3.04Å; S360-S362 PolarHBondContact O-N 2.81Å
361	I	37.9	Very low	78.9	Confident	177 Å²	177	82.3 Å²	82.3	91%	0.908	51%	0.507	S	S	*	.			trans	-57.4	108	169.2	-60.8	168.9	0	0	0	104.8	P359	P359-I361 PolarHBondContact O-N 3.25Å
362	S	34.1	Very low	77.1	Confident	182 Å²	182	85.1 Å²	85.1	100%	1.273	53%	0.527	S	S	*	.			trans	-101.3	0	165.6	45.9	0	0	0	0	108.6	S360	S360-S362 PolarHBondContact O-N 2.81Å

Retrieved 362 of 362 residues in 912.4 ms (Link to these results)

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