A0A087XLU7_POEFO Loading...

GTP binding elongation factor GUF1

Promotes mitochondrial protein synthesis. May act as a fidelity factor of the translation reaction, by catalyzing a one-codon backward translocation of tRNAs on improperly translocated ribosomes. Binds to mitochondrial ribosomes in a GTP-dependent manner.

AlphaFold DB , UniProt , Accession A0A087XLU7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 675 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	31.6	Very low	25.3	Very low	228 Å²	228	156.1 Å²	156.1	100%	1.123	79%	0.786	S	S	*	*				0	112	0	-76	168	171.4	0	0	106.8
2	T	25.8	Very low	25.4	Very low	118 Å²	118	157.4 Å²	157.4	72%	0.724	79%	0.794	S	S	*	*				70.7	134.1	66.3	60.2	0	0	0	0	113
3	Y	23.9	Very low	25.3	Very low	190 Å²	190	153 Å²	153	75%	0.745	79%	0.787	S	S	*	*			cis	-178.2	154.6	-21.6	-133.4	-74.2	0	0	0	107.4
4	F	26.7	Very low	25.4	Very low	155 Å²	155	153 Å²	153	68%	0.68	79%	0.788	S	S	*	*			trans	62.6	163.4	172.4	-70.8	-80.1	0	0	0	116.5	V6	F4-V6 HydrophobicContact CD1-CB 4.21Å; F4-V6 HydrophobicContact CD1-CG2 3.62Å; F4-V6 HydrophobicContact CE1-CG2 4.03Å
5	L	26.1	Very low	25.5	Very low	159 Å²	159	153.7 Å²	153.7	83%	0.832	79%	0.792	S	S	*	*			cis	-114	156.9	-8	-71.8	80.4	0	0	0	108.9
6	V	25.4	Very low	25.5	Very low	97 Å²	97	148.6 Å²	148.6	59%	0.588	79%	0.789	S	S	*	*			cis	92.6	119.1	19.6	179.4	0	0	0	0	116.3	F4	F4-V6 HydrophobicContact CD1-CB 4.21Å; F4-V6 HydrophobicContact CD1-CG2 3.62Å; F4-V6 HydrophobicContact CE1-CG2 4.03Å
7	K	24.5	Very low	25.6	Very low	178 Å²	178	154.8 Å²	154.8	77%	0.774	80%	0.799	S	S	*	*			trans	68.3	115.2	166	-78.1	178	175.8	-177.4	0	119.6
8	Q	23.7	Very low	25.6	Very low	196 Å²	196	153.7 Å²	153.7	92%	0.916	80%	0.8	S	S	*	*				-135.1	156.2	106.6	-151.9	163.4	4.4	0	0	109.4
9	L	23.4	Very low	25.7	Very low	138 Å²	138	154.1 Å²	154.1	72%	0.723	80%	0.802	S	S	*	*			trans	-125.4	142.4	-175.6	-80.5	153.2	0	0	0	109
10	C	23.5	Very low	26	Very low	115 Å²	115	151.9 Å²	151.9	78%	0.777	80%	0.798	S	S	*	*			trans	-168.2	124.6	130.6	-104.1	0	0	0	0	110.9
11	D	24	Very low	26	Very low	143 Å²	143	154.4 Å²	154.4	77%	0.765	80%	0.803	S	S	*	*			trans	24.4	123.7	140.4	-46	-38.1	0	0	0	120.5
12	I	26.2	Very low	25.6	Very low	172 Å²	172	153.3 Å²	153.3	88%	0.882	79%	0.792	S	S	*	*				-151.9	143.9	102.4	-96.8	153.5	0	0	0	108.3
13	S	23.6	Very low	25.6	Very low	100 Å²	100	154 Å²	154	70%	0.699	80%	0.795	S	S	*	*			trans	-92.5	156	179.2	56.7	0	0	0	0	111.7
14	L	26.9	Very low	25.6	Very low	153 Å²	153	150.4 Å²	150.4	80%	0.801	80%	0.797	S	S	*	*			trans	179.5	132.3	132	-94.4	160.6	0	0	0	112.2
15	L	26.8	Very low	25.5	Very low	164 Å²	164	154.3 Å²	154.3	86%	0.859	81%	0.807	S	S	*	*			trans	39.7	108.2	151.2	-63.5	169.3	0	0	0	121.1
16	G	25.6	Very low	25.4	Very low	71 Å²	71	158 Å²	158	73%	0.732	81%	0.81	S	S	*	*				124.1	115.1	103.9	0	0	0	0	0	120.1
17	R	27.1	Very low	25.4	Very low	254 Å²	254	163.2 Å²	163.2	96%	0.958	83%	0.825	S	S	*	*			trans	64.2	86.9	152.5	-60.3	-175.5	178.2	-174.6	-0.1	118.2
18	V	26.5	Very low	25.6	Very low	135 Å²	135	162.7 Å²	162.7	82%	0.818	83%	0.829	S	S	*	*			trans	-89.7	137.1	157.6	174.5	0	0	0	0	110.4
19	L	27.7	Very low	25.9	Very low	161 Å²	161	158.5 Å²	158.5	84%	0.843	82%	0.819	S	S	*	*			trans	-107.4	126.8	158.6	-81.1	170.5	0	0	0	109	F21	L19-F21 PolarHBondContact O-N 3.3Å
20	P	31.5	Very low	26.1	Very low	111 Å²	111	156.2 Å²	156.2	72%	0.721	81%	0.814	S	S	*	*			trans	-86.2	116.4	-169.6	31.5	-34.2	0	0	0	113.6	K22	P20-K22 PolarHBondContact O-N 3.01Å
21	F	25.1	Very low	26.4	Very low	204 Å²	204	161.1 Å²	161.1	90%	0.895	82%	0.818	S	S	*	*			trans	-67.2	112.9	164.4	-96.3	-92.8	0	0	0	110.8	L19 V23	L19-F21 PolarHBondContact O-N 3.3Å; F21-V23 PolarHBondContact O-N 2.68Å
22	K	24.6	Very low	26.4	Very low	205 Å²	205	161.1 Å²	161.1	89%	0.891	82%	0.818	S	S	*	*			trans	-85.7	89.1	174.4	-114.6	179.3	179.1	175.6	0	111	P20 C24	P20-K22 PolarHBondContact O-N 3.01Å; K22-C24 PolarHBondContact O-N 3.43Å
23	V	25.1	Very low	26.5	Very low	133 Å²	133	160.2 Å²	160.2	81%	0.806	81%	0.813	S	S	*	*			trans	-68.4	122.2	170	180	0	0	0	0	109.4	F21	F21-V23 PolarHBondContact O-N 2.68Å
24	C	23.8	Very low	26.4	Very low	115 Å²	115	160.9 Å²	160.9	78%	0.777	82%	0.816	S	S	*	*			trans	-131	108.4	176.5	-161.8	0	0	0	0	110.7	K22	K22-C24 PolarHBondContact O-N 3.43Å
25	R	23.7	Very low	26.4	Very low	237 Å²	237	163.9 Å²	163.9	89%	0.894	82%	0.819	S	S	*	*			trans	-81.5	127.3	174.2	-74.6	178.6	169.2	177.1	-3.9	110.1
26	R	23.9	Very low	26.2	Very low	237 Å²	237	167.4 Å²	167.4	89%	0.894	82%	0.821	S	S	*	*			trans	-131	144.4	155.6	-84.5	-170.6	167.8	-175.7	-4.2	110.4
27	K	26.1	Very low	26.3	Very low	205 Å²	205	169.8 Å²	169.8	89%	0.891	82%	0.82	S	S	*	*			trans	-75.9	146.1	178.7	-65.8	179.1	176.1	-178.9	0	110
28	I	29.6	Very low	26.2	Very low	167 Å²	167	165.4 Å²	165.4	86%	0.856	82%	0.815	S	S	*	*			trans	-103	131	168.5	-59.5	165.9	0	0	0	108.7
29	P	29.8	Very low	26.2	Very low	109 Å²	109	168.4 Å²	168.4	71%	0.708	81%	0.812	S	S	*	*			trans	-122.2	111.3	154	32.9	-19.6	0	0	0	111.4
30	S	27.7	Very low	26.2	Very low	90 Å²	90	167.8 Å²	167.8	63%	0.629	80%	0.804	S	S	*	*			trans	42.4	137.5	136.6	65.6	0	0	0	0	123.1
31	Y	28.9	Very low	26	Very low	218 Å²	218	172.5 Å²	172.5	86%	0.855	81%	0.808	S	S	*	*			trans	96.2	142.1	153.9	-76.9	-70.5	0	0	0	121.1
32	N	25	Very low	26.1	Very low	143 Å²	143	170.2 Å²	170.2	77%	0.765	80%	0.804	S	S	*	*			trans	-75.9	157.4	-174.9	-53.4	-45.6	0	0	0	112.1
33	I	26.5	Very low	26.3	Very low	152 Å²	152	165.6 Å²	165.6	78%	0.779	79%	0.793	S	S	*	*			trans	-153.1	141.6	137.6	-104.8	148.2	0	0	0	108.9	Y35	I33-Y35 HydrophobicContact CG2-CD2 3.56Å; I33-Y35 HydrophobicContact CG2-CE2 3.64Å
34	C	21.6	Very low	26.5	Very low	114 Å²	114	168.4 Å²	168.4	77%	0.77	79%	0.794	S	S	*	*			trans	-106	134.5	178.9	173.4	0	0	0	0	109.6
35	Y	27.9	Very low	26.7	Very low	216 Å²	216	168.5 Å²	168.5	85%	0.847	80%	0.796	S	S	*	*			trans	-141	167	167.6	-86.8	-63.6	0	0	0	113.4	I33	I33-Y35 HydrophobicContact CG2-CD2 3.56Å; I33-Y35 HydrophobicContact CG2-CE2 3.64Å
36	R	22.8	Very low	26.7	Very low	239 Å²	239	164.8 Å²	164.8	90%	0.902	79%	0.793	S	S	*	*			trans	-128.2	151.6	-142.9	-169.3	177.1	-178.3	179.7	0.8	112.9
37	V	27.7	Very low	27.1	Very low	120 Å²	120	159 Å²	159	73%	0.727	79%	0.786	S	S	*	*			trans	-59.8	141.9	-175.6	177	0	0	0	0	115.1
38	L	25.5	Very low	27.4	Very low	162 Å²	162	155.2 Å²	155.2	85%	0.848	78%	0.78	S	S	*	*			trans	-164.2	124.4	145.3	-92.6	149.7	0	0	0	105.9
39	R	25.6	Very low	27.2	Very low	199 Å²	199	155.1 Å²	155.1	75%	0.751	78%	0.781	S	S	*	*				55.1	135.7	61.5	-70.4	-169.5	178.9	-166.1	1.5	112.7
40	H	27.6	Very low	27.3	Very low	148 Å²	148	155.5 Å²	155.5	69%	0.685	79%	0.785	S	S	*	*			cis	-159.9	-177.2	11.2	-132.8	-5.1	0	0	0	109.2
41	R	27.1	Very low	27.2	Very low	210 Å²	210	156.5 Å²	156.5	79%	0.792	79%	0.792	S	S	*	*			cis	-160.5	-153.4	8.1	-149.3	171.4	-179.7	-174	-1.5	109.2
42	L	27.6	Very low	27.1	Very low	155 Å²	155	151.5 Å²	151.5	81%	0.812	79%	0.79	S	S	*	*			trans	78.5	139.9	168.2	-58.6	175.9	0	0	0	118.8
43	V	29.7	Very low	27.1	Very low	109 Å²	109	154.7 Å²	154.7	66%	0.661	80%	0.797	S	S	*	*			cis	-164.6	137.5	-30.8	105	0	0	0	0	111.1
44	K	28.4	Very low	27.1	Very low	192 Å²	192	158.4 Å²	158.4	84%	0.835	80%	0.801	S	S	*	*			trans	54.3	153.7	163	-60.7	177	-174.4	-179	0	117.8
45	S	27.6	Very low	27.3	Very low	117 Å²	117	157.8 Å²	157.8	82%	0.818	80%	0.798	S	S	*	*			cis	-155.7	173	-4.7	29.6	0	0	0	0	111.1
46	L	23.6	Very low	27.4	Very low	159 Å²	159	155.6 Å²	155.6	83%	0.832	80%	0.8	S	S	*	*			trans	-66.6	173	179.7	-75.2	160	0	0	0	114.5
47	P	33.8	Very low	27.5	Very low	115 Å²	115	149.2 Å²	149.2	75%	0.747	79%	0.793	S	S	*	*			cis	-135.3	161.6	12.3	35.7	-15.3	0	0	0	119.2
48	V	30.6	Very low	27.7	Very low	126 Å²	126	149.6 Å²	149.6	76%	0.764	80%	0.795	S	S	*	*			trans	35.6	114.4	143.3	-174.6	0	0	0	0	120.5
49	L	26.9	Very low	27.9	Very low	165 Å²	165	150.4 Å²	150.4	86%	0.864	80%	0.795	S	S	*	*				-154.3	147.1	122.8	-111.7	168.4	0	0	0	109.8	S51	L49-S51 PolarHBondContact O-N 3.14Å
50	S	30.5	Very low	28.2	Very low	116 Å²	116	146.8 Å²	146.8	81%	0.811	80%	0.797	S	S	*	*			trans	-81.8	115.4	-170.1	53.2	0	0	0	0	112.8
51	S	25.8	Very low	28.6	Very low	111 Å²	111	143.8 Å²	143.8	78%	0.776	80%	0.798	S	S	*	*			trans	-106.1	123.5	169.9	50.7	0	0	0	0	111.4	L49 F53	L49-S51 PolarHBondContact O-N 3.14Å; S51-F53 PolarHBondContact O-N 2.87Å
52	S	26.7	Very low	29.3	Very low	114 Å²	114	140.9 Å²	140.9	80%	0.797	79%	0.791	S	S	*	*			trans	-52.3	124.2	-171.7	-44.5	0	0	0	0	113.8	R54	S52-R54 PolarHBondContact O-N 3.21Å
53	F	25.6	Very low	30.1	Very low	209 Å²	209	140.5 Å²	140.5	92%	0.917	79%	0.79	S	S	*	*			trans	-59.9	103.8	157.6	-102.8	-98.4	0	0	0	108.1	S51 S55	S51-F53 PolarHBondContact O-N 2.87Å; F53-S55 PolarHBondContact O-N 3.37Å
54	R	26	Very low	31.5	Very low	230 Å²	230	139.7 Å²	139.7	87%	0.868	79%	0.794	S	S	*	*			trans	-67.8	101.7	158.8	-76.6	-174.5	174.1	-175.4	-2.2	106.7	S52 L56	S52-R54 PolarHBondContact O-N 3.21Å; R54-L56 PolarHBondContact O-N 3.22Å
55	S	27.5	Very low	33.4	Very low	102 Å²	102	132.5 Å²	132.5	71%	0.713	77%	0.767	S	S	*	*			trans	-49.6	139.3	156.7	41.5	0	0	0	0	108.2	F53 S57	F53-S55 PolarHBondContact O-N 3.37Å; S55-S57 PolarHBondContact O-N 2.86Å
56	L	28.4	Very low	35.8	Very low	169 Å²	169	130.6 Å²	130.6	89%	0.885	75%	0.747	S	S	*	*			trans	-62.7	114.1	165.3	-80.8	81.6	0	0	0	105.6	R54 T58	R54-L56 PolarHBondContact O-N 3.22Å; L56-T58 PolarHBondContact O-N 3.16Å
57	S	26.5	Very low	38.6	Very low	106 Å²	106	123.3 Å²	123.3	74%	0.741	71%	0.709	S	S	*	*			trans	-60.4	111.1	176.5	52.2	0	0	0	0	108	S55 Q59	S55-S57 PolarHBondContact O-N 2.86Å; S57-Q59 PolarHBondContact O-N 3.41Å
58	T	30.4	Very low	40.6	Very low	128 Å²	128	121.3 Å²	121.3	79%	0.785	70%	0.698	S	S	*	*			trans	-44.8	131.7	152.9	42.2	0	0	0	0	107.5	L56	L56-T58 PolarHBondContact O-N 3.16Å
59	Q	29.2	Very low	43.2	Very low	178 Å²	178	121.3 Å²	121.3	83%	0.832	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-50.3	137.9	166.2	-67.5	170.1	-21.4	0	0	107.6	S57 A61	S57-Q59 PolarHBondContact O-N 3.41Å; Q59-A61 PolarHBondContact O-N 3.34Å; Q59-A61 VanDerWaalsContact O-N 3.17Å
60	P	32.2	Very low	46.1	Very low	124 Å²	124	114 Å²	114	81%	0.805	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-55.2	128.8	176.8	24.4	-33	0	0	0	107.9	K62	P60-K62 PolarHBondContact O-N 2.83Å
61	A	35.8	Very low	48.8	Very low	85 Å²	85	111 Å²	111	70%	0.702	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-56.4	140.4	171.3	0	0	0	0	0	108	Q59 D63	Q59-A61 PolarHBondContact O-N 3.34Å; Q59-A61 VanDerWaalsContact O-N 3.17Å; A61-D63 PolarHBondContact O-N 2.76Å
62	K	42.8	Very low	51.8	Low	149 Å²	149	106.5 Å²	106.5	65%	0.648	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-47	129	167.4	-72.7	-175.1	175.4	-175.2	0	107.1	P60 A64	P60-K62 PolarHBondContact O-N 2.83Å; K62-A64 PolarHBondContact O-N 3.38Å
63	D	45.1	Very low	54.9	Low	146 Å²	146	105.8 Å²	105.8	78%	0.781	58%	0.582	S	S	*	*			trans	-49.5	111.8	-170.5	-64.7	-78.7	0	0	0	110.8	A61 V65	A61-D63 PolarHBondContact O-N 2.76Å; D63-V65 PolarHBondContact O-N 3.4Å
64	A	58	Low	58.1	Low	92 Å²	92	98.4 Å²	98.4	76%	0.76	55%	0.549	S	S	*	.			trans	-71.1	101.3	-170.6	0	0	0	0	0	108.9	K62 D66	K62-A64 PolarHBondContact O-N 3.38Å; A64-D66 PolarHBondContact O-N 2.99Å; A64-D66 VanDerWaalsContact O-N 3.1Å
65	V	69.4	Low	61.3	Low	42 Å²	42	87.4 Å²	87.4	26%	0.255	51%	0.508	S	S	.	.			trans	-63.2	117.2	-175	-171.4	0	0	0	0	109.8	D63 L67 F133	D63-V65 PolarHBondContact O-N 3.4Å; V65-L67 HydrophobicContact CB-CD2 4.32Å; V65-L67 HydrophobicContact CG1-CD2 3.86Å; V65-L67 PolarHBondContact O-N 3.21Å; V65-F133 HydrophobicContact CG1-CE1 4.48Å; V65-F133 HydrophobicContact CG1-CE2 3.94Å; V65-F133 HydrophobicContact CG1-CZ 3.66Å; V65-F133 HydrophobicContact CG2-CE2 4.28Å
66	D	77.4	Confident	64.6	Low	77 Å²	77	83.7 Å²	83.7	41%	0.412	48%	0.478	S	S	.	.			trans	-76.8	90.3	177.3	178.8	12.2	0	0	0	110.6	A64 S68 K69	A64-D66 PolarHBondContact O-N 2.99Å; A64-D66 VanDerWaalsContact O-N 3.1Å; D66-S68 PolarHBondContact O-N 3.25Å; D66-S68 VanDerWaalsContact O-N 3.12Å; D66-S68 WeakPolarHBondContact OD1-CB 3.27Å; D66-S68 PolarHBondContact OD1-N 3.06Å; D66-S68 VanDerWaalsContact OD1-N 3.12Å; D66-S68 PolarHBondContact OD1-OG 2.89Å; D66-S68 PolarHBondContact OD2-OG 3.11Å; D66-K69 HydrophobicContact CB-CD 4.22Å; D66-K69 HydrophobicContact CB-CG 4.41Å; D66-K69 WeakPolarHBondContact O-CG 3.48Å; D66-K69 PolarHBondContact O-N 2.99Å; D66-K69 WeakPolarHBondContact OD2-CE 3.32Å
67	L	81.4	Confident	67.8	Low	5 Å²	5	75.9 Å²	75.9	3%	0.026	44%	0.437	C	S	.	.	G	3₁₀ helix	trans	-66.8	-5.9	179.9	-58.8	-171.2	0	0	0	114.3	V65 K69 L309 T317 L320 F321 Q324	V65-L67 HydrophobicContact CB-CD2 4.32Å; V65-L67 HydrophobicContact CG1-CD2 3.86Å; V65-L67 PolarHBondContact O-N 3.21Å; L67-K69 PolarHBondContact O-N 3.38Å; L67-L309 HydrophobicContact CD1-CD1 4.19Å; L67-L309 HydrophobicContact CD1-CD2 4.18Å; L67-L309 HydrophobicContact CD1-CG 3.99Å; L67-L309 HydrophobicContact CD2-CD1 3.59Å; L67-L309 HydrophobicContact CD2-CG 4.3Å; L67-T317 HydrophobicContact CD1-CG2 3.91Å; L67-T317 HydrophobicContact CG-CG2 4.34Å; L67-L320 HydrophobicContact CD1-CD2 3.96Å; L67-F321 HydrophobicContact CB-CD2 4.14Å; L67-F321 HydrophobicContact CB-CE2 4.11Å; L67-Q324 PolarHBondContact O-NE2 2.95Å
68	S	77.5	Confident	71.1	Confident	74 Å²	74	70.9 Å²	70.9	52%	0.517	40%	0.402	S	S	.	.	G	3₁₀ helix	trans	-73.2	-15.8	174.3	73.2	0	0	0	0	113.3	D66 F70	D66-S68 PolarHBondContact O-N 3.25Å; D66-S68 VanDerWaalsContact O-N 3.12Å; D66-S68 WeakPolarHBondContact OD1-CB 3.27Å; D66-S68 PolarHBondContact OD1-N 3.06Å; D66-S68 VanDerWaalsContact OD1-N 3.12Å; D66-S68 PolarHBondContact OD1-OG 2.89Å; D66-S68 PolarHBondContact OD2-OG 3.11Å; S68-F70 VanDerWaalsContact C-N 3.26Å; S68-F70 PolarHBondContact O-N 3.08Å
69	K	84.4	Confident	74.1	Confident	126 Å²	126	64.8 Å²	64.8	55%	0.548	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-73.1	-14.3	176.5	-63.6	175.9	179.4	178.6	0	114.3	D66 L67 P71	D66-K69 HydrophobicContact CB-CD 4.22Å; D66-K69 HydrophobicContact CB-CG 4.41Å; D66-K69 WeakPolarHBondContact O-CG 3.48Å; D66-K69 PolarHBondContact O-N 2.99Å; D66-K69 WeakPolarHBondContact OD2-CE 3.32Å; L67-K69 PolarHBondContact O-N 3.38Å; K69-P71 VanDerWaalsContact C-CD 3.43Å; K69-P71 WeakPolarHBondContact O-CD 3.38Å
70	F	86.5	Confident	77.2	Confident	10 Å²	10	56.3 Å²	56.3	4%	0.044	33%	0.325	C	S	.	.			trans	-109.3	80.8	-179	-57.7	-76.1	0	0	0	109.7	S68 I75 F133 E140 L142 Q324	S68-F70 VanDerWaalsContact C-N 3.26Å; S68-F70 PolarHBondContact O-N 3.08Å; F70-I75 HydrophobicContact CB-CG1 4.45Å; F70-F133 HydrophobicContact CD2-CE1 4.31Å; F70-F133 HydrophobicContact CE1-CD1 4.07Å; F70-F133 HydrophobicContact CE1-CE1 4.42Å; F70-F133 AromaticContact CE2-CD1 3.96Å; F70-F133 HydrophobicContact CE2-CD1 3.96Å; F70-F133 AromaticContact CE2-CE1 3.58Å; F70-F133 HydrophobicContact CE2-CE1 3.58Å; F70-F133 HydrophobicContact CE2-CZ 4.35Å; F70-F133 AromaticContact CZ-CD1 3.5Å; F70-F133 HydrophobicContact CZ-CD1 3.5Å; F70-F133 AromaticContact CZ-CE1 3.65Å; F70-F133 HydrophobicContact CZ-CE1 3.65Å; F70-F133 HydrophobicContact CZ-CG 4.39Å; F70-E140 HydrophobicContact CE1-CB 3.88Å; F70-E140 HydrophobicContact CZ-CB 4.36Å; F70-L142 HydrophobicContact CB-CB 4.07Å; F70-L142 HydrophobicContact CB-CD2 4.3Å; F70-L142 HydrophobicContact CD1-CB 3.68Å; F70-L142 HydrophobicContact CD2-CB 4.42Å; F70-L142 HydrophobicContact CE1-CB 4.22Å; F70-L142 HydrophobicContact CG-CB 3.79Å; F70-L142 HydrophobicContact CG-CD2 4.45Å; F70-Q324 PolarHBondContact O-NE2 3.45Å
71	P	87.6	Confident	80.1	Confident	55 Å²	55	50.4 Å²	50.4	36%	0.357	29%	0.287	S	S	.	.			trans	-64.6	163.9	167.5	32	-36.7	0	0	0	110.1	K69 D73 K74	K69-P71 VanDerWaalsContact C-CD 3.43Å; K69-P71 WeakPolarHBondContact O-CD 3.38Å; P71-D73 PolarHBondContact O-N 3.13Å; P71-D73 VanDerWaalsContact O-N 3.11Å; P71-K74 HydrophobicContact CG-CB 4.45Å; P71-K74 HydrophobicContact CG-CD 4.3Å; P71-K74 HydrophobicContact CG-CG 4.14Å; P71-K74 PolarHBondContact O-N 2.87Å
72	V	89.4	Confident	82.8	Confident	16 Å²	16	46.4 Å²	46.4	10%	0.097	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-45.6	-46.5	-176.1	-179.8	0	0	0	0	112.3	K74 I75 H252 P253 A322	V72-K74 PolarHBondContact O-N 3.05Å; V72-I75 PolarHBondContact O-N 3.29Å; V72-H252 WeakPolarHBondContact O-CB 3.11Å; V72-P253 HydrophobicContact CG1-CB 4.37Å; V72-P253 HydrophobicContact CG1-CG 4.05Å; V72-P253 WeakPolarHBondContact CG1-O 3.5Å; V72-A322 HydrophobicContact CG2-CB 4.15Å
73	D	91	Very high	85	Confident	98 Å²	98	40.3 Å²	40.3	52%	0.524	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-57.9	-24.7	-178.9	-34.8	-65.8	0	0	0	114.1	P71 R76	P71-D73 PolarHBondContact O-N 3.13Å; P71-D73 VanDerWaalsContact O-N 3.11Å; D73-R76 PolarHBondContact O-NH1 2.86Å
74	K	92.8	Very high	86.9	Confident	54 Å²	54	35 Å²	35	24%	0.235	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-101.3	10	-178.8	-62.1	-166.1	173.6	-162.6	0	113.6	P71 V72 Y141 L142	P71-K74 HydrophobicContact CG-CB 4.45Å; P71-K74 HydrophobicContact CG-CD 4.3Å; P71-K74 HydrophobicContact CG-CG 4.14Å; P71-K74 PolarHBondContact O-N 2.87Å; V72-K74 PolarHBondContact O-N 3.05Å; K74-Y141 HydrophobicContact CB-CD1 4.1Å; K74-Y141 HydrophobicContact CB-CE1 4.42Å; K74-Y141 HydrophobicContact CG-CE1 4.39Å; K74-Y141 WeakPolarHBondContact O-CA 3.43Å; K74-Y141 WeakPolarHBondContact O-CD1 3.48Å; K74-L142 PolarHBondContact O-N 2.85Å
75	I	94.3	Very high	88.2	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	143.3	175.6	-54.9	169.3	0	0	0	109.4	F70 V72 N77 L142 P253 G323 Q324	F70-I75 HydrophobicContact CB-CG1 4.45Å; V72-I75 PolarHBondContact O-N 3.29Å; I75-N77 WeakPolarHBondContact CG2-OD1 3.48Å; I75-L142 VanDerWaalsContact CA-O 3.3Å; I75-L142 WeakPolarHBondContact CA-O 3.5Å; I75-L142 HydrophobicContact CG1-CB 4.4Å; I75-L142 HydrophobicContact CG1-CD2 4.4Å; I75-P253 HydrophobicContact CB-CG 3.83Å; I75-P253 HydrophobicContact CG2-CG 3.96Å; I75-P253 VanDerWaalsContact O-CD 3.29Å; I75-P253 WeakPolarHBondContact O-CD 3.45Å; I75-G323 WeakPolarHBondContact CG2-O 3.46Å; I75-Q324 HydrophobicContact CD1-CG 3.51Å
76	R	95.9	Very high	89.3	Confident	24 Å²	24	33.9 Å²	33.9	9%	0.091	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	117.5	168.1	-61.2	-66.7	-177.6	-84.7	-1	108.9	D73 L142 L143 N144 V246 V247 I250	D73-R76 PolarHBondContact O-NH1 2.86Å; R76-L142 PolarHBondContact N-O 3.29Å; R76-L143 HydrophobicContact CB-CD2 3.84Å; R76-L143 HydrophobicContact CG-CD2 3.94Å; R76-L143 CarbonylContact O-C 3.51Å; R76-L143 WeakPolarHBondContact O-CA 3.49Å; R76-N144 PolarHBondContact O-N 2.78Å; R76-V246 HydrophobicContact CB-CG1 4.08Å; R76-V246 WeakPolarHBondContact CD-O 3.48Å; R76-V246 HydrophobicContact CG-CG1 4.44Å; R76-V246 WeakPolarHBondContact CG-O 2.98Å; R76-V247 PolarHBondContact NE-O 3.3Å; R76-V247 PolarHBondContact NH2-O 2.92Å; R76-I250 WeakPolarHBondContact CD-O 3.3Å; R76-I250 PolarHBondContact NE-O 3.28Å
77	N	95.3	Very high	89.9	Confident	5 Å²	5	30.9 Å²	30.9	3%	0.027	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	117.9	175.9	-54.5	-47.5	0	0	0	108	I75 N144 A164 C165 Q166 G167 G323 V325	I75-N77 WeakPolarHBondContact CG2-OD1 3.48Å; N77-N144 WeakPolarHBondContact OD1-CB 2.99Å; N77-N144 PolarHBondContact OD1-ND2 3.25Å; N77-A164 WeakPolarHBondContact CB-O 3.38Å; N77-C165 WeakPolarHBondContact O-CA 3.34Å; N77-Q166 PolarHBondContact ND2-OE1 2.88Å; N77-Q166 PolarHBondContact O-N 2.93Å; N77-G167 PolarHBondContact O-N 3.13Å; N77-G323 PolarHBondContact ND2-O 3.4Å; N77-G323 PolarHBondContact OD1-O 2.98Å; N77-V325 HydrophobicContact CB-CG2 4.35Å; N77-V325 WeakPolarHBondContact OD1-CG2 3.41Å
78	F	95.9	Very high	90.4	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	153	-174.1	75.6	-77.8	0	0	0	112	I80 L95 L143 N144 L145 I146 G167 L169 V246 I250	F78-I80 HydrophobicContact CE2-CG1 4.39Å; F78-L95 HydrophobicContact CE2-CD1 4.25Å; F78-L95 HydrophobicContact CZ-CD1 4.22Å; F78-L143 HydrophobicContact CE1-CB 3.95Å; F78-N144 WeakPolarHBondContact CD1-O 3.41Å; F78-N144 PolarHBondContact N-O 2.94Å; F78-N144 VanDerWaalsContact O-O 3.11Å; F78-L145 HydrophobicContact CD2-CD1 4.42Å; F78-L145 HydrophobicContact CE1-CB 4.04Å; F78-L145 HydrophobicContact CE2-CB 4.42Å; F78-L145 HydrophobicContact CE2-CD1 3.76Å; F78-L145 HydrophobicContact CZ-CB 3.82Å; F78-L145 HydrophobicContact CZ-CD1 4Å; F78-L145 HydrophobicContact CZ-CG 4.41Å; F78-L145 CarbonylContact O-C 3.52Å; F78-L145 WeakPolarHBondContact O-CA 3.29Å; F78-I146 PolarHBondContact O-N 3.44Å; F78-G167 VanDerWaalsContact CA-O 3.28Å; F78-G167 WeakPolarHBondContact CA-O 3.37Å; F78-L169 HydrophobicContact CD2-CD1 4.09Å; F78-L169 HydrophobicContact CD2-CG 3.96Å; F78-L169 HydrophobicContact CE2-CD1 3.74Å; F78-L169 HydrophobicContact CE2-CG 4.15Å; F78-V246 HydrophobicContact CD1-CG1 3.9Å; F78-V246 HydrophobicContact CD2-CG2 4.28Å; F78-V246 HydrophobicContact CE1-CG1 4.03Å; F78-V246 HydrophobicContact CE2-CG2 4.32Å; F78-V246 HydrophobicContact CG-CG1 4.35Å; F78-V246 HydrophobicContact CG-CG2 4.45Å; F78-I250 HydrophobicContact CB-CD1 3.54Å; F78-I250 HydrophobicContact CG-CD1 4.25Å
79	C	94.6	Very high	90.9	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	169.2	174.8	57.8	0	0	0	0	111.9	I146 T148 L162 C165 G167 V168 L169	C79-I146 CarbonylContact C-O 3.46Å; C79-I146 WeakPolarHBondContact CA-O 3.45Å; C79-I146 HydrophobicContact CB-CB 4.18Å; C79-I146 WeakPolarHBondContact CB-O 3.08Å; C79-T148 HydrophobicContact CB-CG2 3.95Å; C79-L162 VanDerWaalsContact SG-CD2 3.58Å; C79-C165 PolarHBondContact N-SG 2.88Å; C79-G167 PolarHBondContact N-O 2.78Å; C79-V168 WeakPolarHBondContact O-CA 3.49Å; C79-V168 VanDerWaalsContact SG-CG2 3.52Å; C79-L169 PolarHBondContact O-N 3.01Å
80	I	94.3	Very high	91.2	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	114.8	174.8	-52.4	-178.3	0	0	0	109.1	F78 K88 A92 L95 L145 I146 T148 L169 I171	F78-I80 HydrophobicContact CE2-CG1 4.39Å; I80-K88 HydrophobicContact CB-CG 4.21Å; I80-K88 HydrophobicContact CG2-CG 3.74Å; I80-A92 HydrophobicContact CD1-CB 4.31Å; I80-L95 HydrophobicContact CD1-CD1 4.1Å; I80-L145 HydrophobicContact CD1-CD1 3.51Å; I80-L145 HydrophobicContact CG1-CD1 3.53Å; I80-I146 PolarHBondContact N-O 3.02Å; I80-I146 VanDerWaalsContact N-O 3.16Å; I80-T148 PolarHBondContact O-OG1 2.87Å; I80-L169 HydrophobicContact CD1-CD1 4.38Å; I80-L169 HydrophobicContact CG1-CB 4.29Å; I80-L169 HydrophobicContact CG1-CD1 4.17Å; I80-L169 HydrophobicContact CG2-CB 4.36Å; I80-I171 HydrophobicContact CG2-CD1 3.26Å; I80-I171 HydrophobicContact CG2-CG1 3.79Å
81	I	93	Very high	91.5	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	143	173.9	66	-175	0	0	0	110	V158 L162 V168 L169 L170 I171 N185 A189	I81-V158 HydrophobicContact CG2-CG1 4.09Å; I81-L162 HydrophobicContact CG2-CD2 4.47Å; I81-V168 HydrophobicContact CB-CG2 4.13Å; I81-V168 HydrophobicContact CD1-CG1 4.25Å; I81-V168 HydrophobicContact CD1-CG2 3.58Å; I81-V168 HydrophobicContact CG1-CG2 3.52Å; I81-V168 HydrophobicContact CG2-CG2 3.78Å; I81-L169 PolarHBondContact N-O 2.89Å; I81-L169 VanDerWaalsContact O-O 3.13Å; I81-L170 HydrophobicContact CD1-CB 4.44Å; I81-L170 HydrophobicContact CD1-CD1 3.8Å; I81-L170 HydrophobicContact CG1-CB 4.34Å; I81-L170 HydrophobicContact CG1-CD1 3.78Å; I81-I171 PolarHBondContact O-N 2.97Å; I81-N185 HydrophobicContact CB-CB 4.01Å; I81-N185 HydrophobicContact CD1-CB 3.87Å; I81-N185 WeakPolarHBondContact CD1-O 3.38Å; I81-N185 HydrophobicContact CG1-CB 4.24Å; I81-A189 HydrophobicContact CD1-CB 4.28Å
82	A	91.3	Very high	91.7	Very high	1 Å²	1	21.9 Å²	21.9	1%	0.008	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	164.2	-178.8	0	0	0	0	0	110.6	H86 K88 I171 N185	A82-H86 HydrophobicContact CB-CB 4.04Å; A82-K88 HydrophobicContact CB-CB 3.94Å; A82-K88 HydrophobicContact CB-CG 4.4Å; A82-I171 HydrophobicContact CB-CB 4Å; A82-N185 PolarHBondContact O-ND2 3.14Å
83	H	89.5	Confident	91.8	Very high	22 Å²	22	21.8 Å²	21.8	10%	0.102	12%	0.117	C	C	.	.			trans	-73	163.4	156	-177.4	54.9	0	0	0	109.6	H86 Q179 Q181	H83-H86 AromaticContact CD2-CD2 3.95Å; H83-H86 AromaticContact CD2-NE2 3.75Å; H83-H86 WeakPolarHBondContact O-CB 3.41Å; H83-H86 PolarHBondContact O-N 3.23Å; H83-Q179 HydrophobicContact CB-CB 4.06Å; H83-Q181 HydrophobicContact CB-CB 4.35Å; H83-Q181 PolarHBondContact CE1-OE1 2.86Å; H83-Q181 VanDerWaalsContact CE1-OE1 3.27Å; H83-Q181 PolarHBondContact ND1-OE1 3.47Å
84	I	85.6	Confident	91.8	Very high	34 Å²	34	20.1 Å²	20.1	17%	0.174	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	147.8	172.7	-59.7	159.5	0	0	0	109.6	H86 I123 H151	I84-H86 PolarHBondContact O-N 2.95Å; I84-I123 HydrophobicContact CG2-CG2 4.33Å; I84-H151 HydrophobicContact CD1-CB 4.04Å
85	D	85.9	Confident	91.7	Very high	111 Å²	111	17.6 Å²	17.6	59%	0.594	9%	0.092	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.2	-4.2	-175.6	-64.7	-37.3	0	0	0	117.5	G87 K202	D85-G87 PolarHBondContact O-N 2.89Å; D85-K202 WeakPolarHBondContact O-CE 3.46Å; D85-K202 PolarHBondContact O-NZ 2.95Å
86	H	92.1	Very high	91.6	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	9%	0.092	C	C	.	.	S	Bend	trans	-64.1	-4	178	-80.9	-158.2	0	0	0	114.4	A82 H83 I84 I171 I172 D173 G177 N201	A82-H86 HydrophobicContact CB-CB 4.04Å; H83-H86 AromaticContact CD2-CD2 3.95Å; H83-H86 AromaticContact CD2-NE2 3.75Å; H83-H86 WeakPolarHBondContact O-CB 3.41Å; H83-H86 PolarHBondContact O-N 3.23Å; I84-H86 PolarHBondContact O-N 2.95Å; H86-I171 HydrophobicContact CB-CG2 4.2Å; H86-I171 PolarHBondContact ND1-O 2.95Å; H86-I171 WeakPolarHBondContact O-CG2 3.37Å; H86-I172 WeakPolarHBondContact ND1-CA 3.45Å; H86-D173 HydrophobicContact CB-CB 4.41Å; H86-D173 PolarHBondContact ND1-N 3.14Å; H86-G177 PolarHBondContact CE1-O 3.48Å; H86-N201 PolarHBondContact O-ND2 2.8Å
87	G	89.6	Confident	91.3	Very high	14 Å²	14	17.9 Å²	17.9	14%	0.144	9%	0.094	C	C	.	.	S	Bend	trans	94.4	24.2	171.2	0	0	0	0	0	115	D85 T90 L91	D85-G87 PolarHBondContact O-N 2.89Å; G87-T90 WeakPolarHBondContact O-CB 3.14Å; G87-T90 PolarHBondContact O-N 3.34Å; G87-L91 PolarHBondContact O-N 3.41Å
88	K	91.3	Very high	90.9	Very high	16 Å²	16	21.7 Å²	21.7	7%	0.07	11%	0.113	C	C	.	.	H	α-helix	trans	-49.3	-65.7	178.6	-177.1	-166.7	69	81	0	113.9	I80 A82 T90 L91 A92 T124 D147 T148	I80-K88 HydrophobicContact CB-CG 4.21Å; I80-K88 HydrophobicContact CG2-CG 3.74Å; A82-K88 HydrophobicContact CB-CB 3.94Å; A82-K88 HydrophobicContact CB-CG 4.4Å; K88-T90 PolarHBondContact O-N 3.01Å; K88-L91 WeakPolarHBondContact O-CB 3.4Å; K88-L91 PolarHBondContact O-N 2.82Å; K88-A92 PolarHBondContact O-N 2.79Å; K88-T124 WeakPolarHBondContact CE-OG1 3.43Å; K88-T124 VanDerWaalsContact NZ-CB 3.34Å; K88-T124 PolarHBondContact NZ-OG1 3.41Å; K88-D147 WeakPolarHBondContact CD-OD1 3.41Å; K88-D147 VanDerWaalsContact CG-OD1 3.28Å; K88-D147 WeakPolarHBondContact CG-OD1 3.44Å; K88-D147 IonicContact NZ-OD1 3.63Å; K88-D147 PolarHBondContact NZ-OD1 2.88Å; K88-D147 IonicContact NZ-OD2 2.8Å; K88-D147 PolarHBondContact NZ-OD2 3.38Å; K88-T148 WeakPolarHBondContact CD-O 3.47Å; K88-T148 WeakPolarHBondContact CE-O 3.3Å; K88-T148 PolarHBondContact NZ-O 2.91Å
89	S	89.3	Confident	90.5	Very high	13 Å²	13	22.4 Å²	22.4	9%	0.091	12%	0.118	C	C	.	.	H	α-helix	trans	-59.9	-32	-178.9	-39.1	0	0	0	0	111.9	A92 D93 D113 T124	S89-A92 PolarHBondContact O-N 2.78Å; S89-D93 PolarHBondContact O-N 2.85Å; S89-D113 WeakPolarHBondContact CB-OD2 3.38Å; S89-D113 PolarHBondContact OG-OD2 3.39Å; S89-T124 PolarHBondContact OG-OG1 3.43Å
90	T	90.7	Very high	90	Very high	51 Å²	51	25.4 Å²	25.4	31%	0.313	15%	0.148	S	C	.	.	H	α-helix	trans	-67.5	-34.4	174.2	-43.7	0	0	0	0	112.8	G87 K88 R94 A233	G87-T90 WeakPolarHBondContact O-CB 3.14Å; G87-T90 PolarHBondContact O-N 3.34Å; K88-T90 PolarHBondContact O-N 3.01Å; T90-R94 WeakPolarHBondContact O-CG 3.31Å; T90-R94 PolarHBondContact O-N 3.17Å; T90-A233 HydrophobicContact CG2-CB 4.15Å
91	L	92.6	Very high	89.4	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-69.7	-45.4	171.6	-175.3	59	0	0	0	110.3	G87 K88 D93 R94 L95 L169 I171 V199 I231 A233 V239	G87-L91 PolarHBondContact O-N 3.41Å; K88-L91 WeakPolarHBondContact O-CB 3.4Å; K88-L91 PolarHBondContact O-N 2.82Å; L91-D93 VanDerWaalsContact C-N 3.33Å; L91-D93 PolarHBondContact O-N 2.95Å; L91-R94 PolarHBondContact O-N 2.91Å; L91-L95 HydrophobicContact CD1-CD2 4.47Å; L91-L95 HydrophobicContact CD1-CG 4.4Å; L91-L95 HydrophobicContact CG-CD1 4.26Å; L91-L95 HydrophobicContact CG-CG 4.3Å; L91-L95 WeakPolarHBondContact O-CG 3.36Å; L91-L95 PolarHBondContact O-N 2.71Å; L91-L169 HydrophobicContact CD2-CD1 4.2Å; L91-I171 HydrophobicContact CB-CD1 3.98Å; L91-I171 HydrophobicContact CD2-CD1 3.58Å; L91-I171 HydrophobicContact CD2-CG1 4.22Å; L91-I171 HydrophobicContact CG-CD1 4.41Å; L91-V199 HydrophobicContact CD2-CG1 4.4Å; L91-I231 HydrophobicContact CD1-CD1 3.64Å; L91-I231 HydrophobicContact CD2-CD1 4.07Å; L91-I231 HydrophobicContact CG-CD1 4.44Å; L91-A233 HydrophobicContact CB-CB 4.09Å; L91-A233 HydrophobicContact CD1-CB 4.17Å; L91-V239 HydrophobicContact CD1-CG1 3.77Å; L91-V239 HydrophobicContact CD1-CG2 4.17Å
92	A	92.3	Very high	88.9	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-54	-47.6	176.3	0	0	0	0	0	111.9	I80 K88 S89 R94 L95 L96 L112 L145	I80-A92 HydrophobicContact CD1-CB 4.31Å; K88-A92 PolarHBondContact O-N 2.79Å; S89-A92 PolarHBondContact O-N 2.78Å; A92-R94 VanDerWaalsContact C-N 3.32Å; A92-R94 PolarHBondContact O-N 3.49Å; A92-L95 PolarHBondContact O-N 3.09Å; A92-L96 WeakPolarHBondContact O-CB 3.49Å; A92-L96 WeakPolarHBondContact O-CD1 3.32Å; A92-L96 VanDerWaalsContact O-CG 3.24Å; A92-L96 WeakPolarHBondContact O-CG 3.31Å; A92-L96 PolarHBondContact O-N 3.5Å; A92-L112 HydrophobicContact CB-CD1 3.84Å; A92-L145 HydrophobicContact CB-CD2 4.06Å
93	D	90	Very high	88.2	Confident	15 Å²	15	30.5 Å²	30.5	8%	0.08	19%	0.188	C	C	.	.	H	α-helix	trans	-53.5	-44.6	173.4	-72.4	-34.4	0	0	0	112.2	S89 L91 L96 E97 Q110 V111	S89-D93 PolarHBondContact O-N 2.85Å; L91-D93 VanDerWaalsContact C-N 3.33Å; L91-D93 PolarHBondContact O-N 2.95Å; D93-L96 WeakPolarHBondContact O-CB 3.5Å; D93-L96 PolarHBondContact O-N 3.34Å; D93-E97 WeakPolarHBondContact O-CG 3.34Å; D93-E97 PolarHBondContact O-N 2.94Å; D93-Q110 WeakPolarHBondContact OD1-CA 3.4Å; D93-Q110 PolarHBondContact OD1-N 3.14Å; D93-Q110 WeakPolarHBondContact OD2-CA 3.37Å; D93-Q110 PolarHBondContact OD2-N 3.33Å; D93-V111 PolarHBondContact OD1-N 2.93Å
94	R	90.7	Very high	87.4	Confident	63 Å²	63	37.6 Å²	37.6	24%	0.238	22%	0.218	C	C	.	.	H	α-helix	trans	-69.4	-39.7	179.6	-67.6	-48.7	-173.8	-159.1	-3.2	113	T90 L91 A92 L96 E97 M98 A233 K234 V239	T90-R94 WeakPolarHBondContact O-CG 3.31Å; T90-R94 PolarHBondContact O-N 3.17Å; L91-R94 PolarHBondContact O-N 2.91Å; A92-R94 VanDerWaalsContact C-N 3.32Å; A92-R94 PolarHBondContact O-N 3.49Å; R94-L96 PolarHBondContact O-N 3.27Å; R94-E97 VanDerWaalsContact CD-OE2 3.31Å; R94-E97 WeakPolarHBondContact CD-OE2 3.45Å; R94-E97 IonicContact CZ-OE2 2.72Å; R94-E97 IonicContact NE-OE2 3Å; R94-E97 IonicContact NH1-OE1 3.9Å; R94-E97 PolarHBondContact NH1-OE1 3.49Å; R94-E97 IonicContact NH1-OE2 2.67Å; R94-E97 PolarHBondContact NH1-OE2 3.05Å; R94-E97 PolarHBondContact O-N 3Å; R94-M98 WeakPolarHBondContact O-CB 3.45Å; R94-M98 VanDerWaalsContact O-CG 3.26Å; R94-M98 WeakPolarHBondContact O-CG 3.27Å; R94-M98 PolarHBondContact O-N 2.68Å; R94-A233 WeakPolarHBondContact CG-O 3.32Å; R94-A233 PolarHBondContact NE-O 3.33Å; R94-K234 PolarHBondContact NH2-O 2.98Å; R94-V239 HydrophobicContact CB-CG1 4.12Å
95	L	92.2	Very high	86.6	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.005	23%	0.23	C	C	.	.	H	α-helix	trans	-61.5	-37.8	175	-59.6	174.7	0	0	0	110.4	F78 I80 L91 A92 T99 L132 L145 L169 V239 L243	F78-L95 HydrophobicContact CE2-CD1 4.25Å; F78-L95 HydrophobicContact CZ-CD1 4.22Å; I80-L95 HydrophobicContact CD1-CD1 4.1Å; L91-L95 HydrophobicContact CD1-CD2 4.47Å; L91-L95 HydrophobicContact CD1-CG 4.4Å; L91-L95 HydrophobicContact CG-CD1 4.26Å; L91-L95 HydrophobicContact CG-CG 4.3Å; L91-L95 WeakPolarHBondContact O-CG 3.36Å; L91-L95 PolarHBondContact O-N 2.71Å; A92-L95 PolarHBondContact O-N 3.09Å; L95-T99 WeakPolarHBondContact O-CB 3.32Å; L95-T99 WeakPolarHBondContact O-CG2 3.49Å; L95-T99 PolarHBondContact O-N 3.48Å; L95-T99 VanDerWaalsContact O-N 3.13Å; L95-T99 PolarHBondContact O-OG1 3.4Å; L95-L132 HydrophobicContact CB-CD1 4.09Å; L95-L145 HydrophobicContact CD1-CD2 4.47Å; L95-L169 HydrophobicContact CD1-CD1 4.4Å; L95-V239 HydrophobicContact CD2-CG1 3.93Å; L95-L243 HydrophobicContact CD2-CD1 4.37Å; L95-L243 HydrophobicContact CD2-CD2 3.76Å; L95-L243 HydrophobicContact CD2-CG 3.76Å
96	L	90.7	Very high	85.3	Confident	1 Å²	1	42.9 Å²	42.9	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-70.6	-37.9	176.4	-70.7	160.4	0	0	0	113.7	A92 D93 R94 A101 I102 L112 A130 L132 P312	A92-L96 WeakPolarHBondContact O-CB 3.49Å; A92-L96 WeakPolarHBondContact O-CD1 3.32Å; A92-L96 VanDerWaalsContact O-CG 3.24Å; A92-L96 WeakPolarHBondContact O-CG 3.31Å; A92-L96 PolarHBondContact O-N 3.5Å; D93-L96 WeakPolarHBondContact O-CB 3.5Å; D93-L96 PolarHBondContact O-N 3.34Å; R94-L96 PolarHBondContact O-N 3.27Å; L96-A101 HydrophobicContact CD2-CB 3.87Å; L96-A101 PolarHBondContact O-N 2.88Å; L96-I102 HydrophobicContact CB-CB 4.37Å; L96-I102 HydrophobicContact CB-CD1 3.63Å; L96-I102 HydrophobicContact CB-CG1 3.94Å; L96-I102 HydrophobicContact CD1-CD1 3.8Å; L96-I102 HydrophobicContact CD2-CD1 4.38Å; L96-I102 HydrophobicContact CG-CD1 4.15Å; L96-I102 PolarHBondContact O-N 2.72Å; L96-L112 HydrophobicContact CD1-CD1 4.13Å; L96-L112 HydrophobicContact CD1-CD2 3.9Å; L96-L112 HydrophobicContact CD1-CG 3.88Å; L96-A130 HydrophobicContact CD2-CB 3.84Å; L96-L132 HydrophobicContact CD2-CD2 3.45Å; L96-L132 VanDerWaalsContact CD2-CD2 3.45Å; L96-L132 HydrophobicContact CG-CD2 4.18Å; L96-P312 HydrophobicContact CD2-CG 4.21Å
97	E	89.6	Confident	83.7	Confident	28 Å²	28	51.9 Å²	51.9	13%	0.131	28%	0.283	C	S	.	.	H	α-helix	trans	-67.8	-45.9	172.8	-77.2	-174.3	148	0	0	112	D93 R94 T99 G100	D93-E97 WeakPolarHBondContact O-CG 3.34Å; D93-E97 PolarHBondContact O-N 2.94Å; R94-E97 VanDerWaalsContact CD-OE2 3.31Å; R94-E97 WeakPolarHBondContact CD-OE2 3.45Å; R94-E97 IonicContact CZ-OE2 2.72Å; R94-E97 IonicContact NE-OE2 3Å; R94-E97 IonicContact NH1-OE1 3.9Å; R94-E97 PolarHBondContact NH1-OE1 3.49Å; R94-E97 IonicContact NH1-OE2 2.67Å; R94-E97 PolarHBondContact NH1-OE2 3.05Å; R94-E97 PolarHBondContact O-N 3Å; E97-T99 PolarHBondContact O-N 2.93Å; E97-G100 PolarHBondContact O-N 3.04Å
98	M	88.3	Confident	82.5	Confident	85 Å²	85	54 Å²	54	42%	0.419	29%	0.291	S	S	.	.	H	α-helix	trans	-71.1	-31	-174.3	-71.7	176.5	65.2	0	0	112.7	R94 G100 V239 E240 L243	R94-M98 WeakPolarHBondContact O-CB 3.45Å; R94-M98 VanDerWaalsContact O-CG 3.26Å; R94-M98 WeakPolarHBondContact O-CG 3.27Å; R94-M98 PolarHBondContact O-N 2.68Å; M98-G100 VanDerWaalsContact C-N 3.26Å; M98-G100 PolarHBondContact O-N 3.34Å; M98-V239 HydrophobicContact SD-CB 3.85Å; M98-V239 HydrophobicContact SD-CG1 3.65Å; M98-E240 HydrophobicContact CE-CB 3.8Å; M98-E240 HydrophobicContact CE-CG 4.35Å; M98-L243 HydrophobicContact CB-CD1 4.3Å; M98-L243 HydrophobicContact CE-CD1 4.38Å
99	T	87.1	Confident	81.6	Confident	16 Å²	16	60.6 Å²	60.6	10%	0.098	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	7.9	174.2	58.4	0	0	0	0	113.1	L95 E97 A101 L132 F133 Y134 L243	L95-T99 WeakPolarHBondContact O-CB 3.32Å; L95-T99 WeakPolarHBondContact O-CG2 3.49Å; L95-T99 PolarHBondContact O-N 3.48Å; L95-T99 VanDerWaalsContact O-N 3.13Å; L95-T99 PolarHBondContact O-OG1 3.4Å; E97-T99 PolarHBondContact O-N 2.93Å; T99-A101 PolarHBondContact O-N 2.72Å; T99-A101 VanDerWaalsContact O-N 3.12Å; T99-L132 HydrophobicContact CG2-CB 3.99Å; T99-L132 HydrophobicContact CG2-CD1 4.22Å; T99-F133 WeakPolarHBondContact CB-O 3.3Å; T99-Y134 HydrophobicContact CG2-CD2 4.31Å; T99-L243 HydrophobicContact CG2-CD1 4.18Å; T99-L243 HydrophobicContact CG2-CD2 4.13Å
100	G	83.8	Confident	81	Confident	62 Å²	62	62.9 Å²	62.9	64%	0.639	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.8	13.9	178.1	0	0	0	0	0	114.6	E97 M98 I102	E97-G100 PolarHBondContact O-N 3.04Å; M98-G100 VanDerWaalsContact C-N 3.26Å; M98-G100 PolarHBondContact O-N 3.34Å; G100-I102 VanDerWaalsContact C-N 3.27Å
101	A	81.8	Confident	80.5	Confident	19 Å²	19	62.4 Å²	62.4	16%	0.157	33%	0.325	C	S	.	.	S	Bend	trans	-71.6	-24	174.7	0	0	0	0	0	112.1	L96 T99 L132	L96-A101 HydrophobicContact CD2-CB 3.87Å; L96-A101 PolarHBondContact O-N 2.88Å; T99-A101 PolarHBondContact O-N 2.72Å; T99-A101 VanDerWaalsContact O-N 3.12Å; A101-L132 HydrophobicContact CB-CD2 4.31Å
102	I	83.3	Confident	80	Confident	20 Å²	20	62.5 Å²	62.5	10%	0.103	33%	0.326	C	S	.	.	S	Bend	trans	-132.2	140.8	174.9	-62.8	177.8	0	0	0	109.7	L96 G100 K104 N108 V111 P312	L96-I102 HydrophobicContact CB-CB 4.37Å; L96-I102 HydrophobicContact CB-CD1 3.63Å; L96-I102 HydrophobicContact CB-CG1 3.94Å; L96-I102 HydrophobicContact CD1-CD1 3.8Å; L96-I102 HydrophobicContact CD2-CD1 4.38Å; L96-I102 HydrophobicContact CG-CD1 4.15Å; L96-I102 PolarHBondContact O-N 2.72Å; G100-I102 VanDerWaalsContact C-N 3.27Å; I102-K104 PolarHBondContact O-N 3.19Å; I102-N108 HydrophobicContact CG2-CB 4.21Å; I102-V111 HydrophobicContact CD1-CB 3.68Å; I102-V111 HydrophobicContact CD1-CG1 3.69Å; I102-V111 HydrophobicContact CD1-CG2 3.96Å; I102-P312 HydrophobicContact CD1-CG 3.82Å; I102-P312 HydrophobicContact CG1-CG 3.89Å
103	A	75.9	Confident	79.6	Confident	70 Å²	70	62.5 Å²	62.5	58%	0.579	33%	0.326	S	S	*	.			trans	-70.4	125.6	172.5	0	0	0	0	0	111.2	T105 N108	A103-T105 PolarHBondContact O-N 2.99Å; A103-T105 VanDerWaalsContact O-N 3.09Å; A103-N108 PolarHBondContact O-ND2 3.1Å
104	K	72.1	Confident	79.3	Confident	170 Å²	170	66.8 Å²	66.8	74%	0.739	34%	0.344	S	S	*	.			trans	-60.7	109.3	176.6	-171.4	168.8	-167.1	169.8	0	110.5	I102	I102-K104 PolarHBondContact O-N 3.19Å
105	T	68.4	Low	79	Confident	70 Å²	70	65.4 Å²	65.4	43%	0.429	34%	0.341	S	S	.	.			trans	-157.5	135.4	-172.1	-67.5	0	0	0	0	109.9	A103 K107 N108	A103-T105 PolarHBondContact O-N 2.99Å; A103-T105 VanDerWaalsContact O-N 3.09Å; T105-K107 HydrophobicContact CG2-CB 4.3Å; T105-K107 PolarHBondContact O-N 2.82Å; T105-N108 WeakPolarHBondContact O-CB 3.39Å; T105-N108 PolarHBondContact O-N 3.36Å
106	E	58.5	Low	78.6	Confident	186 Å²	186	70.8 Å²	70.8	87%	0.869	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-16.9	-172.6	-59	-171.2	139.7	0	0	115.8
107	K	59.6	Low	78.4	Confident	190 Å²	190	70.8 Å²	70.8	83%	0.826	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-18.1	175.8	-62.2	-174.8	179.6	-178.6	0	113.5	T105 K109	T105-K107 HydrophobicContact CG2-CB 4.3Å; T105-K107 PolarHBondContact O-N 2.82Å; K107-K109 PolarHBondContact O-N 2.9Å; K107-K109 VanDerWaalsContact O-N 3.14Å
108	N	63.5	Low	78.2	Confident	58 Å²	58	69.5 Å²	69.5	31%	0.31	36%	0.36	S	S	.	.			trans	-88.4	80.4	-176.9	-65.3	-7.1	0	0	0	108.7	I102 A103 T105 V111	I102-N108 HydrophobicContact CG2-CB 4.21Å; A103-N108 PolarHBondContact O-ND2 3.1Å; T105-N108 WeakPolarHBondContact O-CB 3.39Å; T105-N108 PolarHBondContact O-N 3.36Å; N108-V111 HydrophobicContact CB-CG2 3.88Å
109	K	72.5	Confident	78	Confident	155 Å²	155	72.3 Å²	72.3	67%	0.674	37%	0.366	S	S	*	.	S	Bend	trans	-117.1	133.4	172	-64.4	178.7	-176.8	177.1	0	108.3	K107	K107-K109 PolarHBondContact O-N 2.9Å; K107-K109 VanDerWaalsContact O-N 3.14Å
110	Q	77.3	Confident	77.8	Confident	60 Å²	60	76.5 Å²	76.5	28%	0.28	38%	0.384	S	S	.	.	S	Bend	trans	53.4	56.3	177	-67	175.9	-106.4	0	0	111.3	D93 L112 D113	D93-Q110 WeakPolarHBondContact OD1-CA 3.4Å; D93-Q110 PolarHBondContact OD1-N 3.14Å; D93-Q110 WeakPolarHBondContact OD2-CA 3.37Å; D93-Q110 PolarHBondContact OD2-N 3.33Å; Q110-L112 VanDerWaalsContact C-N 3.26Å; Q110-L112 PolarHBondContact O-N 2.79Å; Q110-D113 HydrophobicContact CB-CB 4.07Å; Q110-D113 WeakPolarHBondContact CB-OD2 3.26Å; Q110-D113 PolarHBondContact NE2-OD2 3.12Å; Q110-D113 PolarHBondContact O-N 3.3Å
111	V	79.6	Confident	77.7	Confident	41 Å²	41	77.8 Å²	77.8	25%	0.248	37%	0.37	C	S	.	.	S	Bend	trans	-72.3	-23.9	-172.3	-174.2	0	0	0	0	111.9	D93 I102 N108	D93-V111 PolarHBondContact OD1-N 2.93Å; I102-V111 HydrophobicContact CD1-CB 3.68Å; I102-V111 HydrophobicContact CD1-CG1 3.69Å; I102-V111 HydrophobicContact CD1-CG2 3.96Å; N108-V111 HydrophobicContact CB-CG2 3.88Å
112	L	82.1	Confident	77.7	Confident	2 Å²	2	78.7 Å²	78.7	1%	0.01	38%	0.381	C	S	.	.	S	Bend	trans	-76	-34.6	171.3	-60.6	-172.6	0	0	0	112.9	A92 L96 Q110 K114 Q128 A130 D147 P312	A92-L112 HydrophobicContact CB-CD1 3.84Å; L96-L112 HydrophobicContact CD1-CD1 4.13Å; L96-L112 HydrophobicContact CD1-CD2 3.9Å; L96-L112 HydrophobicContact CD1-CG 3.88Å; Q110-L112 VanDerWaalsContact C-N 3.26Å; Q110-L112 PolarHBondContact O-N 2.79Å; L112-K114 WeakPolarHBondContact O-CG 3.43Å; L112-K114 PolarHBondContact O-N 3.12Å; L112-Q128 HydrophobicContact CB-CB 4.1Å; L112-Q128 HydrophobicContact CB-CG 4.27Å; L112-Q128 HydrophobicContact CD1-CB 4.41Å; L112-Q128 HydrophobicContact CD2-CB 4.34Å; L112-Q128 WeakPolarHBondContact O-CG 3.49Å; L112-A130 HydrophobicContact CD2-CB 4.4Å; L112-D147 HydrophobicContact CD1-CB 3.5Å; L112-P312 HydrophobicContact CD2-CB 4.07Å
113	D	85.1	Confident	77.7	Confident	0 Å²	0	78.9 Å²	78.9	0%	0	38%	0.382	C	S	.	.			trans	-68	98.7	176.1	-64	-43.6	0	0	0	108.3	S89 Q110 E118 R119 T124	S89-D113 WeakPolarHBondContact CB-OD2 3.38Å; S89-D113 PolarHBondContact OG-OD2 3.39Å; Q110-D113 HydrophobicContact CB-CB 4.07Å; Q110-D113 WeakPolarHBondContact CB-OD2 3.26Å; Q110-D113 PolarHBondContact NE2-OD2 3.12Å; Q110-D113 PolarHBondContact O-N 3.3Å; D113-E118 HydrophobicContact CB-CB 3.95Å; D113-R119 HydrophobicContact CB-CG 4.43Å; D113-R119 PolarHBondContact O-NE 3.05Å; D113-R119 PolarHBondContact O-NH2 2.6Å; D113-T124 WeakPolarHBondContact OD1-CA 3.23Å; D113-T124 WeakPolarHBondContact OD1-CB 3.35Å; D113-T124 PolarHBondContact OD1-OG1 3.28Å
114	K	83.4	Confident	78.1	Confident	105 Å²	105	75.8 Å²	75.8	46%	0.457	36%	0.356	S	S	.	.			trans	-95.7	-28.7	-168.3	-82.4	168.6	-173.1	168.6	0	112.6	L112 E118	L112-K114 WeakPolarHBondContact O-CG 3.43Å; L112-K114 PolarHBondContact O-N 3.12Å; K114-E118 PolarHBondContact N-OE2 2.86Å
115	L	84.1	Confident	78.6	Confident	34 Å²	34	68.1 Å²	68.1	18%	0.178	32%	0.323	C	S	.	.	S	Bend	trans	-82.3	149.4	-178.9	-53.4	173.1	0	0	0	110.7	V117 E118 R119 V125	L115-V117 HydrophobicContact CB-CG1 3.97Å; L115-V117 HydrophobicContact CD1-CG1 4.44Å; L115-V117 PolarHBondContact O-N 3.28Å; L115-E118 HydrophobicContact CB-CB 4.42Å; L115-E118 HydrophobicContact CB-CG 3.9Å; L115-E118 WeakPolarHBondContact CB-OE2 3.26Å; L115-E118 HydrophobicContact CD1-CG 4.3Å; L115-E118 HydrophobicContact CG-CG 4.42Å; L115-E118 WeakPolarHBondContact CG-OE2 3.37Å; L115-E118 PolarHBondContact N-OE2 2.85Å; L115-E118 PolarHBondContact O-N 3.23Å; L115-R119 PolarHBondContact O-N 2.81Å; L115-V125 HydrophobicContact CD1-CB 4.47Å; L115-V125 HydrophobicContact CD1-CG1 4.43Å
116	Q	84.3	Confident	79.4	Confident	115 Å²	115	65.8 Å²	65.8	54%	0.537	31%	0.307	S	S	.	.	H	α-helix	trans	-62.5	-44.5	177.2	177.4	169.5	-17.1	0	0	111.7	E118 R119 E120	Q116-E118 VanDerWaalsContact C-N 3.25Å; Q116-E118 PolarHBondContact O-N 3.06Å; Q116-R119 PolarHBondContact O-N 3.42Å; Q116-R119 VanDerWaalsContact O-N 3.15Å; Q116-E120 HydrophobicContact CG-CG 4.23Å; Q116-E120 WeakPolarHBondContact CG-OE1 3.5Å; Q116-E120 PolarHBondContact NE2-OE1 3.05Å; Q116-E120 WeakPolarHBondContact O-CG 3.28Å; Q116-E120 PolarHBondContact O-N 2.85Å
117	V	85.7	Confident	80.7	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-57.2	-33.4	176.2	60.1	0	0	0	0	113.6	L115 R121 V419 Q422 R423	L115-V117 HydrophobicContact CB-CG1 3.97Å; L115-V117 HydrophobicContact CD1-CG1 4.44Å; L115-V117 PolarHBondContact O-N 3.28Å; V117-R121 HydrophobicContact CG2-CG 4.23Å; V117-R121 WeakPolarHBondContact O-CB 3.38Å; V117-R121 PolarHBondContact O-N 3.36Å; V117-V419 HydrophobicContact CG1-CG1 4.18Å; V117-V419 HydrophobicContact CG2-CB 4.5Å; V117-V419 HydrophobicContact CG2-CG1 4.21Å; V117-V419 HydrophobicContact CG2-CG2 4.05Å; V117-Q422 HydrophobicContact CB-CG 4.37Å; V117-Q422 HydrophobicContact CG2-CB 4.47Å; V117-Q422 HydrophobicContact CG2-CG 4.16Å; V117-R423 HydrophobicContact CG1-CG 3.87Å
118	E	84.9	Confident	82	Confident	1 Å²	1	49.2 Å²	49.2	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-65.8	-44.4	177.9	-69.1	173.7	142.1	0	0	110.9	D113 K114 L115 Q116 G122 I123 V125 K126	D113-E118 HydrophobicContact CB-CB 3.95Å; K114-E118 PolarHBondContact N-OE2 2.86Å; L115-E118 HydrophobicContact CB-CB 4.42Å; L115-E118 HydrophobicContact CB-CG 3.9Å; L115-E118 WeakPolarHBondContact CB-OE2 3.26Å; L115-E118 HydrophobicContact CD1-CG 4.3Å; L115-E118 HydrophobicContact CG-CG 4.42Å; L115-E118 WeakPolarHBondContact CG-OE2 3.37Å; L115-E118 PolarHBondContact N-OE2 2.85Å; L115-E118 PolarHBondContact O-N 3.23Å; Q116-E118 VanDerWaalsContact C-N 3.25Å; Q116-E118 PolarHBondContact O-N 3.06Å; E118-G122 WeakPolarHBondContact O-CA 3.36Å; E118-G122 PolarHBondContact O-N 2.83Å; E118-I123 WeakPolarHBondContact CA-O 3.33Å; E118-I123 WeakPolarHBondContact CB-O 3.43Å; E118-I123 VanDerWaalsContact CG-O 3.32Å; E118-I123 WeakPolarHBondContact CG-O 3.4Å; E118-I123 PolarHBondContact O-N 3.39Å; E118-I123 VanDerWaalsContact O-N 3.16Å; E118-V125 HydrophobicContact CG-CB 3.78Å; E118-V125 HydrophobicContact CG-CG2 3.8Å; E118-V125 WeakPolarHBondContact OE1-CA 3.45Å; E118-V125 WeakPolarHBondContact OE1-CB 3.34Å; E118-V125 PolarHBondContact OE1-N 3.03Å; E118-K126 PolarHBondContact OE1-N 3.41Å
119	R	84.4	Confident	83.2	Confident	144 Å²	144	46.8 Å²	46.8	54%	0.543	22%	0.221	S	C	.	.	H	α-helix	trans	-72.4	-31.9	179.2	-62.1	178	-178.6	180	-0.1	113.2	D113 L115 Q116	D113-R119 HydrophobicContact CB-CG 4.43Å; D113-R119 PolarHBondContact O-NE 3.05Å; D113-R119 PolarHBondContact O-NH2 2.6Å; L115-R119 PolarHBondContact O-N 2.81Å; Q116-R119 PolarHBondContact O-N 3.42Å; Q116-R119 VanDerWaalsContact O-N 3.15Å
120	E	84.2	Confident	84.2	Confident	104 Å²	104	39.4 Å²	39.4	49%	0.486	19%	0.189	S	C	.	.	H	α-helix	trans	-77.6	-38.6	177.7	-73	175.5	169.9	0	0	112.8	Q116 Q422 Q426	Q116-E120 HydrophobicContact CG-CG 4.23Å; Q116-E120 WeakPolarHBondContact CG-OE1 3.5Å; Q116-E120 PolarHBondContact NE2-OE1 3.05Å; Q116-E120 WeakPolarHBondContact O-CG 3.28Å; Q116-E120 PolarHBondContact O-N 2.85Å; E120-Q422 PolarHBondContact OE2-NE2 2.93Å; E120-Q426 PolarHBondContact OE2-NE2 3.12Å
121	R	81.1	Confident	84.9	Confident	90 Å²	90	36.6 Å²	36.6	34%	0.34	18%	0.176	S	C	.	.	H	α-helix	trans	-91	-12	179.3	-68.6	-174	178.5	-123.2	-1	114	V117 I123 L415 E418	V117-R121 HydrophobicContact CG2-CG 4.23Å; V117-R121 WeakPolarHBondContact O-CB 3.38Å; V117-R121 PolarHBondContact O-N 3.36Å; R121-I123 VanDerWaalsContact C-N 3.33Å; R121-I123 HydrophobicContact CB-CD1 4.06Å; R121-I123 HydrophobicContact CB-CG1 3.81Å; R121-L415 VanDerWaalsContact NH1-CD1 3.3Å; R121-E418 IonicContact CZ-OE2 3.18Å; R121-E418 IonicContact NH1-OE2 2.75Å; R121-E418 PolarHBondContact NH1-OE2 2.77Å; R121-E418 IonicContact NH2-OE2 2.75Å; R121-E418 PolarHBondContact NH2-OE2 2.84Å; R121-E418 VanDerWaalsContact NH2-OE2 3.15Å
122	G	81.6	Confident	85.5	Confident	37 Å²	37	34.6 Å²	34.6	38%	0.381	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.3	21.5	-178	0	0	0	0	0	114.4	E118	E118-G122 WeakPolarHBondContact O-CA 3.36Å; E118-G122 PolarHBondContact O-N 2.83Å
123	I	84.1	Confident	86	Confident	24 Å²	24	36.3 Å²	36.3	12%	0.123	17%	0.171	C	C	.	.			trans	-124.2	142.1	-176	61.3	177.1	0	0	0	110.5	I84 E118 R121 V125 L415 V419	I84-I123 HydrophobicContact CG2-CG2 4.33Å; E118-I123 WeakPolarHBondContact CA-O 3.33Å; E118-I123 WeakPolarHBondContact CB-O 3.43Å; E118-I123 VanDerWaalsContact CG-O 3.32Å; E118-I123 WeakPolarHBondContact CG-O 3.4Å; E118-I123 PolarHBondContact O-N 3.39Å; E118-I123 VanDerWaalsContact O-N 3.16Å; R121-I123 VanDerWaalsContact C-N 3.33Å; R121-I123 HydrophobicContact CB-CD1 4.06Å; R121-I123 HydrophobicContact CB-CG1 3.81Å; I123-V125 HydrophobicContact CD1-CG2 4.14Å; I123-V125 HydrophobicContact CG1-CG2 4.13Å; I123-L415 HydrophobicContact CD1-CD1 4.13Å; I123-L415 HydrophobicContact CD1-CD2 3.82Å; I123-L415 HydrophobicContact CD1-CG 4.28Å; I123-V419 HydrophobicContact CD1-CG2 4.43Å
124	T	83.9	Confident	86.4	Confident	6 Å²	6	37.5 Å²	37.5	4%	0.037	18%	0.176	C	C	.	.			trans	-79.9	127.7	164	-51.1	0	0	0	0	108.8	K88 S89 D113 K126 P149	K88-T124 WeakPolarHBondContact CE-OG1 3.43Å; K88-T124 VanDerWaalsContact NZ-CB 3.34Å; K88-T124 PolarHBondContact NZ-OG1 3.41Å; S89-T124 PolarHBondContact OG-OG1 3.43Å; D113-T124 WeakPolarHBondContact OD1-CA 3.23Å; D113-T124 WeakPolarHBondContact OD1-CB 3.35Å; D113-T124 PolarHBondContact OD1-OG1 3.28Å; T124-K126 WeakPolarHBondContact CG2-O 3.28Å; T124-P149 WeakPolarHBondContact O-CA 3.37Å; T124-P149 WeakPolarHBondContact O-CB 3.48Å
125	V	83.3	Confident	86.8	Confident	8 Å²	8	36 Å²	36	5%	0.048	18%	0.178	C	C	.	.			trans	-102.8	-43.6	-178.8	167.8	0	0	0	0	110.2	L115 E118 I123 P149 F154 V419	L115-V125 HydrophobicContact CD1-CB 4.47Å; L115-V125 HydrophobicContact CD1-CG1 4.43Å; E118-V125 HydrophobicContact CG-CB 3.78Å; E118-V125 HydrophobicContact CG-CG2 3.8Å; E118-V125 WeakPolarHBondContact OE1-CA 3.45Å; E118-V125 WeakPolarHBondContact OE1-CB 3.34Å; E118-V125 PolarHBondContact OE1-N 3.03Å; I123-V125 HydrophobicContact CD1-CG2 4.14Å; I123-V125 HydrophobicContact CG1-CG2 4.13Å; V125-P149 WeakPolarHBondContact O-CG 3.45Å; V125-F154 HydrophobicContact CG1-CE1 4.05Å; V125-F154 HydrophobicContact CG1-CZ 3.96Å; V125-F154 HydrophobicContact CG2-CE2 4.3Å; V125-F154 HydrophobicContact CG2-CZ 4.28Å; V125-V419 HydrophobicContact CB-CG1 4.45Å; V125-V419 HydrophobicContact CG1-CG1 3.74Å; V125-V419 HydrophobicContact CG2-CG1 3.85Å; V125-V419 HydrophobicContact CG2-CG2 4.26Å
126	K	85.3	Confident	87	Confident	21 Å²	21	35.6 Å²	35.6	9%	0.091	18%	0.176	C	C	.	.	S	Bend	trans	-113.2	130.8	178.8	-178.9	156.1	-169.1	167.1	0	111.9	E118 T124 Q128 E157 D267 S268 N269	E118-K126 PolarHBondContact OE1-N 3.41Å; T124-K126 WeakPolarHBondContact CG2-O 3.28Å; K126-Q128 PolarHBondContact O-N 3.26Å; K126-E157 WeakPolarHBondContact CA-OE2 3.31Å; K126-D267 VanDerWaalsContact CE-CG 3.42Å; K126-D267 WeakPolarHBondContact CE-OD1 3.18Å; K126-D267 VanDerWaalsContact CE-OD2 3.27Å; K126-D267 WeakPolarHBondContact CE-OD2 3.38Å; K126-D267 IonicContact NZ-OD1 3.25Å; K126-D267 PolarHBondContact NZ-OD1 3.09Å; K126-D267 IonicContact NZ-OD2 3.95Å; K126-D267 PolarHBondContact NZ-OD2 3Å; K126-S268 PolarHBondContact NZ-O 2.62Å; K126-N269 WeakPolarHBondContact CE-OD1 3.24Å; K126-N269 PolarHBondContact NZ-OD1 3.32Å
127	A	84.8	Confident	87.2	Confident	6 Å²	6	36.9 Å²	36.9	5%	0.05	19%	0.186	C	C	.	.			trans	-56.3	136	175.9	0	0	0	0	0	112.1	I146 D147 E157 S161	A127-I146 HydrophobicContact CB-CG2 4.36Å; A127-D147 VanDerWaalsContact CA-O 3.27Å; A127-D147 WeakPolarHBondContact CA-O 3.38Å; A127-E157 PolarHBondContact N-OE2 2.94Å; A127-S161 WeakPolarHBondContact CB-OG 3.47Å
128	Q	86.9	Confident	87.2	Confident	22 Å²	22	40.5 Å²	40.5	10%	0.103	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	136.2	178.9	-66	-58.7	-54.7	0	0	111.6	L112 K126 I146 D147	L112-Q128 HydrophobicContact CB-CB 4.1Å; L112-Q128 HydrophobicContact CB-CG 4.27Å; L112-Q128 HydrophobicContact CD1-CB 4.41Å; L112-Q128 HydrophobicContact CD2-CB 4.34Å; L112-Q128 WeakPolarHBondContact O-CG 3.49Å; K126-Q128 PolarHBondContact O-N 3.26Å; Q128-I146 CarbonylContact O-C 3.57Å; Q128-I146 WeakPolarHBondContact O-CA 3.05Å; Q128-D147 PolarHBondContact N-O 3.4Å; Q128-D147 PolarHBondContact O-N 3.24Å
129	T	89.5	Confident	87.3	Confident	7 Å²	7	44.4 Å²	44.4	4%	0.043	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	138.5	177.7	-55.6	0	0	0	0	110.9	L145 I146 L310 V325	T129-L145 CarbonylContact C-O 3.51Å; T129-L145 VanDerWaalsContact CA-O 3.31Å; T129-L145 WeakPolarHBondContact CA-O 3.28Å; T129-I146 HydrophobicContact CG2-CG1 4.17Å; T129-L310 HydrophobicContact CG2-CD1 4.29Å; T129-L310 WeakPolarHBondContact O-CB 3.2Å; T129-V325 HydrophobicContact CG2-CG1 3.82Å
130	A	92.1	Very high	87.7	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	131.7	172.9	0	0	0	0	0	112.4	L96 L112 L145 L310	L96-A130 HydrophobicContact CD2-CB 3.84Å; L112-A130 HydrophobicContact CD2-CB 4.4Å; A130-L145 PolarHBondContact N-O 3.1Å; A130-L145 PolarHBondContact O-N 2.95Å; A130-L310 CarbonylContact C-O 3.48Å; A130-L310 WeakPolarHBondContact CA-O 3.44Å
131	S	92.6	Very high	88.2	Confident	1 Å²	1	39 Å²	39	1%	0.007	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	116.4	178.7	-57.5	0	0	0	0	111.1	N144 L310 R311	S131-N144 WeakPolarHBondContact CB-OD1 3.23Å; S131-N144 PolarHBondContact OG-OD1 3Å; S131-L310 PolarHBondContact N-O 3.32Å; S131-R311 WeakPolarHBondContact O-CG 3.46Å; S131-R311 PolarHBondContact O-NE 3.4Å
132	L	92.9	Very high	88.8	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	146.4	-179.4	-41	-178.7	0	0	0	109.9	L95 L96 T99 A101 L143 L145	L95-L132 HydrophobicContact CB-CD1 4.09Å; L96-L132 HydrophobicContact CD2-CD2 3.45Å; L96-L132 VanDerWaalsContact CD2-CD2 3.45Å; L96-L132 HydrophobicContact CG-CD2 4.18Å; T99-L132 HydrophobicContact CG2-CB 3.99Å; T99-L132 HydrophobicContact CG2-CD1 4.22Å; A101-L132 HydrophobicContact CB-CD2 4.31Å; L132-L143 HydrophobicContact CB-CB 4.22Å; L132-L143 PolarHBondContact N-O 2.82Å; L132-L143 PolarHBondContact O-N 3.47Å; L132-L145 HydrophobicContact CD1-CB 4.49Å
133	F	92.5	Very high	89.5	Confident	38 Å²	38	33 Å²	33	17%	0.167	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	126	164.7	-60.5	-51.2	0	0	0	107.8	V65 F70 T99 Y141 L142 L309 R311	V65-F133 HydrophobicContact CG1-CE1 4.48Å; V65-F133 HydrophobicContact CG1-CE2 3.94Å; V65-F133 HydrophobicContact CG1-CZ 3.66Å; V65-F133 HydrophobicContact CG2-CE2 4.28Å; F70-F133 HydrophobicContact CD2-CE1 4.31Å; F70-F133 HydrophobicContact CE1-CD1 4.07Å; F70-F133 HydrophobicContact CE1-CE1 4.42Å; F70-F133 AromaticContact CE2-CD1 3.96Å; F70-F133 HydrophobicContact CE2-CD1 3.96Å; F70-F133 AromaticContact CE2-CE1 3.58Å; F70-F133 HydrophobicContact CE2-CE1 3.58Å; F70-F133 HydrophobicContact CE2-CZ 4.35Å; F70-F133 AromaticContact CZ-CD1 3.5Å; F70-F133 HydrophobicContact CZ-CD1 3.5Å; F70-F133 AromaticContact CZ-CE1 3.65Å; F70-F133 HydrophobicContact CZ-CE1 3.65Å; F70-F133 HydrophobicContact CZ-CG 4.39Å; T99-F133 WeakPolarHBondContact CB-O 3.3Å; F133-Y141 WeakPolarHBondContact CA-O 3.36Å; F133-L142 HydrophobicContact CD1-CD1 4.33Å; F133-L142 HydrophobicContact CE1-CB 4.45Å; F133-L142 HydrophobicContact CE1-CD1 3.86Å; F133-L309 HydrophobicContact CZ-CD1 4.15Å; F133-R311 VanDerWaalsContact CD2-CZ 3.42Å
134	Y	93.4	Very high	90	Very high	24 Å²	24	31.9 Å²	31.9	9%	0.094	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	135	-179.1	-178.5	-123.5	0	0	0	109	T99 H136 Y141 L143 L243 V247	T99-Y134 HydrophobicContact CG2-CD2 4.31Å; Y134-H136 HydrophobicContact CD1-CB 4.15Å; Y134-H136 HydrophobicContact CE1-CB 3.78Å; Y134-Y141 PolarHBondContact N-O 2.83Å; Y134-Y141 VanDerWaalsContact N-O 3.1Å; Y134-Y141 PolarHBondContact O-N 3.12Å; Y134-L143 HydrophobicContact CD1-CD1 4.14Å; Y134-L143 HydrophobicContact CG-CD1 4.21Å; Y134-L243 HydrophobicContact CD1-CB 4.13Å; Y134-L243 HydrophobicContact CD2-CB 4.44Å; Y134-L243 HydrophobicContact CD2-CD1 4.06Å; Y134-L243 HydrophobicContact CE1-CB 3.72Å; Y134-L243 HydrophobicContact CE2-CB 4.09Å; Y134-L243 HydrophobicContact CE2-CD1 3.93Å; Y134-L243 HydrophobicContact CG-CB 4.48Å; Y134-V247 HydrophobicContact CD1-CG2 3.98Å; Y134-V247 HydrophobicContact CE1-CG2 4.3Å
135	S	91.3	Very high	90.4	Very high	73 Å²	73	31.6 Å²	31.6	51%	0.51	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	123.6	177.6	-170.9	0	0	0	0	109.2	Q139	S135-Q139 WeakPolarHBondContact CA-O 3.4Å
136	H	89.3	Confident	90.9	Very high	26 Å²	26	31.2 Å²	31.2	12%	0.12	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	130.2	-176.4	179.7	75.1	0	0	0	108.5	Y134 G138 Q139 Y141	Y134-H136 HydrophobicContact CD1-CB 4.15Å; Y134-H136 HydrophobicContact CE1-CB 3.78Å; H136-G138 PolarHBondContact O-N 3.26Å; H136-G138 VanDerWaalsContact O-N 3.14Å; H136-Q139 PolarHBondContact N-O 3.15Å; H136-Q139 PolarHBondContact O-N 3.12Å; H136-Y141 HydrophobicContact CB-CD2 4.2Å; H136-Y141 HydrophobicContact CB-CE2 4.09Å
137	D	87.6	Confident	91.2	Very high	142 Å²	142	30.2 Å²	30.2	76%	0.759	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	46.6	40.3	-173.7	-70.7	4.9	0	0	0	114.6	Q139	D137-Q139 PolarHBondContact O-N 2.9Å
138	G	84.7	Confident	91.4	Very high	77 Å²	77	30 Å²	30	79%	0.794	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	74	8.2	-179.6	0	0	0	0	0	114.8	H136	H136-G138 PolarHBondContact O-N 3.26Å; H136-G138 VanDerWaalsContact O-N 3.14Å
139	Q	88.8	Confident	91.3	Very high	82 Å²	82	28.9 Å²	28.9	38%	0.383	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	131.6	178.5	-54.9	-163.2	62.6	0	0	111.1	S135 H136 D137 Y141	S135-Q139 WeakPolarHBondContact CA-O 3.4Å; H136-Q139 PolarHBondContact N-O 3.15Å; H136-Q139 PolarHBondContact O-N 3.12Å; D137-Q139 PolarHBondContact O-N 2.9Å; Q139-Y141 HydrophobicContact CB-CE2 3.89Å; Q139-Y141 WeakPolarHBondContact O-CD2 3.47Å
140	E	92.5	Very high	90.7	Very high	107 Å²	107	29.1 Å²	29.1	50%	0.5	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	132.1	171.2	-60.8	-172.3	128	0	0	110.9	F70	F70-E140 HydrophobicContact CE1-CB 3.88Å; F70-E140 HydrophobicContact CZ-CB 4.36Å
141	Y	94.2	Very high	90.2	Very high	28 Å²	28	30.4 Å²	30.4	11%	0.11	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	147.8	174.7	-69.3	-94.7	0	0	0	110.8	K74 F133 Y134 H136 Q139 V247	K74-Y141 HydrophobicContact CB-CD1 4.1Å; K74-Y141 HydrophobicContact CB-CE1 4.42Å; K74-Y141 HydrophobicContact CG-CE1 4.39Å; K74-Y141 WeakPolarHBondContact O-CA 3.43Å; K74-Y141 WeakPolarHBondContact O-CD1 3.48Å; F133-Y141 WeakPolarHBondContact CA-O 3.36Å; Y134-Y141 PolarHBondContact N-O 2.83Å; Y134-Y141 VanDerWaalsContact N-O 3.1Å; Y134-Y141 PolarHBondContact O-N 3.12Å; H136-Y141 HydrophobicContact CB-CD2 4.2Å; H136-Y141 HydrophobicContact CB-CE2 4.09Å; Q139-Y141 HydrophobicContact CB-CE2 3.89Å; Q139-Y141 WeakPolarHBondContact O-CD2 3.47Å; Y141-V247 HydrophobicContact CD1-CG1 4.06Å; Y141-V247 HydrophobicContact CD1-CG2 4.45Å; Y141-V247 HydrophobicContact CD2-CG1 4.12Å; Y141-V247 HydrophobicContact CD2-CG2 4.25Å; Y141-V247 HydrophobicContact CE1-CG1 3.68Å; Y141-V247 HydrophobicContact CE2-CG1 3.72Å; Y141-V247 HydrophobicContact CG-CG1 4.28Å; Y141-V247 HydrophobicContact CG-CG2 4.15Å; Y141-V247 VanDerWaalsContact CZ-CG1 3.49Å
142	L	94.3	Very high	89.4	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	108.6	170.3	166.2	55.4	0	0	0	108.7	F70 K74 I75 R76 F133 L309 Q324	F70-L142 HydrophobicContact CB-CB 4.07Å; F70-L142 HydrophobicContact CB-CD2 4.3Å; F70-L142 HydrophobicContact CD1-CB 3.68Å; F70-L142 HydrophobicContact CD2-CB 4.42Å; F70-L142 HydrophobicContact CE1-CB 4.22Å; F70-L142 HydrophobicContact CG-CB 3.79Å; F70-L142 HydrophobicContact CG-CD2 4.45Å; K74-L142 PolarHBondContact O-N 2.85Å; I75-L142 VanDerWaalsContact CA-O 3.3Å; I75-L142 WeakPolarHBondContact CA-O 3.5Å; I75-L142 HydrophobicContact CG1-CB 4.4Å; I75-L142 HydrophobicContact CG1-CD2 4.4Å; R76-L142 PolarHBondContact N-O 3.29Å; F133-L142 HydrophobicContact CD1-CD1 4.33Å; F133-L142 HydrophobicContact CE1-CB 4.45Å; F133-L142 HydrophobicContact CE1-CD1 3.86Å; L142-L309 HydrophobicContact CD1-CD1 4.48Å; L142-Q324 HydrophobicContact CD2-CG 4.05Å
143	L	95	Very high	88.9	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	114.5	179	-38.3	178.3	0	0	0	108.7	R76 F78 L132 Y134 L243 V246 V247	R76-L143 HydrophobicContact CB-CD2 3.84Å; R76-L143 HydrophobicContact CG-CD2 3.94Å; R76-L143 CarbonylContact O-C 3.51Å; R76-L143 WeakPolarHBondContact O-CA 3.49Å; F78-L143 HydrophobicContact CE1-CB 3.95Å; L132-L143 HydrophobicContact CB-CB 4.22Å; L132-L143 PolarHBondContact N-O 2.82Å; L132-L143 PolarHBondContact O-N 3.47Å; Y134-L143 HydrophobicContact CD1-CD1 4.14Å; Y134-L143 HydrophobicContact CG-CD1 4.21Å; L143-L243 HydrophobicContact CD1-CD2 3.81Å; L143-V246 HydrophobicContact CD1-CG1 4.21Å; L143-V246 HydrophobicContact CD2-CG1 4.25Å; L143-V247 HydrophobicContact CD2-CG2 4.01Å
144	N	94.3	Very high	88.6	Confident	1 Å²	1	30 Å²	30	1%	0.005	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	109	175.6	-61.3	-55.9	0	0	0	109.3	R76 N77 F78 S131 V325	R76-N144 PolarHBondContact O-N 2.78Å; N77-N144 WeakPolarHBondContact OD1-CB 2.99Å; N77-N144 PolarHBondContact OD1-ND2 3.25Å; F78-N144 WeakPolarHBondContact CD1-O 3.41Å; F78-N144 PolarHBondContact N-O 2.94Å; F78-N144 VanDerWaalsContact O-O 3.11Å; S131-N144 WeakPolarHBondContact CB-OD1 3.23Å; S131-N144 PolarHBondContact OG-OD1 3Å; N144-V325 HydrophobicContact CB-CB 3.96Å; N144-V325 HydrophobicContact CB-CG2 4.01Å; N144-V325 PolarHBondContact ND2-N 3.04Å
145	L	93.9	Very high	88	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	127.1	176.2	164	60.1	0	0	0	109.7	F78 I80 A92 L95 T129 A130 L132	F78-L145 HydrophobicContact CD2-CD1 4.42Å; F78-L145 HydrophobicContact CE1-CB 4.04Å; F78-L145 HydrophobicContact CE2-CB 4.42Å; F78-L145 HydrophobicContact CE2-CD1 3.76Å; F78-L145 HydrophobicContact CZ-CB 3.82Å; F78-L145 HydrophobicContact CZ-CD1 4Å; F78-L145 HydrophobicContact CZ-CG 4.41Å; F78-L145 CarbonylContact O-C 3.52Å; F78-L145 WeakPolarHBondContact O-CA 3.29Å; I80-L145 HydrophobicContact CD1-CD1 3.51Å; I80-L145 HydrophobicContact CG1-CD1 3.53Å; A92-L145 HydrophobicContact CB-CD2 4.06Å; L95-L145 HydrophobicContact CD1-CD2 4.47Å; T129-L145 CarbonylContact C-O 3.51Å; T129-L145 VanDerWaalsContact CA-O 3.31Å; T129-L145 WeakPolarHBondContact CA-O 3.28Å; A130-L145 PolarHBondContact N-O 3.1Å; A130-L145 PolarHBondContact O-N 2.95Å; L132-L145 HydrophobicContact CD1-CB 4.49Å
146	I	92.5	Very high	87.7	Confident	1 Å²	1	29.4 Å²	29.4	1%	0.005	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	110.7	164.1	-56.2	170.1	0	0	0	109.5	F78 C79 I80 A127 Q128 T129 T148 A164 F266	F78-I146 PolarHBondContact O-N 3.44Å; C79-I146 CarbonylContact C-O 3.46Å; C79-I146 WeakPolarHBondContact CA-O 3.45Å; C79-I146 HydrophobicContact CB-CB 4.18Å; C79-I146 WeakPolarHBondContact CB-O 3.08Å; I80-I146 PolarHBondContact N-O 3.02Å; I80-I146 VanDerWaalsContact N-O 3.16Å; A127-I146 HydrophobicContact CB-CG2 4.36Å; Q128-I146 CarbonylContact O-C 3.57Å; Q128-I146 WeakPolarHBondContact O-CA 3.05Å; T129-I146 HydrophobicContact CG2-CG1 4.17Å; I146-T148 HydrophobicContact CG2-CG2 4.45Å; I146-A164 HydrophobicContact CD1-CB 3.76Å; I146-F266 HydrophobicContact CD1-CD2 4.4Å; I146-F266 HydrophobicContact CD1-CE2 3.76Å; I146-F266 HydrophobicContact CD1-CZ 4.02Å; I146-F266 HydrophobicContact CG1-CE2 4.47Å
147	D	91.1	Very high	87.5	Confident	0 Å²	0	29 Å²	29	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	113.8	178.2	-171.9	38.9	0	0	0	109.8	K88 L112 A127 Q128	K88-D147 WeakPolarHBondContact CD-OD1 3.41Å; K88-D147 VanDerWaalsContact CG-OD1 3.28Å; K88-D147 WeakPolarHBondContact CG-OD1 3.44Å; K88-D147 IonicContact NZ-OD1 3.63Å; K88-D147 PolarHBondContact NZ-OD1 2.88Å; K88-D147 IonicContact NZ-OD2 2.8Å; K88-D147 PolarHBondContact NZ-OD2 3.38Å; L112-D147 HydrophobicContact CD1-CB 3.5Å; A127-D147 VanDerWaalsContact CA-O 3.27Å; A127-D147 WeakPolarHBondContact CA-O 3.38Å; Q128-D147 PolarHBondContact N-O 3.4Å; Q128-D147 PolarHBondContact O-N 3.24Å
148	T	89.3	Confident	87.5	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	13%	0.132	C	C	.	.			trans	-98.5	162.6	-169.3	77.1	0	0	0	0	112.6	C79 I80 K88 I146 S161	C79-T148 HydrophobicContact CB-CG2 3.95Å; I80-T148 PolarHBondContact O-OG1 2.87Å; K88-T148 WeakPolarHBondContact CD-O 3.47Å; K88-T148 WeakPolarHBondContact CE-O 3.3Å; K88-T148 PolarHBondContact NZ-O 2.91Å; I146-T148 HydrophobicContact CG2-CG2 4.45Å; T148-S161 VanDerWaalsContact CG2-CB 3.5Å
149	P	85.7	Confident	87.6	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.112	C	C	.	.			trans	-61.1	155.5	165	-28.6	40.9	0	0	0	112.6	T124 V125 F154 E157 V158	T124-P149 WeakPolarHBondContact O-CA 3.37Å; T124-P149 WeakPolarHBondContact O-CB 3.48Å; V125-P149 WeakPolarHBondContact O-CG 3.45Å; P149-F154 HydrophobicContact CB-CB 3.46Å; P149-F154 VanDerWaalsContact CB-CB 3.46Å; P149-F154 HydrophobicContact CB-CD2 4.27Å; P149-F154 HydrophobicContact CB-CG 4.14Å; P149-F154 HydrophobicContact CG-CB 3.97Å; P149-E157 HydrophobicContact CG-CB 3.66Å; P149-E157 HydrophobicContact CG-CG 3.96Å; P149-V158 VanDerWaalsContact O-CG2 3.31Å; P149-V158 WeakPolarHBondContact O-CG2 3.48Å
150	G	76.8	Confident	87.5	Confident	11 Å²	11	17.5 Å²	17.5	11%	0.113	10%	0.095	C	C	.	.			trans	-109.8	0.1	-178.7	0	0	0	0	0	115.6	Q181	G150-Q181 VanDerWaalsContact O-CD 3.3Å; G150-Q181 PolarHBondContact O-OE1 2.9Å
151	H	82.4	Confident	87.3	Confident	28 Å²	28	12.5 Å²	12.5	13%	0.13	7%	0.072	C	C	.	.	S	Bend	trans	-112.7	142.8	-174.1	-174.4	-79.1	0	0	0	111.8	I84 D153 F154 L415	I84-H151 HydrophobicContact CD1-CB 4.04Å; H151-D153 VanDerWaalsContact C-N 3.34Å; H151-D153 IonicContact CE1-OD1 3.19Å; H151-D153 PolarHBondContact CE1-OD1 2.79Å; H151-D153 IonicContact CE1-OD2 2.69Å; H151-D153 WeakPolarHBondContact ND1-CB 3.39Å; H151-D153 PolarHBondContact ND1-N 2.9Å; H151-D153 VanDerWaalsContact ND1-N 3.16Å; H151-D153 IonicContact ND1-OD1 3.28Å; H151-D153 PolarHBondContact O-N 2.8Å; H151-F154 HydrophobicContact CB-CD2 4.2Å; H151-F154 WeakPolarHBondContact O-CA 3.4Å; H151-F154 PolarHBondContact O-N 3.48Å; H151-L415 HydrophobicContact CB-CD2 3.99Å; H151-L415 WeakPolarHBondContact CD2-CD2 3.28Å; H151-L415 VanDerWaalsContact CG-CD2 3.45Å
152	V	75.1	Confident	87.1	Confident	17 Å²	17	11.3 Å²	11.3	10%	0.103	7%	0.067	C	C	.	.	G	3₁₀ helix	trans	-52.5	-41.8	-175.4	63.6	0	0	0	0	114.4	F154 S155 D547 Y548	V152-F154 PolarHBondContact O-N 2.91Å; V152-S155 WeakPolarHBondContact O-CB 3.43Å; V152-S155 PolarHBondContact O-N 2.98Å; V152-S155 PolarHBondContact O-OG 3.01Å; V152-D547 WeakPolarHBondContact CB-OD1 3.23Å; V152-D547 WeakPolarHBondContact CG2-OD2 3.39Å; V152-Y548 HydrophobicContact CB-CE1 4.47Å; V152-Y548 HydrophobicContact CG1-CD1 4.01Å; V152-Y548 HydrophobicContact CG1-CE1 3.47Å; V152-Y548 VanDerWaalsContact CG1-CE1 3.47Å; V152-Y548 HydrophobicContact CG2-CD1 4.22Å; V152-Y548 HydrophobicContact CG2-CE1 4.14Å
153	D	82.9	Confident	86.7	Confident	7 Å²	7	13.7 Å²	13.7	4%	0.037	8%	0.084	C	C	.	.	G	3₁₀ helix	trans	-58.4	-15.3	174.5	-64.5	15.2	0	0	0	114.5	H151 L412 G413 L414 L415 H416 Y548	H151-D153 VanDerWaalsContact C-N 3.34Å; H151-D153 IonicContact CE1-OD1 3.19Å; H151-D153 PolarHBondContact CE1-OD1 2.79Å; H151-D153 IonicContact CE1-OD2 2.69Å; H151-D153 WeakPolarHBondContact ND1-CB 3.39Å; H151-D153 PolarHBondContact ND1-N 2.9Å; H151-D153 VanDerWaalsContact ND1-N 3.16Å; H151-D153 IonicContact ND1-OD1 3.28Å; H151-D153 PolarHBondContact O-N 2.8Å; D153-L412 WeakPolarHBondContact O-CB 3.43Å; D153-L412 VanDerWaalsContact O-CD1 3.22Å; D153-L412 WeakPolarHBondContact O-CD1 3.41Å; D153-G413 VanDerWaalsContact CG-CA 3.49Å; D153-G413 VanDerWaalsContact OD2-CA 3.23Å; D153-G413 WeakPolarHBondContact OD2-CA 3.45Å; D153-L414 PolarHBondContact OD2-N 3Å; D153-L415 WeakPolarHBondContact OD2-CB 3.41Å; D153-L415 PolarHBondContact OD2-N 3.37Å; D153-H416 HydrophobicContact CB-CB 4.17Å; D153-H416 PolarHBondContact OD2-N 2.76Å; D153-Y548 PolarHBondContact OD1-OH 2.94Å
154	F	85.2	Confident	86.4	Confident	6 Å²	6	13.7 Å²	13.7	3%	0.026	8%	0.084	C	C	.	.	G	3₁₀ helix	trans	-111.5	15.1	175.4	-57.7	-61	0	0	0	112.6	V125 P149 H151 V152 Y156 E157 V158 L415 H416 V419	V125-F154 HydrophobicContact CG1-CE1 4.05Å; V125-F154 HydrophobicContact CG1-CZ 3.96Å; V125-F154 HydrophobicContact CG2-CE2 4.3Å; V125-F154 HydrophobicContact CG2-CZ 4.28Å; P149-F154 HydrophobicContact CB-CB 3.46Å; P149-F154 VanDerWaalsContact CB-CB 3.46Å; P149-F154 HydrophobicContact CB-CD2 4.27Å; P149-F154 HydrophobicContact CB-CG 4.14Å; P149-F154 HydrophobicContact CG-CB 3.97Å; H151-F154 HydrophobicContact CB-CD2 4.2Å; H151-F154 WeakPolarHBondContact O-CA 3.4Å; H151-F154 PolarHBondContact O-N 3.48Å; V152-F154 PolarHBondContact O-N 2.91Å; F154-Y156 PolarHBondContact O-N 3.01Å; F154-E157 HydrophobicContact CB-CG 4.29Å; F154-E157 WeakPolarHBondContact O-CA 3.37Å; F154-E157 VanDerWaalsContact O-CB 3.25Å; F154-E157 WeakPolarHBondContact O-CB 3.26Å; F154-E157 PolarHBondContact O-N 2.81Å; F154-V158 PolarHBondContact O-N 2.69Å; F154-L415 HydrophobicContact CE2-CD2 4.08Å; F154-L415 HydrophobicContact CE2-CG 4.21Å; F154-H416 HydrophobicContact CE1-CB 3.82Å; F154-H416 HydrophobicContact CZ-CB 4.16Å; F154-V419 HydrophobicContact CZ-CB 4.42Å; F154-V419 HydrophobicContact CZ-CG1 4.49Å; F154-V419 HydrophobicContact CZ-CG2 4.38Å
155	S	81.4	Confident	86.3	Confident	49 Å²	49	14 Å²	14	34%	0.343	9%	0.086	S	C	.	.	H	α-helix	trans	-51.7	-28.7	175.6	49.7	0	0	0	0	114.2	V152 V158 S159	V152-S155 WeakPolarHBondContact O-CB 3.43Å; V152-S155 PolarHBondContact O-N 2.98Å; V152-S155 PolarHBondContact O-OG 3.01Å; S155-V158 PolarHBondContact O-N 2.85Å; S155-S159 WeakPolarHBondContact O-CB 3.19Å; S155-S159 PolarHBondContact O-N 3.34Å
156	Y	83.9	Confident	86.4	Confident	36 Å²	36	15.9 Å²	15.9	14%	0.141	10%	0.095	C	C	.	.	H	α-helix	trans	-64.3	-38.4	172.4	-175.2	-124	0	0	0	113	F154 R160 F357 K358 A360	F154-Y156 PolarHBondContact O-N 3.01Å; Y156-R160 HydrophobicContact CE2-CG 4.33Å; Y156-R160 WeakPolarHBondContact O-CB 3.44Å; Y156-R160 WeakPolarHBondContact O-CD 3.38Å; Y156-R160 VanDerWaalsContact O-CG 3.31Å; Y156-R160 WeakPolarHBondContact O-CG 3.49Å; Y156-R160 PolarHBondContact O-N 3.45Å; Y156-R160 VanDerWaalsContact O-N 3.07Å; Y156-F357 HydrophobicContact CE2-CB 4.48Å; Y156-K358 WeakPolarHBondContact CE2-O 3.46Å; Y156-A360 HydrophobicContact CD1-CB 3.98Å; Y156-A360 HydrophobicContact CE1-CB 3.93Å; Y156-A360 HydrophobicContact CE2-CB 4.48Å; Y156-A360 HydrophobicContact CG-CB 4.29Å
157	E	86.6	Confident	86.5	Confident	16 Å²	16	15.8 Å²	15.8	8%	0.075	9%	0.094	C	C	.	.	H	α-helix	trans	-64.1	-42.3	172.8	-62.7	-92	126.2	0	0	110.8	K126 A127 P149 F154 R160 S161	K126-E157 WeakPolarHBondContact CA-OE2 3.31Å; A127-E157 PolarHBondContact N-OE2 2.94Å; P149-E157 HydrophobicContact CG-CB 3.66Å; P149-E157 HydrophobicContact CG-CG 3.96Å; F154-E157 HydrophobicContact CB-CG 4.29Å; F154-E157 WeakPolarHBondContact O-CA 3.37Å; F154-E157 VanDerWaalsContact O-CB 3.25Å; F154-E157 WeakPolarHBondContact O-CB 3.26Å; F154-E157 PolarHBondContact O-N 2.81Å; E157-R160 IonicContact OE1-CZ 3.68Å; E157-R160 IonicContact OE1-NH1 2.68Å; E157-R160 PolarHBondContact OE1-NH1 3.31Å; E157-R160 IonicContact OE1-NH2 3.57Å; E157-R160 PolarHBondContact OE1-NH2 3.23Å; E157-R160 IonicContact OE2-NH2 3.56Å; E157-R160 PolarHBondContact OE2-NH2 2.81Å; E157-S161 WeakPolarHBondContact O-CB 3.41Å; E157-S161 PolarHBondContact O-N 2.79Å; E157-S161 PolarHBondContact O-OG 2.72Å
158	V	87.6	Confident	86.8	Confident	2 Å²	2	15.8 Å²	15.8	1%	0.012	9%	0.094	C	C	.	.	H	α-helix	trans	-64.3	-49.1	179.1	-173.9	0	0	0	0	110.4	I81 P149 F154 S155 R160 S161 L162	I81-V158 HydrophobicContact CG2-CG1 4.09Å; P149-V158 VanDerWaalsContact O-CG2 3.31Å; P149-V158 WeakPolarHBondContact O-CG2 3.48Å; F154-V158 PolarHBondContact O-N 2.69Å; S155-V158 PolarHBondContact O-N 2.85Å; V158-R160 PolarHBondContact O-N 3.17Å; V158-S161 WeakPolarHBondContact O-CB 3.43Å; V158-S161 PolarHBondContact O-N 3.13Å; V158-S161 VanDerWaalsContact O-N 3.13Å; V158-L162 HydrophobicContact CG1-CD1 3.91Å; V158-L162 HydrophobicContact CG1-CG 4.3Å; V158-L162 VanDerWaalsContact O-CG 3.3Å; V158-L162 WeakPolarHBondContact O-CG 3.35Å; V158-L162 PolarHBondContact O-N 3.15Å
159	S	85.5	Confident	87.1	Confident	53 Å²	53	15.8 Å²	15.8	37%	0.371	9%	0.094	S	C	.	.	H	α-helix	trans	-60.4	-42.5	178.1	-179.4	0	0	0	0	112.8	S155 S163	S155-S159 WeakPolarHBondContact O-CB 3.19Å; S155-S159 PolarHBondContact O-N 3.34Å; S159-S163 PolarHBondContact O-N 2.86Å
160	R	86.9	Confident	87.6	Confident	5 Å²	5	15.8 Å²	15.8	2%	0.019	9%	0.094	C	C	.	.	H	α-helix	trans	-58.9	-47	172	-78.3	161.7	26.7	-146.1	-9.8	111.6	Y156 E157 V158 S163 F266 D267 I340 F357	Y156-R160 HydrophobicContact CE2-CG 4.33Å; Y156-R160 WeakPolarHBondContact O-CB 3.44Å; Y156-R160 WeakPolarHBondContact O-CD 3.38Å; Y156-R160 VanDerWaalsContact O-CG 3.31Å; Y156-R160 WeakPolarHBondContact O-CG 3.49Å; Y156-R160 PolarHBondContact O-N 3.45Å; Y156-R160 VanDerWaalsContact O-N 3.07Å; E157-R160 IonicContact OE1-CZ 3.68Å; E157-R160 IonicContact OE1-NH1 2.68Å; E157-R160 PolarHBondContact OE1-NH1 3.31Å; E157-R160 IonicContact OE1-NH2 3.57Å; E157-R160 PolarHBondContact OE1-NH2 3.23Å; E157-R160 IonicContact OE2-NH2 3.56Å; E157-R160 PolarHBondContact OE2-NH2 2.81Å; V158-R160 PolarHBondContact O-N 3.17Å; R160-S163 PolarHBondContact O-N 3.07Å; R160-S163 PolarHBondContact O-OG 2.92Å; R160-F266 PolarHBondContact NE-O 2.86Å; R160-D267 IonicContact NH2-OD1 3.7Å; R160-I340 HydrophobicContact CG-CG2 4.06Å; R160-F357 HydrophobicContact CB-CE1 4.48Å; R160-F357 HydrophobicContact CB-CZ 4.31Å; R160-F357 HydrophobicContact CG-CD1 4.28Å; R160-F357 HydrophobicContact CG-CD2 4.09Å; R160-F357 HydrophobicContact CG-CE1 4.23Å; R160-F357 HydrophobicContact CG-CE2 4.04Å; R160-F357 HydrophobicContact CG-CG 4.22Å; R160-F357 HydrophobicContact CG-CZ 4.11Å
161	S	88.9	Confident	88.5	Confident	2 Å²	2	15.3 Å²	15.3	1%	0.014	9%	0.089	C	C	.	.	H	α-helix	trans	-64.1	-46.4	-178.6	-57.6	0	0	0	0	112.8	A127 T148 E157 V158 S163 A164 C165	A127-S161 WeakPolarHBondContact CB-OG 3.47Å; T148-S161 VanDerWaalsContact CG2-CB 3.5Å; E157-S161 WeakPolarHBondContact O-CB 3.41Å; E157-S161 PolarHBondContact O-N 2.79Å; E157-S161 PolarHBondContact O-OG 2.72Å; V158-S161 WeakPolarHBondContact O-CB 3.43Å; V158-S161 PolarHBondContact O-N 3.13Å; V158-S161 VanDerWaalsContact O-N 3.13Å; S161-S163 PolarHBondContact O-N 2.78Å; S161-A164 PolarHBondContact O-N 3.07Å; S161-A164 VanDerWaalsContact O-N 3.13Å; S161-C165 PolarHBondContact O-SG 3.36Å
162	L	89.2	Confident	89.2	Confident	4 Å²	4	14 Å²	14	2%	0.021	8%	0.083	C	C	.	.	H	α-helix	trans	-54.6	-39.6	179.1	-74.2	164	0	0	0	111.9	C79 I81 V158 A164 C165 V168 L188 A189 L194	C79-L162 VanDerWaalsContact SG-CD2 3.58Å; I81-L162 HydrophobicContact CG2-CD2 4.47Å; V158-L162 HydrophobicContact CG1-CD1 3.91Å; V158-L162 HydrophobicContact CG1-CG 4.3Å; V158-L162 VanDerWaalsContact O-CG 3.3Å; V158-L162 WeakPolarHBondContact O-CG 3.35Å; V158-L162 PolarHBondContact O-N 3.15Å; L162-A164 PolarHBondContact O-N 2.8Å; L162-C165 WeakPolarHBondContact O-CB 3.28Å; L162-C165 PolarHBondContact O-N 3.42Å; L162-V168 HydrophobicContact CD2-CG2 4.49Å; L162-L188 HydrophobicContact CD1-CB 3.84Å; L162-A189 HydrophobicContact CD2-CB 4.07Å; L162-L194 HydrophobicContact CB-CD1 4.05Å; L162-L194 HydrophobicContact CD2-CD1 3.47Å; L162-L194 VanDerWaalsContact CD2-CD1 3.47Å; L162-L194 HydrophobicContact CG-CD1 4.37Å
163	S	86.8	Confident	90.2	Very high	49 Å²	49	13.2 Å²	13.2	34%	0.343	8%	0.078	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-18.2	-178.4	76.2	0	0	0	0	115.6	S159 R160 S161 F357	S159-S163 PolarHBondContact O-N 2.86Å; R160-S163 PolarHBondContact O-N 3.07Å; R160-S163 PolarHBondContact O-OG 2.92Å; S161-S163 PolarHBondContact O-N 2.78Å; S163-F357 VanDerWaalsContact OG-CE1 3.23Å; S163-F357 WeakPolarHBondContact OG-CE1 3.18Å; S163-F357 WeakPolarHBondContact OG-CZ 3.08Å
164	A	88.6	Confident	90.8	Very high	1 Å²	1	12.9 Å²	12.9	1%	0.008	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-4	175.8	0	0	0	0	0	112.5	N77 I146 S161 L162 F266 A281	N77-A164 WeakPolarHBondContact CB-O 3.38Å; I146-A164 HydrophobicContact CD1-CB 3.76Å; S161-A164 PolarHBondContact O-N 3.07Å; S161-A164 VanDerWaalsContact O-N 3.13Å; L162-A164 PolarHBondContact O-N 2.8Å; A164-F266 HydrophobicContact CB-CB 4.35Å; A164-F266 HydrophobicContact CB-CD1 4.02Å; A164-F266 HydrophobicContact CB-CD2 4.26Å; A164-F266 HydrophobicContact CB-CE1 4.39Å; A164-F266 HydrophobicContact CB-CG 3.95Å; A164-A281 HydrophobicContact CB-CB 4.12Å
165	C	93.1	Very high	91.1	Very high	6 Å²	6	15.5 Å²	15.5	4%	0.041	9%	0.091	C	C	.	.			trans	-107.2	165.4	-174.7	-62.9	0	0	0	0	113	N77 C79 S161 L162 L194	N77-C165 WeakPolarHBondContact O-CA 3.34Å; C79-C165 PolarHBondContact N-SG 2.88Å; S161-C165 PolarHBondContact O-SG 3.36Å; L162-C165 WeakPolarHBondContact O-CB 3.28Å; L162-C165 PolarHBondContact O-N 3.42Å; C165-L194 HydrophobicContact CB-CD1 4.45Å; C165-L194 VanDerWaalsContact O-CD2 3.28Å; C165-L194 WeakPolarHBondContact O-CD2 3.16Å
166	Q	95.1	Very high	91.5	Very high	40 Å²	40	16 Å²	16	19%	0.187	9%	0.088	C	C	.	.	S	Bend	trans	-112.5	-14.4	170.2	-80.2	72.2	77.6	0	0	111.8	N77 A195 I250 P251	N77-Q166 PolarHBondContact ND2-OE1 2.88Å; N77-Q166 PolarHBondContact O-N 2.93Å; Q166-A195 PolarHBondContact O-N 2.75Å; Q166-A195 VanDerWaalsContact O-N 3.08Å; Q166-I250 HydrophobicContact CB-CG2 3.99Å; Q166-P251 HydrophobicContact CB-CG 4.21Å; Q166-P251 WeakPolarHBondContact CB-O 3.41Å
167	G	95.4	Very high	91.9	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	8%	0.081	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	178.1	175.9	0	0	0	0	0	112.6	N77 F78 C79 A195	N77-G167 PolarHBondContact O-N 3.13Å; F78-G167 VanDerWaalsContact CA-O 3.28Å; F78-G167 WeakPolarHBondContact CA-O 3.37Å; C79-G167 PolarHBondContact N-O 2.78Å; G167-A195 CarbonylContact C-O 3.34Å; G167-A195 WeakPolarHBondContact CA-O 3.47Å
168	V	96.1	Very high	92.2	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	141.2	-174.3	63.4	0	0	0	0	111.8	C79 I81 L162 A189 A195 I196 I197	C79-V168 WeakPolarHBondContact O-CA 3.49Å; C79-V168 VanDerWaalsContact SG-CG2 3.52Å; I81-V168 HydrophobicContact CB-CG2 4.13Å; I81-V168 HydrophobicContact CD1-CG1 4.25Å; I81-V168 HydrophobicContact CD1-CG2 3.58Å; I81-V168 HydrophobicContact CG1-CG2 3.52Å; I81-V168 HydrophobicContact CG2-CG2 3.78Å; L162-V168 HydrophobicContact CD2-CG2 4.49Å; V168-A189 HydrophobicContact CG1-CB 3.78Å; V168-A195 PolarHBondContact N-O 3.03Å; V168-I196 HydrophobicContact CG1-CB 4.21Å; V168-I196 HydrophobicContact CG1-CG1 3.82Å; V168-I196 HydrophobicContact CG1-CG2 4.26Å; V168-I197 PolarHBondContact O-N 2.99Å
169	L	96.8	Very high	92.4	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	113.1	167.8	-57.2	-175.4	0	0	0	109.2	F78 C79 I80 I81 L91 L95 I197 V199 V242 V246	F78-L169 HydrophobicContact CD2-CD1 4.09Å; F78-L169 HydrophobicContact CD2-CG 3.96Å; F78-L169 HydrophobicContact CE2-CD1 3.74Å; F78-L169 HydrophobicContact CE2-CG 4.15Å; C79-L169 PolarHBondContact O-N 3.01Å; I80-L169 HydrophobicContact CD1-CD1 4.38Å; I80-L169 HydrophobicContact CG1-CB 4.29Å; I80-L169 HydrophobicContact CG1-CD1 4.17Å; I80-L169 HydrophobicContact CG2-CB 4.36Å; I81-L169 PolarHBondContact N-O 2.89Å; I81-L169 VanDerWaalsContact O-O 3.13Å; L91-L169 HydrophobicContact CD2-CD1 4.2Å; L95-L169 HydrophobicContact CD1-CD1 4.4Å; L169-I197 HydrophobicContact CD2-CB 3.85Å; L169-I197 HydrophobicContact CD2-CD1 4.07Å; L169-I197 HydrophobicContact CD2-CG1 4.45Å; L169-I197 HydrophobicContact CD2-CG2 4.16Å; L169-V199 HydrophobicContact CB-CG2 4.38Å; L169-V199 HydrophobicContact CD2-CG2 4.23Å; L169-V242 HydrophobicContact CD1-CG1 3.48Å; L169-V242 VanDerWaalsContact CD1-CG1 3.48Å; L169-V242 HydrophobicContact CD2-CG1 3.92Å; L169-V242 HydrophobicContact CG-CG1 4.35Å; L169-V246 HydrophobicContact CD1-CG2 4.47Å; L169-V246 HydrophobicContact CD2-CG2 3.86Å; L169-V246 HydrophobicContact CG-CG2 4.48Å
170	L	96.1	Very high	92.5	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.063	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	99.8	176.8	176.2	62.1	0	0	0	109.3	I81 I172 T182 F186 I196 I197 V199 F221	I81-L170 HydrophobicContact CD1-CB 4.44Å; I81-L170 HydrophobicContact CD1-CD1 3.8Å; I81-L170 HydrophobicContact CG1-CB 4.34Å; I81-L170 HydrophobicContact CG1-CD1 3.78Å; L170-I172 HydrophobicContact CD2-CD1 4.32Å; L170-I172 HydrophobicContact CG-CD1 4.24Å; L170-I172 HydrophobicContact CG-CG1 4.32Å; L170-T182 HydrophobicContact CD1-CG2 3.87Å; L170-T182 HydrophobicContact CG-CG2 4.44Å; L170-F186 HydrophobicContact CD2-CB 4.36Å; L170-F186 HydrophobicContact CD2-CD2 4.07Å; L170-I196 HydrophobicContact CB-CG2 3.94Å; L170-I196 HydrophobicContact CD2-CG2 4.06Å; L170-I197 PolarHBondContact N-O 3.03Å; L170-V199 PolarHBondContact O-N 2.81Å; L170-F221 HydrophobicContact CD2-CD2 4.3Å; L170-F221 HydrophobicContact CD2-CE2 4.04Å
171	I	96.3	Very high	92.5	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	6%	0.062	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	124.2	-176	-56.2	178.5	0	0	0	112	I80 I81 A82 H86 L91 V199 N201	I80-I171 HydrophobicContact CG2-CD1 3.26Å; I80-I171 HydrophobicContact CG2-CG1 3.79Å; I81-I171 PolarHBondContact O-N 2.97Å; A82-I171 HydrophobicContact CB-CB 4Å; H86-I171 HydrophobicContact CB-CG2 4.2Å; H86-I171 PolarHBondContact ND1-O 2.95Å; H86-I171 WeakPolarHBondContact O-CG2 3.37Å; L91-I171 HydrophobicContact CB-CD1 3.98Å; L91-I171 HydrophobicContact CD2-CD1 3.58Å; L91-I171 HydrophobicContact CD2-CG1 4.22Å; L91-I171 HydrophobicContact CG-CD1 4.41Å; I171-V199 WeakPolarHBondContact CA-O 3.47Å; I171-V199 HydrophobicContact CG1-CB 4.4Å; I171-N201 HydrophobicContact CG2-CB 3.67Å
172	I	96.1	Very high	92.7	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	6%	0.061	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	129.3	178.9	-53.5	177.1	0	0	0	108.8	H86 L170 I178 T182 V199 I200 N201 V213 I217 F221	H86-I172 WeakPolarHBondContact ND1-CA 3.45Å; L170-I172 HydrophobicContact CD2-CD1 4.32Å; L170-I172 HydrophobicContact CG-CD1 4.24Å; L170-I172 HydrophobicContact CG-CG1 4.32Å; I172-I178 HydrophobicContact CD1-CG1 4.31Å; I172-T182 HydrophobicContact CD1-CG2 3.79Å; I172-T182 HydrophobicContact CG1-CG2 3.73Å; I172-V199 PolarHBondContact N-O 3.45Å; I172-I200 CarbonylContact O-C 3.6Å; I172-I200 WeakPolarHBondContact O-CA 3.46Å; I172-N201 PolarHBondContact O-N 2.71Å; I172-V213 HydrophobicContact CB-CG1 4.28Å; I172-V213 HydrophobicContact CG2-CG1 3.55Å; I172-I217 HydrophobicContact CD1-CD1 3.71Å; I172-I217 HydrophobicContact CD1-CG1 3.63Å; I172-F221 HydrophobicContact CD1-CE2 4.29Å
173	D	95.3	Very high	92.7	Very high	1 Å²	1	11.3 Å²	11.3	1%	0.005	6%	0.061	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	125.6	178.7	172.2	-32.8	0	0	0	110	H86 N175 Q176 G177 K202	H86-D173 HydrophobicContact CB-CB 4.41Å; H86-D173 PolarHBondContact ND1-N 3.14Å; D173-N175 PolarHBondContact O-N 3.45Å; D173-N175 WeakPolarHBondContact OD1-CA 3.42Å; D173-N175 WeakPolarHBondContact OD1-CB 3.45Å; D173-N175 PolarHBondContact OD1-N 2.88Å; D173-Q176 HydrophobicContact CB-CB 3.95Å; D173-Q176 HydrophobicContact CB-CG 4.32Å; D173-Q176 PolarHBondContact O-N 2.95Å; D173-Q176 PolarHBondContact OD1-N 3.49Å; D173-G177 WeakPolarHBondContact O-CA 3.33Å; D173-G177 PolarHBondContact O-N 3.44Å; D173-K202 WeakPolarHBondContact OD2-CD 3.12Å; D173-K202 VanDerWaalsContact OD2-CE 3.22Å; D173-K202 WeakPolarHBondContact OD2-CE 3.25Å; D173-K202 IonicContact OD2-NZ 2.64Å; D173-K202 PolarHBondContact OD2-NZ 3.17Å
174	A	95.4	Very high	92.8	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.05	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-24.5	-176.8	0	0	0	0	0	114.3	I200 N201 I203 A208 D209 P210	A174-I200 HydrophobicContact CB-CG2 3.73Å; A174-N201 VanDerWaalsContact CB-O 3.32Å; A174-N201 WeakPolarHBondContact CB-O 3.38Å; A174-N201 PolarHBondContact N-O 3.24Å; A174-I203 HydrophobicContact CB-CG2 4.28Å; A174-A208 HydrophobicContact CB-CB 3.72Å; A174-D209 CarbonylContact O-C 3.55Å; A174-D209 PolarHBondContact O-N 3.45Å; A174-P210 HydrophobicContact CB-CG 4.34Å
175	N	92.2	Very high	92.9	Very high	62 Å²	62	10 Å²	10	33%	0.332	5%	0.052	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-40.6	175.3	164.1	98.1	0	0	0	111.1	D173 L205 N207	D173-N175 PolarHBondContact O-N 3.45Å; D173-N175 WeakPolarHBondContact OD1-CA 3.42Å; D173-N175 WeakPolarHBondContact OD1-CB 3.45Å; D173-N175 PolarHBondContact OD1-N 2.88Å; N175-L205 HydrophobicContact CB-CD1 4.13Å; N175-N207 WeakPolarHBondContact OD1-CB 3.33Å; N175-N207 PolarHBondContact OD1-O 2.91Å
176	Q	90.6	Very high	92.8	Very high	58 Å²	58	10.2 Å²	10.2	27%	0.271	5%	0.053	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-24.7	-179.3	-62	-169.5	16.7	0	0	114.8	D173 Q179 R516	D173-Q176 HydrophobicContact CB-CB 3.95Å; D173-Q176 HydrophobicContact CB-CG 4.32Å; D173-Q176 PolarHBondContact O-N 2.95Å; D173-Q176 PolarHBondContact OD1-N 3.49Å; Q176-Q179 PolarHBondContact O-NE2 3.13Å; Q176-R516 PolarHBondContact O-NH1 3.16Å; Q176-R516 PolarHBondContact O-NH2 3.13Å
177	G	91.9	Very high	92.6	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	6%	0.061	C	C	.	.	B	Isolated β-bridge	trans	61.9	-160.7	-175.3	0	0	0	0	0	114.8	H86 D173	H86-G177 PolarHBondContact CE1-O 3.48Å; D173-G177 WeakPolarHBondContact O-CA 3.33Å; D173-G177 PolarHBondContact O-N 3.44Å
178	I	92.6	Very high	92.3	Very high	1 Å²	1	15.4 Å²	15.4	1%	0.005	8%	0.075	C	C	.	.			trans	-63.4	136	178.1	-61.3	-175.1	0	0	0	110.7	I172 T182 V183 Q216 I217 V220 F221 L486 R516	I172-I178 HydrophobicContact CD1-CG1 4.31Å; I178-T182 HydrophobicContact CG2-CG2 4.36Å; I178-V183 HydrophobicContact CG2-CG2 3.58Å; I178-Q216 HydrophobicContact CD1-CB 3.73Å; I178-Q216 WeakPolarHBondContact CD1-O 3.46Å; I178-Q216 HydrophobicContact CG1-CB 3.97Å; I178-I217 HydrophobicContact CD1-CG1 4.38Å; I178-V220 HydrophobicContact CD1-CB 3.98Å; I178-V220 HydrophobicContact CD1-CG1 4.38Å; I178-V220 HydrophobicContact CD1-CG2 4.16Å; I178-F221 HydrophobicContact CD1-CD2 4.13Å; I178-F221 HydrophobicContact CD1-CE2 3.6Å; I178-F221 HydrophobicContact CD1-CZ 4.06Å; I178-F221 HydrophobicContact CG1-CE2 4.25Å; I178-F221 HydrophobicContact CG2-CZ 4.26Å; I178-L486 HydrophobicContact CG2-CD2 3.94Å; I178-R516 PolarHBondContact O-NH1 3.26Å; I178-R516 VanDerWaalsContact O-NH1 3.17Å
179	Q	92.2	Very high	92.1	Very high	13 Å²	13	15.4 Å²	15.4	6%	0.061	8%	0.075	C	C	.	.			trans	-127.6	165.6	177	-61.7	-62.1	-16.9	0	0	110.6	H83 Q176 Q181 T182 V183 S545	H83-Q179 HydrophobicContact CB-CB 4.06Å; Q176-Q179 PolarHBondContact O-NE2 3.13Å; Q179-Q181 VanDerWaalsContact C-N 3.34Å; Q179-Q181 PolarHBondContact O-N 2.83Å; Q179-T182 PolarHBondContact N-OG1 2.79Å; Q179-T182 WeakPolarHBondContact O-CA 3.28Å; Q179-T182 WeakPolarHBondContact O-CB 3.44Å; Q179-T182 PolarHBondContact O-N 2.87Å; Q179-T182 PolarHBondContact O-OG1 2.95Å; Q179-V183 PolarHBondContact O-N 2.8Å; Q179-S545 PolarHBondContact OE1-OG 3.42Å
180	A	86.6	Confident	91.8	Very high	1 Å²	1	21.7 Å²	21.7	1%	0.008	10%	0.102	C	C	.	.	H	α-helix	trans	-56.4	-43.1	-173.4	0	0	0	0	0	113.5	T182 V183 A184 L486 S545 D547	A180-T182 VanDerWaalsContact C-N 3.29Å; A180-T182 PolarHBondContact O-N 2.72Å; A180-V183 PolarHBondContact O-N 3.03Å; A180-V183 VanDerWaalsContact O-N 3.14Å; A180-A184 PolarHBondContact O-N 3.1Å; A180-L486 HydrophobicContact CB-CD1 4.11Å; A180-S545 PolarHBondContact N-OG 3.47Å; A180-D547 HydrophobicContact CB-CB 3.76Å
181	Q	88.4	Confident	91.5	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.009	14%	0.138	C	C	.	.	H	α-helix	trans	-67.2	-26.3	174.5	-76.8	161.2	-5.9	0	0	113.2	H83 G150 Q179 V183 N185 D547	H83-Q181 HydrophobicContact CB-CB 4.35Å; H83-Q181 PolarHBondContact CE1-OE1 2.86Å; H83-Q181 VanDerWaalsContact CE1-OE1 3.27Å; H83-Q181 PolarHBondContact ND1-OE1 3.47Å; G150-Q181 VanDerWaalsContact O-CD 3.3Å; G150-Q181 PolarHBondContact O-OE1 2.9Å; Q179-Q181 VanDerWaalsContact C-N 3.34Å; Q179-Q181 PolarHBondContact O-N 2.83Å; Q181-V183 VanDerWaalsContact C-N 3.33Å; Q181-N185 VanDerWaalsContact O-CB 3.23Å; Q181-N185 WeakPolarHBondContact O-CB 3.2Å; Q181-N185 VanDerWaalsContact O-CG 3.25Å; Q181-N185 PolarHBondContact O-N 3Å; Q181-N185 PolarHBondContact O-ND2 3.41Å; Q181-N185 VanDerWaalsContact O-ND2 3.09Å; Q181-D547 HydrophobicContact CG-CB 4.42Å; Q181-D547 WeakPolarHBondContact CG-OD1 3.5Å
182	T	91.5	Very high	91.1	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-63.7	-42.3	171.1	-45.7	0	0	0	0	110.4	L170 I172 I178 Q179 A180 F186 F221	L170-T182 HydrophobicContact CD1-CG2 3.87Å; L170-T182 HydrophobicContact CG-CG2 4.44Å; I172-T182 HydrophobicContact CD1-CG2 3.79Å; I172-T182 HydrophobicContact CG1-CG2 3.73Å; I178-T182 HydrophobicContact CG2-CG2 4.36Å; Q179-T182 PolarHBondContact N-OG1 2.79Å; Q179-T182 WeakPolarHBondContact O-CA 3.28Å; Q179-T182 WeakPolarHBondContact O-CB 3.44Å; Q179-T182 PolarHBondContact O-N 2.87Å; Q179-T182 PolarHBondContact O-OG1 2.95Å; A180-T182 VanDerWaalsContact C-N 3.29Å; A180-T182 PolarHBondContact O-N 2.72Å; T182-F186 VanDerWaalsContact O-CB 3.28Å; T182-F186 WeakPolarHBondContact O-CB 3.11Å; T182-F186 PolarHBondContact O-N 3.4Å; T182-F221 HydrophobicContact CG2-CE2 4.17Å; T182-F221 HydrophobicContact CG2-CZ 4.13Å
183	V	90.6	Very high	90.9	Very high	3 Å²	3	40 Å²	40	2%	0.018	20%	0.196	C	C	.	.	H	α-helix	trans	-70.7	-45.6	-180	-179.6	0	0	0	0	111.2	I178 Q179 A180 Q181 F186 Y187 V220 F221 L486 M518	I178-V183 HydrophobicContact CG2-CG2 3.58Å; Q179-V183 PolarHBondContact O-N 2.8Å; A180-V183 PolarHBondContact O-N 3.03Å; A180-V183 VanDerWaalsContact O-N 3.14Å; Q181-V183 VanDerWaalsContact C-N 3.33Å; V183-F186 PolarHBondContact O-N 2.89Å; V183-Y187 HydrophobicContact CG1-CD2 3.88Å; V183-Y187 HydrophobicContact CG1-CE2 3.53Å; V183-Y187 VanDerWaalsContact O-CD2 3.23Å; V183-Y187 WeakPolarHBondContact O-CD2 3.3Å; V183-Y187 PolarHBondContact O-N 3.03Å; V183-Y187 VanDerWaalsContact O-N 3.12Å; V183-V220 HydrophobicContact CG2-CG1 4.49Å; V183-F221 HydrophobicContact CG2-CE1 4.27Å; V183-F221 HydrophobicContact CG2-CZ 4.19Å; V183-L486 HydrophobicContact CG2-CD2 4.43Å; V183-M518 HydrophobicContact CG1-CE 4.19Å; V183-M518 HydrophobicContact CG2-CE 4Å
184	A	87.9	Confident	90.8	Very high	13 Å²	13	41.1 Å²	41.1	11%	0.107	20%	0.202	C	C	.	.	H	α-helix	trans	-61.7	-49.2	177.1	0	0	0	0	0	112	A180 F186 Y187 L188 D547	A180-A184 PolarHBondContact O-N 3.1Å; A184-F186 VanDerWaalsContact C-N 3.33Å; A184-F186 PolarHBondContact O-N 2.85Å; A184-Y187 PolarHBondContact O-N 2.99Å; A184-L188 WeakPolarHBondContact O-CG 2.76Å; A184-L188 PolarHBondContact O-N 3.09Å; A184-D547 HydrophobicContact CB-CB 4.46Å
185	N	90.3	Very high	90.9	Very high	10 Å²	10	42.4 Å²	42.4	5%	0.053	21%	0.213	C	C	.	.	H	α-helix	trans	-67.1	-31.6	179.3	-69.4	-34.2	0	0	0	112.8	I81 A82 Q181 A189	I81-N185 HydrophobicContact CB-CB 4.01Å; I81-N185 HydrophobicContact CD1-CB 3.87Å; I81-N185 WeakPolarHBondContact CD1-O 3.38Å; I81-N185 HydrophobicContact CG1-CB 4.24Å; A82-N185 PolarHBondContact O-ND2 3.14Å; Q181-N185 VanDerWaalsContact O-CB 3.23Å; Q181-N185 WeakPolarHBondContact O-CB 3.2Å; Q181-N185 VanDerWaalsContact O-CG 3.25Å; Q181-N185 PolarHBondContact O-N 3Å; Q181-N185 PolarHBondContact O-ND2 3.41Å; Q181-N185 VanDerWaalsContact O-ND2 3.09Å; N185-A189 PolarHBondContact O-N 2.93Å; N185-A189 VanDerWaalsContact O-N 3.12Å
186	F	92.3	Very high	91.1	Very high	11 Å²	11	40.8 Å²	40.8	5%	0.048	20%	0.203	C	C	.	.	H	α-helix	trans	-60.7	-50.8	171	169.4	-94.2	0	0	0	111.3	L170 T182 V183 A184 L188 A189 F190 I196 F221 I223	L170-F186 HydrophobicContact CD2-CB 4.36Å; L170-F186 HydrophobicContact CD2-CD2 4.07Å; T182-F186 VanDerWaalsContact O-CB 3.28Å; T182-F186 WeakPolarHBondContact O-CB 3.11Å; T182-F186 PolarHBondContact O-N 3.4Å; V183-F186 PolarHBondContact O-N 2.89Å; A184-F186 VanDerWaalsContact C-N 3.33Å; A184-F186 PolarHBondContact O-N 2.85Å; F186-L188 VanDerWaalsContact C-N 3.34Å; F186-L188 PolarHBondContact O-N 2.99Å; F186-A189 PolarHBondContact O-N 2.82Å; F186-A189 VanDerWaalsContact O-N 3.15Å; F186-F190 HydrophobicContact CE1-CB 4.46Å; F186-F190 HydrophobicContact CZ-CD2 4.2Å; F186-F190 WeakPolarHBondContact O-CB 3.2Å; F186-F190 PolarHBondContact O-N 3.31Å; F186-I196 HydrophobicContact CD2-CD1 3.6Å; F186-I196 HydrophobicContact CD2-CG2 4.44Å; F186-I196 HydrophobicContact CE2-CD1 3.53Å; F186-I196 HydrophobicContact CZ-CD1 4.44Å; F186-F221 HydrophobicContact CB-CD1 4.12Å; F186-F221 HydrophobicContact CB-CE1 3.64Å; F186-F221 HydrophobicContact CB-CZ 3.91Å; F186-F221 AromaticContact CD1-CD1 3.29Å; F186-F221 HydrophobicContact CD1-CD1 3.29Å; F186-F221 AromaticContact CD1-CE1 3.54Å; F186-F221 HydrophobicContact CD1-CE1 3.54Å; F186-F221 HydrophobicContact CD1-CG 4.17Å; F186-F221 HydrophobicContact CD2-CB 4.2Å; F186-F221 AromaticContact CD2-CD1 3.78Å; F186-F221 HydrophobicContact CD2-CD1 3.78Å; F186-F221 HydrophobicContact CD2-CD2 4.3Å; F186-F221 HydrophobicContact CD2-CE1 4.17Å; F186-F221 AromaticContact CD2-CG 3.85Å; F186-F221 HydrophobicContact CD2-CG 3.85Å; F186-F221 HydrophobicContact CE1-CB 4.24Å; F186-F221 AromaticContact CE1-CD1 3.53Å; F186-F221 HydrophobicContact CE1-CD1 3.53Å; F186-F221 HydrophobicContact CE1-CE1 4.25Å; F186-F221 HydrophobicContact CE1-CG 4.2Å; F186-F221 HydrophobicContact CE2-CB 3.71Å; F186-F221 AromaticContact CE2-CD1 3.99Å; F186-F221 HydrophobicContact CE2-CD1 3.99Å; F186-F221 AromaticContact CE2-CG 3.89Å; F186-F221 HydrophobicContact CE2-CG 3.89Å; F186-F221 AromaticContact CG-CD1 3.43Å; F186-F221 HydrophobicContact CG-CD1 3.43Å; F186-F221 VanDerWaalsContact CG-CD1 3.43Å; F186-F221 AromaticContact CG-CE1 3.5Å; F186-F221 HydrophobicContact CG-CE1 3.5Å; F186-F221 VanDerWaalsContact CG-CE1 3.5Å; F186-F221 AromaticContact CG-CG 4Å; F186-F221 HydrophobicContact CG-CG 4Å; F186-F221 HydrophobicContact CG-CZ 4.11Å; F186-F221 HydrophobicContact CZ-CB 3.73Å; F186-F221 AromaticContact CZ-CD1 3.87Å; F186-F221 HydrophobicContact CZ-CD1 3.87Å; F186-F221 HydrophobicContact CZ-CG 4.06Å; F186-I223 HydrophobicContact CE2-CD1 4.13Å
187	Y	90.3	Very high	91.4	Very high	93 Å²	93	38.1 Å²	38.1	37%	0.365	19%	0.191	S	C	.	.	H	α-helix	trans	-64.2	-37.1	179.7	-73.2	-57.7	0	0	0	112.4	V183 A184 A189 F190 E191	V183-Y187 HydrophobicContact CG1-CD2 3.88Å; V183-Y187 HydrophobicContact CG1-CE2 3.53Å; V183-Y187 VanDerWaalsContact O-CD2 3.23Å; V183-Y187 WeakPolarHBondContact O-CD2 3.3Å; V183-Y187 PolarHBondContact O-N 3.03Å; V183-Y187 VanDerWaalsContact O-N 3.12Å; A184-Y187 PolarHBondContact O-N 2.99Å; Y187-A189 VanDerWaalsContact C-N 3.32Å; Y187-A189 PolarHBondContact O-N 3.21Å; Y187-F190 PolarHBondContact O-N 2.91Å; Y187-E191 WeakPolarHBondContact O-CB 3.25Å; Y187-E191 WeakPolarHBondContact O-CG 3.42Å; Y187-E191 PolarHBondContact O-N 2.95Å
188	L	88.3	Confident	91.6	Very high	55 Å²	55	38.1 Å²	38.1	29%	0.288	19%	0.191	S	C	.	.	H	α-helix	trans	-60.4	-38.2	173	-70.7	173.9	0	0	0	113	L162 A184 F186 A192	L162-L188 HydrophobicContact CD1-CB 3.84Å; A184-L188 WeakPolarHBondContact O-CG 2.76Å; A184-L188 PolarHBondContact O-N 3.09Å; F186-L188 VanDerWaalsContact C-N 3.34Å; F186-L188 PolarHBondContact O-N 2.99Å; L188-A192 WeakPolarHBondContact O-CB 3.19Å; L188-A192 PolarHBondContact O-N 3.49Å
189	A	91.6	Very high	91.8	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-74.4	-35.5	175.7	0	0	0	0	0	113	I81 L162 V168 N185 F186 Y187 A192 Q193 L194 I196	I81-A189 HydrophobicContact CD1-CB 4.28Å; L162-A189 HydrophobicContact CD2-CB 4.07Å; V168-A189 HydrophobicContact CG1-CB 3.78Å; N185-A189 PolarHBondContact O-N 2.93Å; N185-A189 VanDerWaalsContact O-N 3.12Å; F186-A189 PolarHBondContact O-N 2.82Å; F186-A189 VanDerWaalsContact O-N 3.15Å; Y187-A189 VanDerWaalsContact C-N 3.32Å; Y187-A189 PolarHBondContact O-N 3.21Å; A189-A192 CarbonylContact O-C 3.56Å; A189-A192 PolarHBondContact O-N 2.84Å; A189-Q193 PolarHBondContact O-N 3.11Å; A189-L194 PolarHBondContact O-N 2.74Å; A189-L194 VanDerWaalsContact O-N 3.13Å; A189-I196 HydrophobicContact CB-CD1 3.94Å; A189-I196 HydrophobicContact CB-CG1 4.18Å
190	F	91.4	Very high	92.1	Very high	132 Å²	132	37.4 Å²	37.4	58%	0.579	19%	0.188	S	C	*	.	H	α-helix	trans	-69	-44.1	177.6	-175.3	-91.5	0	0	0	112	F186 Y187 A192 Q193 I196	F186-F190 HydrophobicContact CE1-CB 4.46Å; F186-F190 HydrophobicContact CZ-CD2 4.2Å; F186-F190 WeakPolarHBondContact O-CB 3.2Å; F186-F190 PolarHBondContact O-N 3.31Å; Y187-F190 PolarHBondContact O-N 2.91Å; F190-A192 PolarHBondContact O-N 3.23Å; F190-Q193 PolarHBondContact O-N 2.95Å; F190-I196 HydrophobicContact CB-CD1 4.43Å
191	E	89.4	Confident	92.5	Very high	159 Å²	159	37.5 Å²	37.5	74%	0.743	19%	0.188	S	C	*	.	H	α-helix	trans	-61.5	-33.5	171.6	-74.5	-173.3	-178.9	0	0	112.2	Y187 Q193	Y187-E191 WeakPolarHBondContact O-CB 3.25Å; Y187-E191 WeakPolarHBondContact O-CG 3.42Å; Y187-E191 PolarHBondContact O-N 2.95Å; E191-Q193 PolarHBondContact O-N 3.17Å
192	A	88.3	Confident	92.9	Very high	46 Å²	46	39.5 Å²	39.5	38%	0.38	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	1.7	173.4	0	0	0	0	0	114.1	L188 A189 F190 L194	L188-A192 WeakPolarHBondContact O-CB 3.19Å; L188-A192 PolarHBondContact O-N 3.49Å; A189-A192 CarbonylContact O-C 3.56Å; A189-A192 PolarHBondContact O-N 2.84Å; F190-A192 PolarHBondContact O-N 3.23Å; A192-L194 HydrophobicContact CB-CD1 4.26Å; A192-L194 HydrophobicContact CB-CG 3.92Å; A192-L194 PolarHBondContact O-N 2.99Å
193	Q	91.8	Very high	93.1	Very high	181 Å²	181	42.2 Å²	42.2	85%	0.846	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.1	31.8	178.3	-49.9	-168.4	-68	0	0	114.6	A189 F190 E191	A189-Q193 PolarHBondContact O-N 3.11Å; F190-Q193 PolarHBondContact O-N 2.95Å; E191-Q193 PolarHBondContact O-N 3.17Å
194	L	94.4	Very high	93.2	Very high	24 Å²	24	44.2 Å²	44.2	13%	0.126	22%	0.221	C	C	.	.			trans	-83.9	151.1	-178.5	-57.4	-176.8	0	0	0	112.3	L162 C165 A189 A192 I196	L162-L194 HydrophobicContact CB-CD1 4.05Å; L162-L194 HydrophobicContact CD2-CD1 3.47Å; L162-L194 VanDerWaalsContact CD2-CD1 3.47Å; L162-L194 HydrophobicContact CG-CD1 4.37Å; C165-L194 HydrophobicContact CB-CD1 4.45Å; C165-L194 VanDerWaalsContact O-CD2 3.28Å; C165-L194 WeakPolarHBondContact O-CD2 3.16Å; A189-L194 PolarHBondContact O-N 2.74Å; A189-L194 VanDerWaalsContact O-N 3.13Å; A192-L194 HydrophobicContact CB-CD1 4.26Å; A192-L194 HydrophobicContact CB-CG 3.92Å; A192-L194 PolarHBondContact O-N 2.99Å; L194-I196 PolarHBondContact O-N 3.43Å
195	A	95.9	Very high	93.5	Very high	27 Å²	27	46.8 Å²	46.8	22%	0.223	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	115.1	169.7	0	0	0	0	0	110.9	Q166 G167 V168	Q166-A195 PolarHBondContact O-N 2.75Å; Q166-A195 VanDerWaalsContact O-N 3.08Å; G167-A195 CarbonylContact C-O 3.34Å; G167-A195 WeakPolarHBondContact CA-O 3.47Å; V168-A195 PolarHBondContact N-O 3.03Å
196	I	96.3	Very high	93.4	Very high	27 Å²	27	56.3 Å²	56.3	14%	0.138	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	120.4	-176.5	-55.1	-180	0	0	0	109.9	V168 L170 F186 A189 F190 L194 I223	V168-I196 HydrophobicContact CG1-CB 4.21Å; V168-I196 HydrophobicContact CG1-CG1 3.82Å; V168-I196 HydrophobicContact CG1-CG2 4.26Å; L170-I196 HydrophobicContact CB-CG2 3.94Å; L170-I196 HydrophobicContact CD2-CG2 4.06Å; F186-I196 HydrophobicContact CD2-CD1 3.6Å; F186-I196 HydrophobicContact CD2-CG2 4.44Å; F186-I196 HydrophobicContact CE2-CD1 3.53Å; F186-I196 HydrophobicContact CZ-CD1 4.44Å; A189-I196 HydrophobicContact CB-CD1 3.94Å; A189-I196 HydrophobicContact CB-CG1 4.18Å; F190-I196 HydrophobicContact CB-CD1 4.43Å; L194-I196 PolarHBondContact O-N 3.43Å; I196-I223 HydrophobicContact CG2-CD1 4.39Å
197	I	96.8	Very high	93.4	Very high	2 Å²	2	61.7 Å²	61.7	1%	0.01	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	111.8	172.7	-57.7	177.8	0	0	0	108.8	V168 L169 L170 V199 I229 A245 V246 R249 I250	V168-I197 PolarHBondContact O-N 2.99Å; L169-I197 HydrophobicContact CD2-CB 3.85Å; L169-I197 HydrophobicContact CD2-CD1 4.07Å; L169-I197 HydrophobicContact CD2-CG1 4.45Å; L169-I197 HydrophobicContact CD2-CG2 4.16Å; L170-I197 PolarHBondContact N-O 3.03Å; I197-V199 HydrophobicContact CG2-CG2 4.13Å; I197-I229 HydrophobicContact CG2-CD1 3.61Å; I197-I229 HydrophobicContact CG2-CG1 4.24Å; I197-A245 HydrophobicContact CD1-CB 4.11Å; I197-A245 WeakPolarHBondContact CD1-O 3.23Å; I197-V246 HydrophobicContact CD1-CG2 4.45Å; I197-R249 HydrophobicContact CD1-CB 4.18Å; I197-R249 HydrophobicContact CG1-CB 4.47Å; I197-I250 HydrophobicContact CD1-CD1 4.06Å; I197-I250 HydrophobicContact CD1-CG1 3.77Å; I197-I250 HydrophobicContact CG1-CG1 4.47Å
198	P	96.6	Very high	93.5	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	125.7	173.8	26.7	-31.1	0	0	0	111.7	I217 I223 C228 I229	P198-I217 HydrophobicContact CB-CD1 4.3Å; P198-I217 HydrophobicContact CB-CG2 4.37Å; P198-I223 HydrophobicContact CG-CD1 4.4Å; P198-I223 HydrophobicContact CG-CG2 4.02Å; P198-C228 HydrophobicContact CG-CB 4.48Å; P198-I229 PolarHBondContact O-N 2.76Å
199	V	97.3	Very high	93.7	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	112.6	-177.7	179.7	0	0	0	0	109.9	L91 L169 L170 I171 I172 I197 I231 V242	L91-V199 HydrophobicContact CD2-CG1 4.4Å; L169-V199 HydrophobicContact CB-CG2 4.38Å; L169-V199 HydrophobicContact CD2-CG2 4.23Å; L170-V199 PolarHBondContact O-N 2.81Å; I171-V199 WeakPolarHBondContact CA-O 3.47Å; I171-V199 HydrophobicContact CG1-CB 4.4Å; I172-V199 PolarHBondContact N-O 3.45Å; I197-V199 HydrophobicContact CG2-CG2 4.13Å; V199-I231 HydrophobicContact CG1-CD1 3.39Å; V199-I231 HydrophobicContact CG1-CG1 3.68Å; V199-I231 HydrophobicContact CG1-CG2 4.41Å; V199-V242 HydrophobicContact CG1-CG2 4.27Å; V199-V242 HydrophobicContact CG2-CG1 4.38Å; V199-V242 HydrophobicContact CG2-CG2 4.46Å
200	I	97.3	Very high	93.9	Very high	0 Å²	0	60 Å²	60	0%	0	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	104.4	-177.2	-61.2	177.3	0	0	0	109.1	I172 A174 P210 V213 E214 I217 C228 I229 R230 I231	I172-I200 CarbonylContact O-C 3.6Å; I172-I200 WeakPolarHBondContact O-CA 3.46Å; A174-I200 HydrophobicContact CB-CG2 3.73Å; I200-P210 HydrophobicContact CG2-CB 4.18Å; I200-V213 HydrophobicContact CD1-CB 4.36Å; I200-V213 HydrophobicContact CD1-CG1 3.96Å; I200-V213 HydrophobicContact CG1-CG1 4.1Å; I200-V213 HydrophobicContact CG2-CG1 4.41Å; I200-E214 HydrophobicContact CD1-CG 3.47Å; I200-E214 VanDerWaalsContact CD1-CG 3.47Å; I200-I217 HydrophobicContact CD1-CD1 3.9Å; I200-I217 HydrophobicContact CG1-CD1 4.03Å; I200-C228 HydrophobicContact CD1-CB 3.88Å; I200-C228 HydrophobicContact CG1-CB 4.47Å; I200-I229 PolarHBondContact N-O 2.83Å; I200-R230 CarbonylContact O-C 3.53Å; I200-I231 PolarHBondContact O-N 2.91Å
201	N	96.8	Very high	94	Very high	3 Å²	3	59.3 Å²	59.3	2%	0.016	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	167.4	-171.7	-169.3	22.7	0	0	0	112.9	H86 I171 I172 A174 I231 A233	H86-N201 PolarHBondContact O-ND2 2.8Å; I171-N201 HydrophobicContact CG2-CB 3.67Å; I172-N201 PolarHBondContact O-N 2.71Å; A174-N201 VanDerWaalsContact CB-O 3.32Å; A174-N201 WeakPolarHBondContact CB-O 3.38Å; A174-N201 PolarHBondContact N-O 3.24Å; N201-I231 CarbonylContact C-O 3.51Å; N201-I231 WeakPolarHBondContact CA-O 3.44Å; N201-I231 HydrophobicContact CB-CD1 4.45Å; N201-I231 HydrophobicContact CB-CG1 4.12Å; N201-A233 WeakPolarHBondContact OD1-CB 3.38Å; N201-A233 PolarHBondContact OD1-N 3.3Å
202	K	95.6	Very high	94.2	Very high	44 Å²	44	54.2 Å²	54.2	19%	0.191	28%	0.278	C	S	.	.			trans	63.9	32.9	179.1	-47.3	-170.9	-165.6	166.3	0	115.2	D85 D173 D204 L205 I231	D85-K202 WeakPolarHBondContact O-CE 3.46Å; D85-K202 PolarHBondContact O-NZ 2.95Å; D173-K202 WeakPolarHBondContact OD2-CD 3.12Å; D173-K202 VanDerWaalsContact OD2-CE 3.22Å; D173-K202 WeakPolarHBondContact OD2-CE 3.25Å; D173-K202 IonicContact OD2-NZ 2.64Å; D173-K202 PolarHBondContact OD2-NZ 3.17Å; K202-D204 PolarHBondContact O-N 3.39Å; K202-L205 HydrophobicContact CB-CD1 3.84Å; K202-L205 HydrophobicContact CB-CG 4.08Å; K202-L205 HydrophobicContact CD-CD1 3.91Å; K202-L205 PolarHBondContact O-N 3.15Å; K202-I231 PolarHBondContact N-O 3.16Å
203	I	95.2	Very high	94.4	Very high	56 Å²	56	52 Å²	52	29%	0.287	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-5.8	172	73.2	-175.4	0	0	0	113.8	A174 L205 P210 R230 I231	A174-I203 HydrophobicContact CB-CG2 4.28Å; I203-L205 VanDerWaalsContact C-N 3.31Å; I203-P210 HydrophobicContact CG2-CG 4.07Å; I203-R230 HydrophobicContact CD1-CB 4.39Å; I203-R230 HydrophobicContact CG2-CB 4.35Å; I203-I231 WeakPolarHBondContact CG1-O 3.4Å; I203-I231 PolarHBondContact N-O 2.81Å
204	D	93.6	Very high	94.6	Very high	45 Å²	45	44 Å²	44	24%	0.241	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-7.5	171.2	65.5	-73.9	0	0	0	114.5	K202 S232 K234 L235	K202-D204 PolarHBondContact O-N 3.39Å; D204-S232 WeakPolarHBondContact OD1-CB 3.39Å; D204-S232 PolarHBondContact OD1-OG 3.07Å; D204-K234 WeakPolarHBondContact OD2-CD 3.39Å; D204-K234 IonicContact OD2-NZ 3.91Å; D204-K234 PolarHBondContact OD2-NZ 3.18Å; D204-L235 HydrophobicContact CB-CD1 3.61Å; D204-L235 HydrophobicContact CB-CG 4.02Å
205	L	93.2	Very high	94.5	Very high	67 Å²	67	44.8 Å²	44.8	35%	0.351	23%	0.23	S	C	.	.	S	Bend	trans	-79.9	136.1	176.2	-62.4	178.1	0	0	0	111.1	N175 K202 I203 N207 A208	N175-L205 HydrophobicContact CB-CD1 4.13Å; K202-L205 HydrophobicContact CB-CD1 3.84Å; K202-L205 HydrophobicContact CB-CG 4.08Å; K202-L205 HydrophobicContact CD-CD1 3.91Å; K202-L205 PolarHBondContact O-N 3.15Å; I203-L205 VanDerWaalsContact C-N 3.31Å; L205-N207 PolarHBondContact O-N 2.79Å; L205-A208 HydrophobicContact CB-CB 4.27Å; L205-A208 WeakPolarHBondContact O-CB 3.3Å; L205-A208 PolarHBondContact O-N 2.87Å
206	K	90.1	Very high	94.3	Very high	211 Å²	211	43.6 Å²	43.6	92%	0.917	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-19.7	178	-65.3	-172	177.1	-174	0	114.9
207	N	90.9	Very high	94.2	Very high	123 Å²	123	42.3 Å²	42.3	66%	0.658	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110.2	13.5	-179.9	-58.8	18.6	0	0	0	111.5	N175 L205	N175-N207 WeakPolarHBondContact OD1-CB 3.33Å; N175-N207 PolarHBondContact OD1-O 2.91Å; L205-N207 PolarHBondContact O-N 2.79Å
208	A	92.7	Very high	94.1	Very high	27 Å²	27	45.6 Å²	45.6	22%	0.223	23%	0.228	C	C	.	.			trans	-66.5	134.8	172.6	0	0	0	0	0	110.1	A174 L205	A174-A208 HydrophobicContact CB-CB 3.72Å; L205-A208 HydrophobicContact CB-CB 4.27Å; L205-A208 WeakPolarHBondContact O-CB 3.3Å; L205-A208 PolarHBondContact O-N 2.87Å
209	D	93.4	Very high	93.8	Very high	63 Å²	63	51.6 Å²	51.6	34%	0.337	25%	0.254	S	S	.	.			trans	-136	77.4	-177	173.9	7.6	0	0	0	108.8	A174 E211 R212 V213	A174-D209 CarbonylContact O-C 3.55Å; A174-D209 PolarHBondContact O-N 3.45Å; D209-E211 VanDerWaalsContact C-N 3.31Å; D209-E211 PolarHBondContact O-N 3.25Å; D209-R212 VanDerWaalsContact OD1-CB 3.25Å; D209-R212 WeakPolarHBondContact OD1-CB 3.21Å; D209-R212 PolarHBondContact OD1-N 3.22Å; D209-R212 VanDerWaalsContact OD1-N 3.15Å; D209-R212 WeakPolarHBondContact OD2-CB 3.32Å; D209-R212 WeakPolarHBondContact OD2-CD 3.43Å; D209-R212 IonicContact OD2-CZ 2.72Å; D209-R212 IonicContact OD2-NE 3.79Å; D209-R212 PolarHBondContact OD2-NE 2.97Å; D209-R212 IonicContact OD2-NH2 3.93Å; D209-V213 WeakPolarHBondContact O-CG2 3.09Å; D209-V213 PolarHBondContact O-N 3.28Å
210	P	94.4	Very high	93.5	Very high	22 Å²	22	52.9 Å²	52.9	14%	0.143	26%	0.262	C	S	.	.	H	α-helix	trans	-64.1	-34.7	-175.6	-22.2	34.9	0	0	0	112.9	A174 I200 I203 V213 E214 R230	A174-P210 HydrophobicContact CB-CG 4.34Å; I200-P210 HydrophobicContact CG2-CB 4.18Å; I203-P210 HydrophobicContact CG2-CG 4.07Å; P210-V213 CarbonylContact O-C 3.55Å; P210-V213 WeakPolarHBondContact O-CA 3.44Å; P210-V213 PolarHBondContact O-N 3.18Å; P210-E214 WeakPolarHBondContact O-CG 3.39Å; P210-E214 PolarHBondContact O-N 2.95Å; P210-R230 HydrophobicContact CB-CG 4.23Å
211	E	93.8	Very high	93.2	Very high	118 Å²	118	53.6 Å²	53.6	55%	0.551	27%	0.265	S	S	*	.	H	α-helix	trans	-72	-36.9	-172.4	-72	167.9	-164.3	0	0	112.2	D209 V213 S215 R230	D209-E211 VanDerWaalsContact C-N 3.31Å; D209-E211 PolarHBondContact O-N 3.25Å; E211-V213 VanDerWaalsContact C-N 3.34Å; E211-S215 WeakPolarHBondContact O-CB 3.47Å; E211-S215 PolarHBondContact O-N 3.03Å; E211-S215 VanDerWaalsContact O-N 3.09Å; E211-S215 PolarHBondContact O-OG 2.81Å; E211-R230 IonicContact OE1-NH1 3.84Å; E211-R230 PolarHBondContact OE1-NH1 3.3Å; E211-R230 IonicContact OE1-NH2 2.68Å
212	R	93.3	Very high	93	Very high	52 Å²	52	60.7 Å²	60.7	20%	0.196	30%	0.303	C	S	.	.	H	α-helix	trans	-65.4	-38.3	166.7	-175.7	-175.1	50.5	64.4	18.9	111.2	D209 S215 Q216	D209-R212 VanDerWaalsContact OD1-CB 3.25Å; D209-R212 WeakPolarHBondContact OD1-CB 3.21Å; D209-R212 PolarHBondContact OD1-N 3.22Å; D209-R212 VanDerWaalsContact OD1-N 3.15Å; D209-R212 WeakPolarHBondContact OD2-CB 3.32Å; D209-R212 WeakPolarHBondContact OD2-CD 3.43Å; D209-R212 IonicContact OD2-CZ 2.72Å; D209-R212 IonicContact OD2-NE 3.79Å; D209-R212 PolarHBondContact OD2-NE 2.97Å; D209-R212 IonicContact OD2-NH2 3.93Å; R212-S215 CarbonylContact O-C 3.59Å; R212-S215 WeakPolarHBondContact O-CB 3.41Å; R212-S215 PolarHBondContact O-N 3.03Å; R212-Q216 WeakPolarHBondContact O-CG 3.4Å; R212-Q216 PolarHBondContact O-N 2.83Å
213	V	94.1	Very high	92.8	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-69.3	-37.8	-179.6	174.4	0	0	0	0	112.1	I172 I200 D209 P210 E211 S215 Q216 I217	I172-V213 HydrophobicContact CB-CG1 4.28Å; I172-V213 HydrophobicContact CG2-CG1 3.55Å; I200-V213 HydrophobicContact CD1-CB 4.36Å; I200-V213 HydrophobicContact CD1-CG1 3.96Å; I200-V213 HydrophobicContact CG1-CG1 4.1Å; I200-V213 HydrophobicContact CG2-CG1 4.41Å; D209-V213 WeakPolarHBondContact O-CG2 3.09Å; D209-V213 PolarHBondContact O-N 3.28Å; P210-V213 CarbonylContact O-C 3.55Å; P210-V213 WeakPolarHBondContact O-CA 3.44Å; P210-V213 PolarHBondContact O-N 3.18Å; E211-V213 VanDerWaalsContact C-N 3.34Å; V213-S215 VanDerWaalsContact C-N 3.34Å; V213-Q216 WeakPolarHBondContact O-CB 3.23Å; V213-Q216 PolarHBondContact O-N 3.1Å; V213-Q216 VanDerWaalsContact O-N 3.17Å; V213-I217 HydrophobicContact CG1-CD1 4Å; V213-I217 WeakPolarHBondContact O-CD1 3.18Å; V213-I217 VanDerWaalsContact O-CG1 3.28Å; V213-I217 WeakPolarHBondContact O-CG1 3.45Å; V213-I217 PolarHBondContact O-N 2.99Å
214	E	94.9	Very high	92.8	Very high	14 Å²	14	59.5 Å²	59.5	7%	0.065	30%	0.302	C	S	.	.	H	α-helix	trans	-59.8	-44.7	168.8	-72.3	160.2	-171.8	0	0	111.1	I200 P210 Q216 I217 E218 R225 C228 R230	I200-E214 HydrophobicContact CD1-CG 3.47Å; I200-E214 VanDerWaalsContact CD1-CG 3.47Å; P210-E214 WeakPolarHBondContact O-CG 3.39Å; P210-E214 PolarHBondContact O-N 2.95Å; E214-Q216 VanDerWaalsContact C-N 3.26Å; E214-Q216 PolarHBondContact O-N 3.04Å; E214-I217 PolarHBondContact O-N 3.21Å; E214-I217 VanDerWaalsContact O-N 3.14Å; E214-E218 WeakPolarHBondContact O-CB 3.36Å; E214-E218 PolarHBondContact O-N 2.93Å; E214-R225 HydrophobicContact CB-CB 4.34Å; E214-R225 HydrophobicContact CB-CG 4.22Å; E214-C228 HydrophobicContact CG-CB 3.88Å; E214-R230 IonicContact OE1-CZ 3.12Å; E214-R230 VanDerWaalsContact OE1-CZ 3.24Å; E214-R230 IonicContact OE1-NE 3.14Å; E214-R230 PolarHBondContact OE1-NE 3.49Å; E214-R230 IonicContact OE1-NH2 3.31Å; E214-R230 PolarHBondContact OE1-NH2 3.43Å; E214-R230 IonicContact OE2-CZ 2.67Å; E214-R230 IonicContact OE2-NE 3.04Å; E214-R230 IonicContact OE2-NH2 3.9Å; E214-R230 PolarHBondContact OE2-NH2 3.43Å
215	S	93.2	Very high	92.7	Very high	40 Å²	40	61.5 Å²	61.5	28%	0.28	31%	0.307	S	S	.	.	H	α-helix	trans	-62.5	-30.8	174.8	-50.6	0	0	0	0	113.1	E211 R212 V213 K219 R225	E211-S215 WeakPolarHBondContact O-CB 3.47Å; E211-S215 PolarHBondContact O-N 3.03Å; E211-S215 VanDerWaalsContact O-N 3.09Å; E211-S215 PolarHBondContact O-OG 2.81Å; R212-S215 CarbonylContact O-C 3.59Å; R212-S215 WeakPolarHBondContact O-CB 3.41Å; R212-S215 PolarHBondContact O-N 3.03Å; V213-S215 VanDerWaalsContact C-N 3.34Å; S215-K219 WeakPolarHBondContact O-CB 3.48Å; S215-K219 PolarHBondContact O-N 2.87Å; S215-R225 PolarHBondContact OG-NH1 3.07Å; S215-R225 PolarHBondContact OG-NH2 2.83Å; S215-R225 VanDerWaalsContact OG-NH2 3.16Å
216	Q	91.8	Very high	92.6	Very high	1 Å²	1	65.8 Å²	65.8	1%	0.005	33%	0.325	C	S	.	.	H	α-helix	trans	-72.4	-41.8	172.2	-70	-177.9	-23.6	0	0	111.7	I178 R212 V213 E214 K219 V220 I512 D513	I178-Q216 HydrophobicContact CD1-CB 3.73Å; I178-Q216 WeakPolarHBondContact CD1-O 3.46Å; I178-Q216 HydrophobicContact CG1-CB 3.97Å; R212-Q216 WeakPolarHBondContact O-CG 3.4Å; R212-Q216 PolarHBondContact O-N 2.83Å; V213-Q216 WeakPolarHBondContact O-CB 3.23Å; V213-Q216 PolarHBondContact O-N 3.1Å; V213-Q216 VanDerWaalsContact O-N 3.17Å; E214-Q216 VanDerWaalsContact C-N 3.26Å; E214-Q216 PolarHBondContact O-N 3.04Å; Q216-K219 PolarHBondContact O-N 3.25Å; Q216-V220 VanDerWaalsContact O-CB 3.31Å; Q216-V220 WeakPolarHBondContact O-CB 3.45Å; Q216-V220 VanDerWaalsContact O-CG2 3.26Å; Q216-V220 WeakPolarHBondContact O-CG2 3.12Å; Q216-V220 PolarHBondContact O-N 3.37Å; Q216-I512 HydrophobicContact CB-CG2 4.2Å; Q216-I512 HydrophobicContact CG-CG2 3.85Å; Q216-D513 PolarHBondContact NE2-OD2 2.53Å
217	I	93.8	Very high	92.7	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-63.7	-51.2	-179.4	-71.5	160.7	0	0	0	110.2	I172 I178 P198 I200 V213 E214 K219 V220 F221 I223	I172-I217 HydrophobicContact CD1-CD1 3.71Å; I172-I217 HydrophobicContact CD1-CG1 3.63Å; I178-I217 HydrophobicContact CD1-CG1 4.38Å; P198-I217 HydrophobicContact CB-CD1 4.3Å; P198-I217 HydrophobicContact CB-CG2 4.37Å; I200-I217 HydrophobicContact CD1-CD1 3.9Å; I200-I217 HydrophobicContact CG1-CD1 4.03Å; V213-I217 HydrophobicContact CG1-CD1 4Å; V213-I217 WeakPolarHBondContact O-CD1 3.18Å; V213-I217 VanDerWaalsContact O-CG1 3.28Å; V213-I217 WeakPolarHBondContact O-CG1 3.45Å; V213-I217 PolarHBondContact O-N 2.99Å; E214-I217 PolarHBondContact O-N 3.21Å; E214-I217 VanDerWaalsContact O-N 3.14Å; I217-K219 PolarHBondContact O-N 2.8Å; I217-V220 PolarHBondContact O-N 2.79Å; I217-F221 HydrophobicContact CG2-CD2 4.35Å; I217-F221 WeakPolarHBondContact O-CA 3.4Å; I217-F221 WeakPolarHBondContact O-CB 3.4Å; I217-F221 PolarHBondContact O-N 3.3Å; I217-I223 HydrophobicContact CG2-CB 3.97Å; I217-I223 HydrophobicContact CG2-CD1 4.33Å
218	E	93.6	Very high	92.8	Very high	72 Å²	72	54 Å²	54	34%	0.336	27%	0.271	S	S	.	.	H	α-helix	trans	-52.3	-52.7	174.9	-179.6	-173	-109.3	0	0	111	E214 V220 D222 I223 R225	E214-E218 WeakPolarHBondContact O-CB 3.36Å; E214-E218 PolarHBondContact O-N 2.93Å; E218-V220 PolarHBondContact O-N 2.97Å; E218-D222 VanDerWaalsContact O-CA 3.27Å; E218-D222 WeakPolarHBondContact O-CA 3.39Å; E218-D222 PolarHBondContact O-N 2.62Å; E218-I223 WeakPolarHBondContact CA-O 3.4Å; E218-R225 HydrophobicContact CB-CG 4.46Å; E218-R225 VanDerWaalsContact CD-NE 3.28Å; E218-R225 WeakPolarHBondContact OE1-CG 3.49Å; E218-R225 IonicContact OE1-CZ 3.18Å; E218-R225 IonicContact OE1-NE 2.86Å; E218-R225 PolarHBondContact OE1-NE 2.8Å; E218-R225 IonicContact OE1-NH2 2.86Å; E218-R225 IonicContact OE2-CZ 3.03Å; E218-R225 VanDerWaalsContact OE2-CZ 3.31Å; E218-R225 IonicContact OE2-NE 3.25Å; E218-R225 PolarHBondContact OE2-NE 3.22Å; E218-R225 VanDerWaalsContact OE2-NE 3.14Å; E218-R225 IonicContact OE2-NH2 3.79Å; E218-R225 PolarHBondContact OE2-NH2 3.47Å
219	K	90.6	Very high	93	Very high	125 Å²	125	53.4 Å²	53.4	54%	0.543	26%	0.263	S	S	.	.	H	α-helix	trans	-74.8	-21.4	-174.4	-177	173.2	161	-152.9	0	115.4	S215 Q216 I217 Y511 I512	S215-K219 WeakPolarHBondContact O-CB 3.48Å; S215-K219 PolarHBondContact O-N 2.87Å; Q216-K219 PolarHBondContact O-N 3.25Å; I217-K219 PolarHBondContact O-N 2.8Å; K219-Y511 WeakPolarHBondContact CE-O 3.17Å; K219-Y511 PolarHBondContact NZ-O 2.69Å; K219-I512 VanDerWaalsContact CD-O 3.32Å; K219-I512 WeakPolarHBondContact CD-O 3.42Å; K219-I512 VanDerWaalsContact CE-O 3.31Å; K219-I512 WeakPolarHBondContact CE-O 3.35Å; K219-I512 PolarHBondContact NZ-O 3.03Å
220	V	90.3	Very high	93.1	Very high	27 Å²	27	54.7 Å²	54.7	16%	0.164	26%	0.263	C	S	.	.	H	α-helix	trans	-105.2	-30.1	-177.2	-179.1	0	0	0	0	112.7	I178 V183 Q216 I217 E218 I512 M518	I178-V220 HydrophobicContact CD1-CB 3.98Å; I178-V220 HydrophobicContact CD1-CG1 4.38Å; I178-V220 HydrophobicContact CD1-CG2 4.16Å; V183-V220 HydrophobicContact CG2-CG1 4.49Å; Q216-V220 VanDerWaalsContact O-CB 3.31Å; Q216-V220 WeakPolarHBondContact O-CB 3.45Å; Q216-V220 VanDerWaalsContact O-CG2 3.26Å; Q216-V220 WeakPolarHBondContact O-CG2 3.12Å; Q216-V220 PolarHBondContact O-N 3.37Å; I217-V220 PolarHBondContact O-N 2.79Å; E218-V220 PolarHBondContact O-N 2.97Å; V220-I512 HydrophobicContact CG2-CB 4.32Å; V220-I512 HydrophobicContact CG2-CG1 4Å; V220-I512 HydrophobicContact CG2-CG2 3.81Å; V220-M518 HydrophobicContact CG1-CE 4.2Å
221	F	92.2	Very high	93.2	Very high	15 Å²	15	53.6 Å²	53.6	7%	0.066	26%	0.257	C	S	.	.	H	α-helix	trans	-119.3	-5.2	-173.6	-56.7	-41.4	0	0	0	114.2	L170 I172 I178 T182 V183 F186 I217 I223	L170-F221 HydrophobicContact CD2-CD2 4.3Å; L170-F221 HydrophobicContact CD2-CE2 4.04Å; I172-F221 HydrophobicContact CD1-CE2 4.29Å; I178-F221 HydrophobicContact CD1-CD2 4.13Å; I178-F221 HydrophobicContact CD1-CE2 3.6Å; I178-F221 HydrophobicContact CD1-CZ 4.06Å; I178-F221 HydrophobicContact CG1-CE2 4.25Å; I178-F221 HydrophobicContact CG2-CZ 4.26Å; T182-F221 HydrophobicContact CG2-CE2 4.17Å; T182-F221 HydrophobicContact CG2-CZ 4.13Å; V183-F221 HydrophobicContact CG2-CE1 4.27Å; V183-F221 HydrophobicContact CG2-CZ 4.19Å; F186-F221 HydrophobicContact CB-CD1 4.12Å; F186-F221 HydrophobicContact CB-CE1 3.64Å; F186-F221 HydrophobicContact CB-CZ 3.91Å; F186-F221 AromaticContact CD1-CD1 3.29Å; F186-F221 HydrophobicContact CD1-CD1 3.29Å; F186-F221 AromaticContact CD1-CE1 3.54Å; F186-F221 HydrophobicContact CD1-CE1 3.54Å; F186-F221 HydrophobicContact CD1-CG 4.17Å; F186-F221 HydrophobicContact CD2-CB 4.2Å; F186-F221 AromaticContact CD2-CD1 3.78Å; F186-F221 HydrophobicContact CD2-CD1 3.78Å; F186-F221 HydrophobicContact CD2-CD2 4.3Å; F186-F221 HydrophobicContact CD2-CE1 4.17Å; F186-F221 AromaticContact CD2-CG 3.85Å; F186-F221 HydrophobicContact CD2-CG 3.85Å; F186-F221 HydrophobicContact CE1-CB 4.24Å; F186-F221 AromaticContact CE1-CD1 3.53Å; F186-F221 HydrophobicContact CE1-CD1 3.53Å; F186-F221 HydrophobicContact CE1-CE1 4.25Å; F186-F221 HydrophobicContact CE1-CG 4.2Å; F186-F221 HydrophobicContact CE2-CB 3.71Å; F186-F221 AromaticContact CE2-CD1 3.99Å; F186-F221 HydrophobicContact CE2-CD1 3.99Å; F186-F221 AromaticContact CE2-CG 3.89Å; F186-F221 HydrophobicContact CE2-CG 3.89Å; F186-F221 AromaticContact CG-CD1 3.43Å; F186-F221 HydrophobicContact CG-CD1 3.43Å; F186-F221 VanDerWaalsContact CG-CD1 3.43Å; F186-F221 AromaticContact CG-CE1 3.5Å; F186-F221 HydrophobicContact CG-CE1 3.5Å; F186-F221 VanDerWaalsContact CG-CE1 3.5Å; F186-F221 AromaticContact CG-CG 4Å; F186-F221 HydrophobicContact CG-CG 4Å; F186-F221 HydrophobicContact CG-CZ 4.11Å; F186-F221 HydrophobicContact CZ-CB 3.73Å; F186-F221 AromaticContact CZ-CD1 3.87Å; F186-F221 HydrophobicContact CZ-CD1 3.87Å; F186-F221 HydrophobicContact CZ-CG 4.06Å; I217-F221 HydrophobicContact CG2-CD2 4.35Å; I217-F221 WeakPolarHBondContact O-CA 3.4Å; I217-F221 WeakPolarHBondContact O-CB 3.4Å; I217-F221 PolarHBondContact O-N 3.3Å; F221-I223 HydrophobicContact CB-CD1 4.02Å; F221-I223 HydrophobicContact CB-CG1 3.99Å; F221-I223 PolarHBondContact O-N 2.98Å
222	D	92.1	Very high	93.3	Very high	152 Å²	152	48 Å²	48	81%	0.813	23%	0.23	S	C	*	.			trans	59.9	27.5	-178.8	-149	31.2	0	0	0	113.7	E218	E218-D222 VanDerWaalsContact O-CA 3.27Å; E218-D222 WeakPolarHBondContact O-CA 3.39Å; E218-D222 PolarHBondContact O-N 2.62Å
223	I	92.6	Very high	93.3	Very high	19 Å²	19	45.5 Å²	45.5	10%	0.097	22%	0.221	C	C	.	.			trans	-97	129	176.9	-49.6	172.1	0	0	0	109.8	F186 I196 P198 I217 E218 F221 E227	F186-I223 HydrophobicContact CE2-CD1 4.13Å; I196-I223 HydrophobicContact CG2-CD1 4.39Å; P198-I223 HydrophobicContact CG-CD1 4.4Å; P198-I223 HydrophobicContact CG-CG2 4.02Å; I217-I223 HydrophobicContact CG2-CB 3.97Å; I217-I223 HydrophobicContact CG2-CD1 4.33Å; E218-I223 WeakPolarHBondContact CA-O 3.4Å; F221-I223 HydrophobicContact CB-CD1 4.02Å; F221-I223 HydrophobicContact CB-CG1 3.99Å; F221-I223 PolarHBondContact O-N 2.98Å; I223-E227 HydrophobicContact CG2-CB 4.04Å
224	P	93.5	Very high	93.1	Very high	56 Å²	56	51.5 Å²	51.5	36%	0.364	25%	0.247	S	C	.	.			trans	-56.7	148.8	176.3	-25.7	34.3	0	0	0	114.3	E226 E227	P224-E226 VanDerWaalsContact C-N 3.27Å; P224-E226 WeakPolarHBondContact CB-OE2 3.37Å; P224-E226 PolarHBondContact O-N 2.8Å; P224-E227 HydrophobicContact CB-CG 4.39Å; P224-E227 WeakPolarHBondContact CD-OE1 3.37Å; P224-E227 PolarHBondContact O-N 3.37Å
225	R	92.8	Very high	92.8	Very high	87 Å²	87	56.3 Å²	56.3	33%	0.328	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-64.6	-35.2	-178.9	-57.8	176.7	-179.1	-122	-7.5	111.7	E214 S215 E218 E227 C228	E214-R225 HydrophobicContact CB-CB 4.34Å; E214-R225 HydrophobicContact CB-CG 4.22Å; S215-R225 PolarHBondContact OG-NH1 3.07Å; S215-R225 PolarHBondContact OG-NH2 2.83Å; S215-R225 VanDerWaalsContact OG-NH2 3.16Å; E218-R225 HydrophobicContact CB-CG 4.46Å; E218-R225 VanDerWaalsContact CD-NE 3.28Å; E218-R225 WeakPolarHBondContact OE1-CG 3.49Å; E218-R225 IonicContact OE1-CZ 3.18Å; E218-R225 IonicContact OE1-NE 2.86Å; E218-R225 PolarHBondContact OE1-NE 2.8Å; E218-R225 IonicContact OE1-NH2 2.86Å; E218-R225 IonicContact OE2-CZ 3.03Å; E218-R225 VanDerWaalsContact OE2-CZ 3.31Å; E218-R225 IonicContact OE2-NE 3.25Å; E218-R225 PolarHBondContact OE2-NE 3.22Å; E218-R225 VanDerWaalsContact OE2-NE 3.14Å; E218-R225 IonicContact OE2-NH2 3.79Å; E218-R225 PolarHBondContact OE2-NH2 3.47Å; R225-E227 PolarHBondContact O-N 2.93Å; R225-C228 VanDerWaalsContact O-CB 3.3Å; R225-C228 WeakPolarHBondContact O-CB 3.3Å; R225-C228 PolarHBondContact O-N 3.06Å
226	E	90.2	Very high	92.6	Very high	157 Å²	157	55.7 Å²	55.7	73%	0.734	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-62.5	-21.9	179.4	-62.7	72.9	-162.9	0	0	112.6	P224	P224-E226 VanDerWaalsContact C-N 3.27Å; P224-E226 WeakPolarHBondContact CB-OE2 3.37Å; P224-E226 PolarHBondContact O-N 2.8Å
227	E	91.7	Very high	92.6	Very high	74 Å²	74	59 Å²	59	35%	0.346	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-81.8	-16	176.2	-65.8	-167.6	-138.2	0	0	113.2	I223 P224 R225 I229 R249	I223-E227 HydrophobicContact CG2-CB 4.04Å; P224-E227 HydrophobicContact CB-CG 4.39Å; P224-E227 WeakPolarHBondContact CD-OE1 3.37Å; P224-E227 PolarHBondContact O-N 3.37Å; R225-E227 PolarHBondContact O-N 2.93Å; E227-I229 PolarHBondContact O-N 2.88Å; E227-R249 PolarHBondContact O-NH1 3.02Å
228	C	94.6	Very high	92.6	Very high	14 Å²	14	62.9 Å²	62.9	10%	0.095	31%	0.313	C	S	.	.			trans	-76.5	120.1	-174.5	-66.1	0	0	0	0	113.2	P198 I200 E214 R225 R230	P198-C228 HydrophobicContact CG-CB 4.48Å; I200-C228 HydrophobicContact CD1-CB 3.88Å; I200-C228 HydrophobicContact CG1-CB 4.47Å; E214-C228 HydrophobicContact CG-CB 3.88Å; R225-C228 VanDerWaalsContact O-CB 3.3Å; R225-C228 WeakPolarHBondContact O-CB 3.3Å; R225-C228 PolarHBondContact O-N 3.06Å; C228-R230 PolarHBondContact O-N 2.88Å
229	I	96.1	Very high	92.6	Very high	13 Å²	13	59.4 Å²	59.4	7%	0.067	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	105.9	-177.5	-46.4	-179.5	0	0	0	110.4	I197 P198 I200 E227 I231 A241 V242 A245	I197-I229 HydrophobicContact CG2-CD1 3.61Å; I197-I229 HydrophobicContact CG2-CG1 4.24Å; P198-I229 PolarHBondContact O-N 2.76Å; I200-I229 PolarHBondContact N-O 2.83Å; E227-I229 PolarHBondContact O-N 2.88Å; I229-I231 HydrophobicContact CG2-CG2 3.9Å; I229-A241 HydrophobicContact CG2-CB 4.04Å; I229-V242 HydrophobicContact CG2-CG2 3.97Å; I229-A245 HydrophobicContact CD1-CB 3.42Å; I229-A245 VanDerWaalsContact CD1-CB 3.42Å
230	R	96.6	Very high	92.7	Very high	90 Å²	90	58.4 Å²	58.4	34%	0.34	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	121	174.9	-59.3	-178.8	-174.8	-170.8	2	110.9	I200 I203 P210 E211 E214 C228 N238	I200-R230 CarbonylContact O-C 3.53Å; I203-R230 HydrophobicContact CD1-CB 4.39Å; I203-R230 HydrophobicContact CG2-CB 4.35Å; P210-R230 HydrophobicContact CB-CG 4.23Å; E211-R230 IonicContact OE1-NH1 3.84Å; E211-R230 PolarHBondContact OE1-NH1 3.3Å; E211-R230 IonicContact OE1-NH2 2.68Å; E214-R230 IonicContact OE1-CZ 3.12Å; E214-R230 VanDerWaalsContact OE1-CZ 3.24Å; E214-R230 IonicContact OE1-NE 3.14Å; E214-R230 PolarHBondContact OE1-NE 3.49Å; E214-R230 IonicContact OE1-NH2 3.31Å; E214-R230 PolarHBondContact OE1-NH2 3.43Å; E214-R230 IonicContact OE2-CZ 2.67Å; E214-R230 IonicContact OE2-NE 3.04Å; E214-R230 IonicContact OE2-NH2 3.9Å; E214-R230 PolarHBondContact OE2-NH2 3.43Å; C228-R230 PolarHBondContact O-N 2.88Å; R230-N238 WeakPolarHBondContact O-CB 3.27Å; R230-N238 PolarHBondContact O-ND2 2.95Å
231	I	96.5	Very high	92.9	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	30%	0.295	C	S	.	.			trans	-139.5	163.9	-179.1	70.1	164.7	0	0	0	114.6	L91 V199 I200 N201 K202 I203 I229 T237 N238 V239 V242	L91-I231 HydrophobicContact CD1-CD1 3.64Å; L91-I231 HydrophobicContact CD2-CD1 4.07Å; L91-I231 HydrophobicContact CG-CD1 4.44Å; V199-I231 HydrophobicContact CG1-CD1 3.39Å; V199-I231 HydrophobicContact CG1-CG1 3.68Å; V199-I231 HydrophobicContact CG1-CG2 4.41Å; I200-I231 PolarHBondContact O-N 2.91Å; N201-I231 CarbonylContact C-O 3.51Å; N201-I231 WeakPolarHBondContact CA-O 3.44Å; N201-I231 HydrophobicContact CB-CD1 4.45Å; N201-I231 HydrophobicContact CB-CG1 4.12Å; K202-I231 PolarHBondContact N-O 3.16Å; I203-I231 WeakPolarHBondContact CG1-O 3.4Å; I203-I231 PolarHBondContact N-O 2.81Å; I229-I231 HydrophobicContact CG2-CG2 3.9Å; I231-T237 WeakPolarHBondContact CA-O 3.37Å; I231-N238 HydrophobicContact CG2-CB 4.31Å; I231-N238 WeakPolarHBondContact CG2-O 3.46Å; I231-V239 HydrophobicContact CD1-CG2 4.41Å; I231-V242 HydrophobicContact CD1-CG2 4.4Å; I231-V242 HydrophobicContact CG2-CG2 3.74Å
232	S	95.8	Very high	93	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-123.8	104.2	154.8	175	0	0	0	0	110.1	D204 K234 L235 G236 T237	D204-S232 WeakPolarHBondContact OD1-CB 3.39Å; D204-S232 PolarHBondContact OD1-OG 3.07Å; S232-K234 PolarHBondContact O-N 3.06Å; S232-K234 PolarHBondContact OG-N 2.71Å; S232-L235 PolarHBondContact O-N 2.82Å; S232-L235 PolarHBondContact OG-N 2.88Å; S232-L235 VanDerWaalsContact OG-N 3.15Å; S232-G236 CarbonylContact O-C 3.54Å; S232-G236 WeakPolarHBondContact O-CA 3.18Å; S232-G236 PolarHBondContact O-N 2.75Å; S232-T237 PolarHBondContact N-O 2.88Å; S232-T237 PolarHBondContact O-N 2.98Å
233	A	92.1	Very high	93.1	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-29.4	171.3	0	0	0	0	0	112.2	T90 L91 R94 N201	T90-A233 HydrophobicContact CG2-CB 4.15Å; L91-A233 HydrophobicContact CB-CB 4.09Å; L91-A233 HydrophobicContact CD1-CB 4.17Å; R94-A233 WeakPolarHBondContact CG-O 3.32Å; R94-A233 PolarHBondContact NE-O 3.33Å; N201-A233 WeakPolarHBondContact OD1-CB 3.38Å; N201-A233 PolarHBondContact OD1-N 3.3Å
234	K	90.1	Very high	93.2	Very high	126 Å²	126	52.4 Å²	52.4	55%	0.548	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-44.2	179	-177.4	175.7	153.3	-144	0	112.3	R94 D204 S232	R94-K234 PolarHBondContact NH2-O 2.98Å; D204-K234 WeakPolarHBondContact OD2-CD 3.39Å; D204-K234 IonicContact OD2-NZ 3.91Å; D204-K234 PolarHBondContact OD2-NZ 3.18Å; S232-K234 PolarHBondContact O-N 3.06Å; S232-K234 PolarHBondContact OG-N 2.71Å
235	L	89.6	Confident	93.3	Very high	115 Å²	115	49.8 Å²	49.8	60%	0.602	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.7	-18.9	178.6	-60.6	-175.1	0	0	0	113.8	D204 S232 T237	D204-L235 HydrophobicContact CB-CD1 3.61Å; D204-L235 HydrophobicContact CB-CG 4.02Å; S232-L235 PolarHBondContact O-N 2.82Å; S232-L235 PolarHBondContact OG-N 2.88Å; S232-L235 VanDerWaalsContact OG-N 3.15Å; L235-T237 VanDerWaalsContact C-N 3.31Å; L235-T237 WeakPolarHBondContact CB-OG1 3.42Å
236	G	87.9	Confident	93.4	Very high	27 Å²	27	45.7 Å²	45.7	28%	0.278	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.5	1.3	-168.3	0	0	0	0	0	113.7	S232 N238 V239	S232-G236 CarbonylContact O-C 3.54Å; S232-G236 WeakPolarHBondContact O-CA 3.18Å; S232-G236 PolarHBondContact O-N 2.75Å; G236-N238 PolarHBondContact O-N 2.96Å; G236-V239 PolarHBondContact O-N 2.87Å
237	T	92.8	Very high	93.7	Very high	69 Å²	69	38.5 Å²	38.5	42%	0.423	20%	0.198	S	C	.	.	B	Isolated β-bridge	trans	-61.2	122.7	-177.7	-50.1	0	0	0	0	111.2	I231 S232 L235 V239	I231-T237 WeakPolarHBondContact CA-O 3.37Å; S232-T237 PolarHBondContact N-O 2.88Å; S232-T237 PolarHBondContact O-N 2.98Å; L235-T237 VanDerWaalsContact C-N 3.31Å; L235-T237 WeakPolarHBondContact CB-OG1 3.42Å; T237-V239 PolarHBondContact O-N 3.22Å; T237-V239 VanDerWaalsContact O-N 3.16Å
238	N	93.6	Very high	93.8	Very high	82 Å²	82	40.7 Å²	40.7	44%	0.439	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	59	16.3	177.8	-156.8	40.9	0	0	0	116	R230 I231 G236 E240 A241	R230-N238 WeakPolarHBondContact O-CB 3.27Å; R230-N238 PolarHBondContact O-ND2 2.95Å; I231-N238 HydrophobicContact CG2-CB 4.31Å; I231-N238 WeakPolarHBondContact CG2-O 3.46Å; G236-N238 PolarHBondContact O-N 2.96Å; N238-E240 PolarHBondContact O-N 2.95Å; N238-A241 PolarHBondContact O-N 2.87Å; N238-A241 WeakPolarHBondContact OD1-CB 3.19Å
239	V	92.9	Very high	93.8	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-66.9	-24	177.8	176.3	0	0	0	0	112	L91 R94 L95 M98 I231 G236 T237 A241 V242	L91-V239 HydrophobicContact CD1-CG1 3.77Å; L91-V239 HydrophobicContact CD1-CG2 4.17Å; R94-V239 HydrophobicContact CB-CG1 4.12Å; L95-V239 HydrophobicContact CD2-CG1 3.93Å; M98-V239 HydrophobicContact SD-CB 3.85Å; M98-V239 HydrophobicContact SD-CG1 3.65Å; I231-V239 HydrophobicContact CD1-CG2 4.41Å; G236-V239 PolarHBondContact O-N 2.87Å; T237-V239 PolarHBondContact O-N 3.22Å; T237-V239 VanDerWaalsContact O-N 3.16Å; V239-A241 VanDerWaalsContact C-N 3.34Å; V239-A241 PolarHBondContact O-N 2.78Å; V239-V242 WeakPolarHBondContact O-CB 3.21Å; V239-V242 PolarHBondContact O-N 3.39Å; V239-V242 VanDerWaalsContact O-N 3.13Å
240	E	92.9	Very high	93.7	Very high	104 Å²	104	43.9 Å²	43.9	49%	0.486	22%	0.218	S	C	.	.	H	α-helix	trans	-63.8	-36.8	176.7	-166.4	166.9	-173.4	0	0	112.9	M98 N238 V242 L243 Q244	M98-E240 HydrophobicContact CE-CB 3.8Å; M98-E240 HydrophobicContact CE-CG 4.35Å; N238-E240 PolarHBondContact O-N 2.95Å; E240-V242 PolarHBondContact O-N 3Å; E240-V242 VanDerWaalsContact O-N 3.17Å; E240-L243 WeakPolarHBondContact O-CB 3.38Å; E240-L243 PolarHBondContact O-N 3.15Å; E240-Q244 WeakPolarHBondContact O-CG 3.47Å; E240-Q244 PolarHBondContact O-N 2.83Å
241	A	94.4	Very high	93.6	Very high	21 Å²	21	42.9 Å²	42.9	17%	0.174	22%	0.223	C	C	.	.	H	α-helix	trans	-61.4	-24.2	175.2	0	0	0	0	0	112.8	I229 N238 V239 A245	I229-A241 HydrophobicContact CG2-CB 4.04Å; N238-A241 PolarHBondContact O-N 2.87Å; N238-A241 WeakPolarHBondContact OD1-CB 3.19Å; V239-A241 VanDerWaalsContact C-N 3.34Å; V239-A241 PolarHBondContact O-N 2.78Å; A241-A245 VanDerWaalsContact O-CB 3.27Å; A241-A245 WeakPolarHBondContact O-CB 3.14Å; A241-A245 PolarHBondContact O-N 3.16Å
242	V	95.2	Very high	93.5	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-73.6	-39.2	173.7	-174.9	0	0	0	0	111	L169 V199 I229 I231 V239 E240 V246	L169-V242 HydrophobicContact CD1-CG1 3.48Å; L169-V242 VanDerWaalsContact CD1-CG1 3.48Å; L169-V242 HydrophobicContact CD2-CG1 3.92Å; L169-V242 HydrophobicContact CG-CG1 4.35Å; V199-V242 HydrophobicContact CG1-CG2 4.27Å; V199-V242 HydrophobicContact CG2-CG1 4.38Å; V199-V242 HydrophobicContact CG2-CG2 4.46Å; I229-V242 HydrophobicContact CG2-CG2 3.97Å; I231-V242 HydrophobicContact CD1-CG2 4.4Å; I231-V242 HydrophobicContact CG2-CG2 3.74Å; V239-V242 WeakPolarHBondContact O-CB 3.21Å; V239-V242 PolarHBondContact O-N 3.39Å; V239-V242 VanDerWaalsContact O-N 3.13Å; E240-V242 PolarHBondContact O-N 3Å; E240-V242 VanDerWaalsContact O-N 3.17Å; V242-V246 WeakPolarHBondContact O-CB 3.38Å; V242-V246 VanDerWaalsContact O-CG2 3.23Å; V242-V246 WeakPolarHBondContact O-CG2 3.36Å; V242-V246 PolarHBondContact O-N 2.83Å
243	L	93.9	Very high	93.3	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-66.7	-39.7	174.5	-72.8	167.9	0	0	0	111.5	L95 M98 T99 Y134 L143 E240 V246 V247	L95-L243 HydrophobicContact CD2-CD1 4.37Å; L95-L243 HydrophobicContact CD2-CD2 3.76Å; L95-L243 HydrophobicContact CD2-CG 3.76Å; M98-L243 HydrophobicContact CB-CD1 4.3Å; M98-L243 HydrophobicContact CE-CD1 4.38Å; T99-L243 HydrophobicContact CG2-CD1 4.18Å; T99-L243 HydrophobicContact CG2-CD2 4.13Å; Y134-L243 HydrophobicContact CD1-CB 4.13Å; Y134-L243 HydrophobicContact CD2-CB 4.44Å; Y134-L243 HydrophobicContact CD2-CD1 4.06Å; Y134-L243 HydrophobicContact CE1-CB 3.72Å; Y134-L243 HydrophobicContact CE2-CB 4.09Å; Y134-L243 HydrophobicContact CE2-CD1 3.93Å; Y134-L243 HydrophobicContact CG-CB 4.48Å; L143-L243 HydrophobicContact CD1-CD2 3.81Å; E240-L243 WeakPolarHBondContact O-CB 3.38Å; E240-L243 PolarHBondContact O-N 3.15Å; L243-V246 PolarHBondContact O-N 2.75Å; L243-V247 PolarHBondContact O-N 2.81Å
244	Q	94.4	Very high	92.8	Very high	65 Å²	65	49.9 Å²	49.9	30%	0.304	27%	0.269	S	S	.	.	H	α-helix	trans	-61.6	-53.4	173.9	-66.5	167.8	-12.2	0	0	110.7	E240 V246 V247 E248	E240-Q244 WeakPolarHBondContact O-CG 3.47Å; E240-Q244 PolarHBondContact O-N 2.83Å; Q244-V246 VanDerWaalsContact C-N 3.27Å; Q244-V246 PolarHBondContact O-N 2.9Å; Q244-V247 WeakPolarHBondContact O-CA 3.36Å; Q244-V247 WeakPolarHBondContact O-CB 3.48Å; Q244-V247 PolarHBondContact O-N 2.97Å; Q244-E248 WeakPolarHBondContact O-CG 3.47Å; Q244-E248 PolarHBondContact O-N 3.27Å
245	A	95.1	Very high	92.5	Very high	2 Å²	2	45.9 Å²	45.9	2%	0.017	26%	0.264	C	S	.	.	H	α-helix	trans	-61.9	-30	178.1	0	0	0	0	0	113.8	I197 I229 A241 V247 R249	I197-A245 HydrophobicContact CD1-CB 4.11Å; I197-A245 WeakPolarHBondContact CD1-O 3.23Å; I229-A245 HydrophobicContact CD1-CB 3.42Å; I229-A245 VanDerWaalsContact CD1-CB 3.42Å; A241-A245 VanDerWaalsContact O-CB 3.27Å; A241-A245 WeakPolarHBondContact O-CB 3.14Å; A241-A245 PolarHBondContact O-N 3.16Å; A245-V247 VanDerWaalsContact C-N 3.34Å; A245-R249 HydrophobicContact CB-CG 4.44Å; A245-R249 VanDerWaalsContact O-CB 3.31Å; A245-R249 WeakPolarHBondContact O-CB 3.36Å; A245-R249 PolarHBondContact O-N 2.71Å
246	V	95.6	Very high	92.4	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.006	25%	0.251	C	S	.	.	H	α-helix	trans	-65	-35.8	171.5	161.6	0	0	0	0	111.9	R76 F78 L143 L169 I197 V242 L243 Q244 I250	R76-V246 HydrophobicContact CB-CG1 4.08Å; R76-V246 WeakPolarHBondContact CD-O 3.48Å; R76-V246 HydrophobicContact CG-CG1 4.44Å; R76-V246 WeakPolarHBondContact CG-O 2.98Å; F78-V246 HydrophobicContact CD1-CG1 3.9Å; F78-V246 HydrophobicContact CD2-CG2 4.28Å; F78-V246 HydrophobicContact CE1-CG1 4.03Å; F78-V246 HydrophobicContact CE2-CG2 4.32Å; F78-V246 HydrophobicContact CG-CG1 4.35Å; F78-V246 HydrophobicContact CG-CG2 4.45Å; L143-V246 HydrophobicContact CD1-CG1 4.21Å; L143-V246 HydrophobicContact CD2-CG1 4.25Å; L169-V246 HydrophobicContact CD1-CG2 4.47Å; L169-V246 HydrophobicContact CD2-CG2 3.86Å; L169-V246 HydrophobicContact CG-CG2 4.48Å; I197-V246 HydrophobicContact CD1-CG2 4.45Å; V242-V246 WeakPolarHBondContact O-CB 3.38Å; V242-V246 VanDerWaalsContact O-CG2 3.23Å; V242-V246 WeakPolarHBondContact O-CG2 3.36Å; V242-V246 PolarHBondContact O-N 2.83Å; L243-V246 PolarHBondContact O-N 2.75Å; Q244-V246 VanDerWaalsContact C-N 3.27Å; Q244-V246 PolarHBondContact O-N 2.9Å; V246-I250 HydrophobicContact CB-CD1 4.37Å; V246-I250 HydrophobicContact CG1-CD1 4.3Å; V246-I250 HydrophobicContact CG2-CD1 3.98Å; V246-I250 WeakPolarHBondContact O-CB 3.47Å
247	V	95	Very high	92.4	Very high	5 Å²	5	43.5 Å²	43.5	3%	0.03	25%	0.25	C	S	.	.	H	α-helix	trans	-75.7	-43.1	175.6	174	0	0	0	0	111.4	R76 Y134 Y141 L143 L243 Q244 A245	R76-V247 PolarHBondContact NE-O 3.3Å; R76-V247 PolarHBondContact NH2-O 2.92Å; Y134-V247 HydrophobicContact CD1-CG2 3.98Å; Y134-V247 HydrophobicContact CE1-CG2 4.3Å; Y141-V247 HydrophobicContact CD1-CG1 4.06Å; Y141-V247 HydrophobicContact CD1-CG2 4.45Å; Y141-V247 HydrophobicContact CD2-CG1 4.12Å; Y141-V247 HydrophobicContact CD2-CG2 4.25Å; Y141-V247 HydrophobicContact CE1-CG1 3.68Å; Y141-V247 HydrophobicContact CE2-CG1 3.72Å; Y141-V247 HydrophobicContact CG-CG1 4.28Å; Y141-V247 HydrophobicContact CG-CG2 4.15Å; Y141-V247 VanDerWaalsContact CZ-CG1 3.49Å; L143-V247 HydrophobicContact CD2-CG2 4.01Å; L243-V247 PolarHBondContact O-N 2.81Å; Q244-V247 WeakPolarHBondContact O-CA 3.36Å; Q244-V247 WeakPolarHBondContact O-CB 3.48Å; Q244-V247 PolarHBondContact O-N 2.97Å; A245-V247 VanDerWaalsContact C-N 3.34Å
248	E	94.1	Very high	92.1	Very high	121 Å²	121	46.9 Å²	46.9	57%	0.565	27%	0.266	S	S	*	.	H	α-helix	trans	-75.1	-47.1	-174.7	-68.1	166.9	-167.6	0	0	114	Q244	Q244-E248 WeakPolarHBondContact O-CG 3.47Å; Q244-E248 PolarHBondContact O-N 3.27Å
249	R	94.4	Very high	91.8	Very high	92 Å²	92	46.6 Å²	46.6	35%	0.347	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-26.9	-164.9	-51.3	-173.5	-169.5	175.1	5	114.6	I197 E227 A245	I197-R249 HydrophobicContact CD1-CB 4.18Å; I197-R249 HydrophobicContact CG1-CB 4.47Å; E227-R249 PolarHBondContact O-NH1 3.02Å; A245-R249 HydrophobicContact CB-CG 4.44Å; A245-R249 VanDerWaalsContact O-CB 3.31Å; A245-R249 WeakPolarHBondContact O-CB 3.36Å; A245-R249 PolarHBondContact O-N 2.71Å
250	I	95.5	Very high	91.7	Very high	2 Å²	2	49.9 Å²	49.9	1%	0.01	29%	0.286	C	S	.	.	S	Bend	trans	-81.1	129.6	175.2	-57.6	-175.1	0	0	0	108	R76 F78 Q166 I197 V246	R76-I250 WeakPolarHBondContact CD-O 3.3Å; R76-I250 PolarHBondContact NE-O 3.28Å; F78-I250 HydrophobicContact CB-CD1 3.54Å; F78-I250 HydrophobicContact CG-CD1 4.25Å; Q166-I250 HydrophobicContact CB-CG2 3.99Å; I197-I250 HydrophobicContact CD1-CD1 4.06Å; I197-I250 HydrophobicContact CD1-CG1 3.77Å; I197-I250 HydrophobicContact CG1-CG1 4.47Å; V246-I250 HydrophobicContact CB-CD1 4.37Å; V246-I250 HydrophobicContact CG1-CD1 4.3Å; V246-I250 HydrophobicContact CG2-CD1 3.98Å; V246-I250 WeakPolarHBondContact O-CB 3.47Å
251	P	94.9	Very high	91.8	Very high	69 Å²	69	45.1 Å²	45.1	45%	0.448	26%	0.263	S	S	.	.	P	Polyproline II helix	trans	-68.2	156	176.3	25.6	-30.4	0	0	0	111.4	Q166	Q166-P251 HydrophobicContact CB-CG 4.21Å; Q166-P251 WeakPolarHBondContact CB-O 3.41Å
252	H	93.6	Very high	91.7	Very high	91 Å²	91	46.3 Å²	46.3	42%	0.421	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-65.6	156.3	169.4	59	78.4	0	0	0	110.9	V72	V72-H252 WeakPolarHBondContact O-CB 3.11Å
253	P	91.3	Very high	91.6	Very high	5 Å²	5	46.3 Å²	46.3	3%	0.032	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-53	156	168.5	13.4	-24.1	0	0	0	113	V72 I75	V72-P253 HydrophobicContact CG1-CB 4.37Å; V72-P253 HydrophobicContact CG1-CG 4.05Å; V72-P253 WeakPolarHBondContact CG1-O 3.5Å; I75-P253 HydrophobicContact CB-CG 3.83Å; I75-P253 HydrophobicContact CG2-CG 3.96Å; I75-P253 VanDerWaalsContact O-CD 3.29Å; I75-P253 WeakPolarHBondContact O-CD 3.45Å
254	G	82.5	Confident	91.6	Very high	51 Å²	51	46.8 Å²	46.8	53%	0.526	27%	0.267	S	S	.	.	P	Polyproline II helix	trans	-83.1	170	168.4	0	0	0	0	0	112.7
255	G	83.3	Confident	91.5	Very high	42 Å²	42	43.8 Å²	43.8	43%	0.433	25%	0.254	S	S	.	.			trans	91.1	169.6	176.2	0	0	0	0	0	114.7
256	S	88.1	Confident	91.2	Very high	48 Å²	48	43.9 Å²	43.9	34%	0.336	25%	0.253	S	S	.	.			trans	-123.2	156.3	-179.2	-178.7	0	0	0	0	112	D258 D259 G285 A322	S256-D258 PolarHBondContact O-N 3.44Å; S256-D258 PolarHBondContact OG-N 2.66Å; S256-D259 PolarHBondContact N-OD2 3.31Å; S256-D259 WeakPolarHBondContact O-CB 3.35Å; S256-D259 PolarHBondContact O-N 3.12Å; S256-G285 PolarHBondContact O-N 2.72Å; S256-A322 WeakPolarHBondContact O-CB 3.48Å
257	V	86.3	Confident	90.8	Very high	43 Å²	43	44 Å²	44	26%	0.261	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	-21.7	172.9	175.9	0	0	0	0	112.4	G285 F321 A322	V257-G285 WeakPolarHBondContact O-CA 3.47Å; V257-F321 HydrophobicContact CG1-CD1 3.81Å; V257-F321 HydrophobicContact CG1-CE1 4.4Å; V257-F321 HydrophobicContact CG2-CB 4.29Å; V257-F321 HydrophobicContact CG2-CD1 4.43Å; V257-A322 HydrophobicContact CG2-CB 4.34Å
258	D	86.2	Confident	90.4	Very high	141 Å²	141	43.9 Å²	43.9	75%	0.754	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-5.9	179	-62.5	-50.1	0	0	0	113.6	S256	S256-D258 PolarHBondContact O-N 3.44Å; S256-D258 PolarHBondContact OG-N 2.66Å
259	D	88.6	Confident	90	Very high	75 Å²	75	40.5 Å²	40.5	40%	0.401	24%	0.239	S	C	.	.	S	Bend	trans	-66.2	159.6	173.8	-70.5	-29.4	0	0	0	111.7	S256 F261 G285	S256-D259 PolarHBondContact N-OD2 3.31Å; S256-D259 WeakPolarHBondContact O-CB 3.35Å; S256-D259 PolarHBondContact O-N 3.12Å; D259-F261 PolarHBondContact O-N 2.95Å; D259-G285 WeakPolarHBondContact O-CA 3.35Å
260	P	91.1	Very high	89.5	Confident	70 Å²	70	38.5 Å²	38.5	46%	0.455	23%	0.233	S	C	.	.	P	Polyproline II helix	trans	-54	135.4	165.6	-25.4	35.8	0	0	0	111.3	K262 V351	P260-K262 PolarHBondContact O-N 3.4Å; P260-V351 HydrophobicContact CB-CG1 3.63Å
261	F	93.7	Very high	89	Confident	3 Å²	3	40.2 Å²	40.2	1%	0.013	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-59	124.5	-179.3	173.8	-117.9	0	0	0	111.1	D259 A263 V282 G284 V287 I293 L344 Y345 H346	D259-F261 PolarHBondContact O-N 2.95Å; F261-A263 HydrophobicContact CE2-CB 3.82Å; F261-A263 HydrophobicContact CZ-CB 3.64Å; F261-V282 HydrophobicContact CD2-CG1 4.14Å; F261-V282 HydrophobicContact CE2-CG1 3.93Å; F261-V282 HydrophobicContact CE2-CG2 4.25Å; F261-G284 WeakPolarHBondContact CA-O 3.45Å; F261-V287 HydrophobicContact CD1-CB 4.34Å; F261-V287 HydrophobicContact CD2-CB 3.98Å; F261-V287 HydrophobicContact CD2-CG1 4.31Å; F261-V287 HydrophobicContact CE1-CB 4.03Å; F261-V287 HydrophobicContact CE1-CG2 4.26Å; F261-V287 HydrophobicContact CE2-CB 3.62Å; F261-V287 HydrophobicContact CE2-CG1 3.55Å; F261-V287 HydrophobicContact CG-CB 4.34Å; F261-V287 HydrophobicContact CZ-CB 3.66Å; F261-V287 HydrophobicContact CZ-CG1 3.7Å; F261-V287 HydrophobicContact CZ-CG2 4.19Å; F261-I293 HydrophobicContact CD1-CG2 4.25Å; F261-I293 HydrophobicContact CE1-CG2 3.82Å; F261-L344 HydrophobicContact CE1-CB 4.38Å; F261-Y345 VanDerWaalsContact O-CA 3.28Å; F261-Y345 WeakPolarHBondContact O-CA 3.31Å; F261-Y345 VanDerWaalsContact O-CB 3.28Å; F261-Y345 WeakPolarHBondContact O-CB 3.39Å; F261-H346 WeakPolarHBondContact CB-CD2 3.26Å; F261-H346 WeakPolarHBondContact CB-NE2 3.39Å; F261-H346 AromaticContact CD1-CE1 3.7Å; F261-H346 AromaticContact CD1-ND1 3.82Å; F261-H346 AromaticContact CD1-NE2 3.92Å; F261-H346 AromaticContact CG-CE1 3.98Å; F261-H346 AromaticContact CG-NE2 3.74Å
262	K	93.4	Very high	88.2	Confident	46 Å²	46	42.5 Å²	42.5	20%	0.2	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	113.5	-177.9	-174.9	169.7	174.1	171.9	0	109.3	P260 I283 G284 T343 L344 V351 Q352 L354	P260-K262 PolarHBondContact O-N 3.4Å; K262-I283 WeakPolarHBondContact O-CA 3.5Å; K262-I283 PolarHBondContact O-N 3.49Å; K262-G284 PolarHBondContact N-O 3.29Å; K262-G284 PolarHBondContact O-N 3.33Å; K262-G284 VanDerWaalsContact O-N 3.1Å; K262-T343 HydrophobicContact CD-CG2 4.45Å; K262-T343 HydrophobicContact CG-CG2 3.74Å; K262-L344 WeakPolarHBondContact CA-O 3.43Å; K262-V351 HydrophobicContact CB-CG2 4.37Å; K262-V351 HydrophobicContact CD-CB 4.38Å; K262-V351 HydrophobicContact CD-CG2 3.99Å; K262-V351 HydrophobicContact CG-CG2 4.06Å; K262-Q352 VanDerWaalsContact CE-O 3.26Å; K262-Q352 WeakPolarHBondContact CE-O 3.35Å; K262-Q352 PolarHBondContact NZ-O 2.79Å; K262-L354 VanDerWaalsContact CE-CD2 3.4Å; K262-L354 VanDerWaalsContact CE-CG 3.45Å
263	A	93.6	Very high	87.7	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	141.6	178.9	0	0	0	0	0	112.3	F261 I280 A281 V282 T343 L344	F261-A263 HydrophobicContact CE2-CB 3.82Å; F261-A263 HydrophobicContact CZ-CB 3.64Å; A263-I280 HydrophobicContact CB-CB 4.37Å; A263-I280 HydrophobicContact CB-CD1 3.96Å; A263-A281 CarbonylContact C-O 3.54Å; A263-A281 VanDerWaalsContact CA-O 3.25Å; A263-A281 WeakPolarHBondContact CA-O 3.32Å; A263-V282 HydrophobicContact CB-CG2 4.38Å; A263-T343 WeakPolarHBondContact O-CA 3.48Å; A263-L344 PolarHBondContact N-O 2.87Å; A263-L344 PolarHBondContact O-N 2.71Å
264	L	92.8	Very high	87.3	Confident	11 Å²	11	52.3 Å²	52.3	6%	0.058	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	127.4	175.6	-178.8	60.9	0	0	0	110.2	I280 A281 L354 F357	L264-I280 WeakPolarHBondContact O-CA 3.37Å; L264-A281 PolarHBondContact N-O 3.33Å; L264-A281 PolarHBondContact O-N 2.84Å; L264-L354 HydrophobicContact CB-CD1 3.6Å; L264-L354 HydrophobicContact CD1-CB 4.48Å; L264-L354 HydrophobicContact CD1-CD1 3.86Å; L264-L354 HydrophobicContact CG-CD1 4.2Å; L264-F357 HydrophobicContact CD2-CZ 4.38Å
265	V	91.8	Very high	87.5	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.012	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	112.6	166.2	-177.5	0	0	0	0	108.8	A278 I280 G341 D342 L344	V265-A278 HydrophobicContact CG1-CB 4.32Å; V265-I280 HydrophobicContact CG2-CG2 4.08Å; V265-G341 PolarHBondContact O-N 3.34Å; V265-D342 PolarHBondContact N-O 3.5Å; V265-L344 HydrophobicContact CG2-CD1 3.73Å; V265-L344 HydrophobicContact CG2-CG 3.87Å
266	F	89	Confident	87.7	Confident	3 Å²	3	48.6 Å²	48.6	1%	0.013	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	-20	-177.1	72	-88.3	0	0	0	114	I146 R160 A164 N279 A281 V325 I340	I146-F266 HydrophobicContact CD1-CD2 4.4Å; I146-F266 HydrophobicContact CD1-CE2 3.76Å; I146-F266 HydrophobicContact CD1-CZ 4.02Å; I146-F266 HydrophobicContact CG1-CE2 4.47Å; R160-F266 PolarHBondContact NE-O 2.86Å; A164-F266 HydrophobicContact CB-CB 4.35Å; A164-F266 HydrophobicContact CB-CD1 4.02Å; A164-F266 HydrophobicContact CB-CD2 4.26Å; A164-F266 HydrophobicContact CB-CE1 4.39Å; A164-F266 HydrophobicContact CB-CG 3.95Å; F266-N279 VanDerWaalsContact CD1-O 3.32Å; F266-N279 WeakPolarHBondContact CD1-O 3.4Å; F266-N279 HydrophobicContact CE1-CB 4.01Å; F266-N279 HydrophobicContact CE2-CB 4.34Å; F266-N279 HydrophobicContact CZ-CB 3.88Å; F266-N279 PolarHBondContact N-O 3.35Å; F266-A281 HydrophobicContact CD1-CB 4.43Å; F266-V325 HydrophobicContact CE1-CG1 3.67Å; F266-V325 HydrophobicContact CZ-CG1 3.74Å; F266-I340 VanDerWaalsContact O-CG2 3.26Å; F266-I340 WeakPolarHBondContact O-CG2 3.46Å
267	D	88.1	Confident	87.9	Confident	5 Å²	5	46.6 Å²	46.6	3%	0.027	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	162.2	169.2	175	50	0	0	0	110.7	K126 R160 N269 N279	K126-D267 VanDerWaalsContact CE-CG 3.42Å; K126-D267 WeakPolarHBondContact CE-OD1 3.18Å; K126-D267 VanDerWaalsContact CE-OD2 3.27Å; K126-D267 WeakPolarHBondContact CE-OD2 3.38Å; K126-D267 IonicContact NZ-OD1 3.25Å; K126-D267 PolarHBondContact NZ-OD1 3.09Å; K126-D267 IonicContact NZ-OD2 3.95Å; K126-D267 PolarHBondContact NZ-OD2 3Å; R160-D267 IonicContact NH2-OD1 3.7Å; D267-N269 PolarHBondContact OD2-ND2 2.95Å; D267-N279 HydrophobicContact CB-CB 3.99Å; D267-N279 PolarHBondContact O-N 3.13Å; D267-N279 PolarHBondContact OD2-ND2 2.91Å
268	S	86.6	Confident	88.1	Confident	2 Å²	2	44.6 Å²	44.6	1%	0.014	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	142.3	178	59.5	0	0	0	0	111.1	K126 V277 V335	K126-S268 PolarHBondContact NZ-O 2.62Å; S268-V277 WeakPolarHBondContact CA-O 3.28Å; S268-V335 WeakPolarHBondContact OG-CG1 3.3Å
269	N	85.6	Confident	88.4	Confident	50 Å²	50	38.4 Å²	38.4	27%	0.267	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	146.1	174.4	-63.9	-78.2	0	0	0	110.2	K126 D267 V277 N279	K126-N269 WeakPolarHBondContact CE-OD1 3.24Å; K126-N269 PolarHBondContact NZ-OD1 3.32Å; D267-N269 PolarHBondContact OD2-ND2 2.95Å; N269-V277 PolarHBondContact N-O 2.9Å; N269-V277 PolarHBondContact O-N 3.34Å; N269-N279 PolarHBondContact ND2-ND2 3.38Å
270	F	84	Confident	88.6	Confident	50 Å²	50	34.8 Å²	34.8	22%	0.219	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	119.3	-179.7	-174.2	-110.2	0	0	0	112.3	H272 V276 K333 V335 L388 N389	F270-H272 AromaticContact CD1-ND1 3.91Å; F270-H272 AromaticContact CE1-ND1 3.5Å; F270-V276 HydrophobicContact CD2-CG2 4.41Å; F270-K333 WeakPolarHBondContact CE2-O 3.37Å; F270-V335 HydrophobicContact CB-CG2 3.9Å; F270-V335 HydrophobicContact CD2-CG2 4.15Å; F270-V335 HydrophobicContact CG-CG2 4.38Å; F270-L388 HydrophobicContact CB-CB 4.3Å; F270-L388 HydrophobicContact CD1-CD1 3.99Å; F270-L388 HydrophobicContact CD2-CD1 4.49Å; F270-L388 HydrophobicContact CE1-CD1 4.08Å; F270-L388 HydrophobicContact CG-CB 4.47Å; F270-L388 HydrophobicContact CG-CD1 4.19Å; F270-L388 HydrophobicContact CZ-CD1 4.39Å; F270-N389 WeakPolarHBondContact CB-OD1 3.15Å; F270-N389 PolarHBondContact N-OD1 3.05Å
271	D	84.3	Confident	88.7	Confident	38 Å²	38	31.7 Å²	31.7	20%	0.203	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	128.6	175.4	-178.1	-56.6	0	0	0	110.1	Y273 R274 G275 V277	D271-Y273 PolarHBondContact O-N 3.35Å; D271-Y273 VanDerWaalsContact O-N 3.17Å; D271-Y273 WeakPolarHBondContact OD1-CA 3.15Å; D271-Y273 PolarHBondContact OD1-N 2.94Å; D271-R274 HydrophobicContact CB-CB 4.04Å; D271-R274 PolarHBondContact OD1-N 2.98Å; D271-R274 IonicContact OD1-NE 2.76Å; D271-R274 IonicContact OD2-CZ 3.61Å; D271-R274 VanDerWaalsContact OD2-CZ 3.25Å; D271-R274 IonicContact OD2-NE 3.19Å; D271-R274 PolarHBondContact OD2-NE 3.19Å; D271-R274 IonicContact OD2-NH2 2.78Å; D271-R274 PolarHBondContact OD2-NH2 3.25Å; D271-G275 PolarHBondContact N-O 3.01Å; D271-G275 WeakPolarHBondContact O-CA 3.43Å; D271-G275 PolarHBondContact O-N 3.34Å; D271-V277 HydrophobicContact CB-CG2 4.15Å
272	H	78.1	Confident	88.7	Confident	117 Å²	117	31.6 Å²	31.6	54%	0.542	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-19.6	-176.2	-71.6	-25	0	0	0	115.4	F270	F270-H272 AromaticContact CD1-ND1 3.91Å; F270-H272 AromaticContact CE1-ND1 3.5Å
273	Y	83.1	Confident	88.7	Confident	224 Å²	224	32.4 Å²	32.4	88%	0.878	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	-110.5	-31.7	-179.7	-59.6	-78	0	0	0	112.7	D271	D271-Y273 PolarHBondContact O-N 3.35Å; D271-Y273 VanDerWaalsContact O-N 3.17Å; D271-Y273 WeakPolarHBondContact OD1-CA 3.15Å; D271-Y273 PolarHBondContact OD1-N 2.94Å
274	R	84.1	Confident	88.5	Confident	78 Å²	78	32.6 Å²	32.6	29%	0.294	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-11.4	-174.2	-59.4	-176.7	-67.1	162.3	3.4	114	D271 E306 E314 I329	D271-R274 HydrophobicContact CB-CB 4.04Å; D271-R274 PolarHBondContact OD1-N 2.98Å; D271-R274 IonicContact OD1-NE 2.76Å; D271-R274 IonicContact OD2-CZ 3.61Å; D271-R274 VanDerWaalsContact OD2-CZ 3.25Å; D271-R274 IonicContact OD2-NE 3.19Å; D271-R274 PolarHBondContact OD2-NE 3.19Å; D271-R274 IonicContact OD2-NH2 2.78Å; D271-R274 PolarHBondContact OD2-NH2 3.25Å; R274-E306 IonicContact NH1-OE1 2.71Å; R274-E314 IonicContact CZ-OE1 3.94Å; R274-E314 IonicContact CZ-OE2 2.68Å; R274-E314 IonicContact NH1-OE1 3.71Å; R274-E314 IonicContact NH1-OE2 3.5Å; R274-E314 PolarHBondContact NH1-OE2 3.31Å; R274-E314 IonicContact NH2-OE1 2.71Å; R274-E314 PolarHBondContact NH2-OE1 3.1Å; R274-E314 IonicContact NH2-OE2 3.34Å; R274-E314 PolarHBondContact NH2-OE2 2.95Å; R274-I329 HydrophobicContact CB-CD1 4.2Å; R274-I329 HydrophobicContact CB-CG2 4.17Å; R274-I329 WeakPolarHBondContact O-CG2 3.44Å
275	G	86.6	Confident	88.5	Confident	14 Å²	14	32.1 Å²	32.1	14%	0.144	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	82.6	-144.3	-176.1	0	0	0	0	0	111.4	D271 M332	D271-G275 PolarHBondContact N-O 3.01Å; D271-G275 WeakPolarHBondContact O-CA 3.43Å; D271-G275 PolarHBondContact O-N 3.34Å; G275-M332 WeakPolarHBondContact CA-O 3.35Å
276	V	87.5	Confident	88.6	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	126.4	178	-164.6	0	0	0	0	111.1	F270 M332 V335 A338	F270-V276 HydrophobicContact CD2-CG2 4.41Å; V276-M332 HydrophobicContact CB-CB 3.99Å; V276-M332 HydrophobicContact CG2-CB 3.9Å; V276-M332 PolarHBondContact N-O 2.82Å; V276-V335 HydrophobicContact CG1-CG2 4.12Å; V276-V335 HydrophobicContact CG2-CB 4.43Å; V276-V335 HydrophobicContact CG2-CG2 3.87Å; V276-A338 HydrophobicContact CB-CB 4.38Å; V276-A338 HydrophobicContact CG1-CB 3.69Å
277	V	90.7	Very high	88.8	Confident	6 Å²	6	38.4 Å²	38.4	4%	0.036	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	109	165.9	-174.1	0	0	0	0	107.2	S268 N269 D271 Y327 I329	S268-V277 WeakPolarHBondContact CA-O 3.28Å; N269-V277 PolarHBondContact N-O 2.9Å; N269-V277 PolarHBondContact O-N 3.34Å; D271-V277 HydrophobicContact CB-CG2 4.15Å; V277-Y327 HydrophobicContact CG1-CD2 3.93Å; V277-Y327 HydrophobicContact CG1-CG 4.27Å; V277-I329 HydrophobicContact CG1-CG1 4.29Å; V277-I329 HydrophobicContact CG2-CD1 4Å; V277-I329 HydrophobicContact CG2-CG1 4.12Å
278	A	91.3	Very high	89.1	Confident	2 Å²	2	43.3 Å²	43.3	2%	0.017	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	123.6	-179.6	0	0	0	0	0	110.2	V265 I280 Y327 I328	V265-A278 HydrophobicContact CG1-CB 4.32Å; A278-I280 HydrophobicContact CB-CG2 4.44Å; A278-Y327 CarbonylContact O-C 3.58Å; A278-Y327 WeakPolarHBondContact O-CA 3.36Å; A278-I328 PolarHBondContact N-O 2.84Å; A278-I328 PolarHBondContact O-N 2.92Å
279	N	92.1	Very high	89.5	Confident	10 Å²	10	48.4 Å²	48.4	5%	0.053	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	123.5	173.6	-70.4	-27.4	0	0	0	108.7	F266 D267 N269	F266-N279 VanDerWaalsContact CD1-O 3.32Å; F266-N279 WeakPolarHBondContact CD1-O 3.4Å; F266-N279 HydrophobicContact CE1-CB 4.01Å; F266-N279 HydrophobicContact CE2-CB 4.34Å; F266-N279 HydrophobicContact CZ-CB 3.88Å; F266-N279 PolarHBondContact N-O 3.35Å; D267-N279 HydrophobicContact CB-CB 3.99Å; D267-N279 PolarHBondContact O-N 3.13Å; D267-N279 PolarHBondContact OD2-ND2 2.91Å; N269-N279 PolarHBondContact ND2-ND2 3.38Å
280	I	93.6	Very high	89.8	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	145.4	-169	60.3	139.4	0	0	0	113.6	A263 L264 V265 A278 V282 L320 V325 G326 I328 L344	A263-I280 HydrophobicContact CB-CB 4.37Å; A263-I280 HydrophobicContact CB-CD1 3.96Å; L264-I280 WeakPolarHBondContact O-CA 3.37Å; V265-I280 HydrophobicContact CG2-CG2 4.08Å; A278-I280 HydrophobicContact CB-CG2 4.44Å; I280-V282 HydrophobicContact CD1-CG2 3.83Å; I280-L320 HydrophobicContact CD1-CD1 4.17Å; I280-V325 WeakPolarHBondContact O-CA 3.45Å; I280-G326 PolarHBondContact N-O 2.84Å; I280-G326 PolarHBondContact O-N 3.01Å; I280-I328 HydrophobicContact CD1-CD1 3.45Å; I280-I328 VanDerWaalsContact CD1-CD1 3.45Å; I280-I328 HydrophobicContact CD1-CG1 3.8Å; I280-I328 HydrophobicContact CG1-CD1 4.19Å; I280-I328 HydrophobicContact CG1-CG1 4.09Å; I280-L344 HydrophobicContact CG2-CD1 4.04Å
281	A	93.4	Very high	90.2	Very high	4 Å²	4	46.7 Å²	46.7	3%	0.033	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	119.8	164.5	0	0	0	0	0	108.7	A164 A263 L264 F266 I283 V325	A164-A281 HydrophobicContact CB-CB 4.12Å; A263-A281 CarbonylContact C-O 3.54Å; A263-A281 VanDerWaalsContact CA-O 3.25Å; A263-A281 WeakPolarHBondContact CA-O 3.32Å; L264-A281 PolarHBondContact N-O 3.33Å; L264-A281 PolarHBondContact O-N 2.84Å; F266-A281 HydrophobicContact CD1-CB 4.43Å; A281-I283 HydrophobicContact CB-CD1 4.33Å; A281-I283 PolarHBondContact O-N 2.89Å; A281-V325 HydrophobicContact CB-CG2 4.2Å
282	V	93.8	Very high	90.7	Very high	2 Å²	2	50.7 Å²	50.7	1%	0.012	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	110.9	177.1	-173.2	0	0	0	0	108.7	F261 A263 I280 G284 L320 F321 G323 Q324	F261-V282 HydrophobicContact CD2-CG1 4.14Å; F261-V282 HydrophobicContact CE2-CG1 3.93Å; F261-V282 HydrophobicContact CE2-CG2 4.25Å; A263-V282 HydrophobicContact CB-CG2 4.38Å; I280-V282 HydrophobicContact CD1-CG2 3.83Å; V282-G284 WeakPolarHBondContact CG1-O 3.31Å; V282-L320 HydrophobicContact CG2-CB 4.1Å; V282-F321 WeakPolarHBondContact CB-O 3.38Å; V282-G323 WeakPolarHBondContact O-CA 3.41Å; V282-G323 PolarHBondContact O-N 3.13Å; V282-Q324 PolarHBondContact N-O 3.37Å
283	I	91.8	Very high	91.5	Very high	63 Å²	63	45.1 Å²	45.1	32%	0.323	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	-28.8	-179.6	-52	-54.7	0	0	0	111.3	K262 A281 L354	K262-I283 WeakPolarHBondContact O-CA 3.5Å; K262-I283 PolarHBondContact O-N 3.49Å; A281-I283 HydrophobicContact CB-CD1 4.33Å; A281-I283 PolarHBondContact O-N 2.89Å; I283-L354 HydrophobicContact CG1-CD1 3.98Å
284	G	91.3	Very high	92	Very high	4 Å²	4	34.8 Å²	34.8	4%	0.041	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	154.8	177.3	0	0	0	0	0	112.7	F261 K262 V282	F261-G284 WeakPolarHBondContact CA-O 3.45Å; K262-G284 PolarHBondContact N-O 3.29Å; K262-G284 PolarHBondContact O-N 3.33Å; K262-G284 VanDerWaalsContact O-N 3.1Å; V282-G284 WeakPolarHBondContact CG1-O 3.31Å
285	G	91.9	Very high	92.4	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.154	C	C	.	.	S	Bend	trans	72.3	-142	174.5	0	0	0	0	0	114.8	S256 V257 D259 A322	S256-G285 PolarHBondContact O-N 2.72Å; V257-G285 WeakPolarHBondContact O-CA 3.47Å; D259-G285 WeakPolarHBondContact O-CA 3.35Å; G285-A322 PolarHBondContact O-N 3.04Å
286	R	93.1	Very high	92.5	Very high	136 Å²	136	31.8 Å²	31.8	51%	0.513	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.9	151.2	-176.9	65.3	-168.3	-178	-155.6	-5.5	112.1	L320 F321 H346	R286-L320 WeakPolarHBondContact CA-O 3.41Å; R286-F321 HydrophobicContact CB-CD1 4.07Å; R286-H346 PolarHBondContact O-NE2 2.83Å
287	V	94	Very high	92.4	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.012	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	140.1	174.5	57.8	0	0	0	0	110.2	F261 D291 I293 V304 K319 L320 I328	F261-V287 HydrophobicContact CD1-CB 4.34Å; F261-V287 HydrophobicContact CD2-CB 3.98Å; F261-V287 HydrophobicContact CD2-CG1 4.31Å; F261-V287 HydrophobicContact CE1-CB 4.03Å; F261-V287 HydrophobicContact CE1-CG2 4.26Å; F261-V287 HydrophobicContact CE2-CB 3.62Å; F261-V287 HydrophobicContact CE2-CG1 3.55Å; F261-V287 HydrophobicContact CG-CB 4.34Å; F261-V287 HydrophobicContact CZ-CB 3.66Å; F261-V287 HydrophobicContact CZ-CG1 3.7Å; F261-V287 HydrophobicContact CZ-CG2 4.19Å; V287-D291 HydrophobicContact CG2-CB 4.23Å; V287-I293 HydrophobicContact CG2-CG2 4.3Å; V287-V304 HydrophobicContact CG2-CG2 4.02Å; V287-K319 CarbonylContact O-C 3.35Å; V287-K319 WeakPolarHBondContact O-CA 3.22Å; V287-L320 HydrophobicContact CG1-CB 4.06Å; V287-L320 PolarHBondContact N-O 2.91Å; V287-L320 PolarHBondContact O-N 2.9Å; V287-I328 HydrophobicContact CG1-CD1 4.16Å; V287-I328 HydrophobicContact CG2-CD1 4.42Å
288	K	94.3	Very high	92.2	Very high	107 Å²	107	40 Å²	40	47%	0.465	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	164	174	58.9	160.3	-177.2	174.7	0	111.2	G290 D291 Q318 K319	K288-G290 PolarHBondContact O-N 3.17Å; K288-D291 WeakPolarHBondContact CE-OD1 3.47Å; K288-D291 HydrophobicContact CG-CB 4.48Å; K288-D291 VanDerWaalsContact CG-OD1 3.3Å; K288-D291 WeakPolarHBondContact CG-OD1 3.36Å; K288-D291 WeakPolarHBondContact CG-OD2 3.44Å; K288-D291 PolarHBondContact N-OD2 3.06Å; K288-D291 IonicContact NZ-OD1 3.85Å; K288-D291 WeakPolarHBondContact O-CB 3.34Å; K288-D291 PolarHBondContact O-N 3.03Å; K288-Q318 WeakPolarHBondContact CA-O 3.31Å; K288-K319 HydrophobicContact CB-CG 3.99Å
289	K	94.1	Very high	92.1	Very high	109 Å²	109	44.4 Å²	44.4	47%	0.474	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	134.7	167.6	-178.3	169.3	174.7	129.7	0	110.3	N305 Q318	K289-N305 WeakPolarHBondContact CD-O 3.5Å; K289-N305 WeakPolarHBondContact CE-O 3.46Å; K289-N305 PolarHBondContact NZ-O 2.61Å; K289-Q318 PolarHBondContact N-O 3.4Å
290	G	92.3	Very high	92	Very high	38 Å²	38	48.4 Å²	48.4	39%	0.392	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.5	8.4	-175.5	0	0	0	0	0	115.7	K288 V304	K288-G290 PolarHBondContact O-N 3.17Å; G290-V304 PolarHBondContact N-O 3.24Å
291	D	93.8	Very high	91.9	Very high	26 Å²	26	51.8 Å²	51.8	14%	0.139	27%	0.266	C	S	.	.			trans	-72.6	151	167	-80.1	-23.3	0	0	0	111.7	V287 K288 E303 V304 H346	V287-D291 HydrophobicContact CG2-CB 4.23Å; K288-D291 WeakPolarHBondContact CE-OD1 3.47Å; K288-D291 HydrophobicContact CG-CB 4.48Å; K288-D291 VanDerWaalsContact CG-OD1 3.3Å; K288-D291 WeakPolarHBondContact CG-OD1 3.36Å; K288-D291 WeakPolarHBondContact CG-OD2 3.44Å; K288-D291 PolarHBondContact N-OD2 3.06Å; K288-D291 IonicContact NZ-OD1 3.85Å; K288-D291 WeakPolarHBondContact O-CB 3.34Å; K288-D291 PolarHBondContact O-N 3.03Å; D291-E303 WeakPolarHBondContact O-CA 3.42Å; D291-V304 PolarHBondContact O-N 3.26Å; D291-H346 VanDerWaalsContact CG-CE1 3.49Å; D291-H346 IonicContact OD2-CE1 3.72Å; D291-H346 PolarHBondContact OD2-CE1 2.85Å; D291-H346 IonicContact OD2-NE2 2.87Å
292	K	94.8	Very high	92	Very high	122 Å²	122	52.9 Å²	52.9	53%	0.53	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	107.4	171.9	-72.2	-178	179.6	-179.9	0	110	T301 Y302 H347	K292-T301 HydrophobicContact CB-CG2 4.2Å; K292-Y302 CarbonylContact C-O 3.56Å; K292-Y302 WeakPolarHBondContact CA-O 2.97Å; K292-H347 HydrophobicContact CB-CB 4.11Å; K292-H347 WeakPolarHBondContact O-CB 3.47Å; K292-H347 PolarHBondContact O-N 3.32Å
293	I	94.6	Very high	92	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	154.3	-179.8	61	169	0	0	0	110.9	F261 V287 T301 Y302 V304 I328 A330 L344 Y345	F261-I293 HydrophobicContact CD1-CG2 4.25Å; F261-I293 HydrophobicContact CE1-CG2 3.82Å; V287-I293 HydrophobicContact CG2-CG2 4.3Å; I293-T301 CarbonylContact O-C 3.55Å; I293-T301 WeakPolarHBondContact O-CA 3.5Å; I293-Y302 PolarHBondContact N-O 3.09Å; I293-Y302 PolarHBondContact O-N 2.9Å; I293-V304 HydrophobicContact CD1-CG2 3.8Å; I293-V304 HydrophobicContact CG1-CG2 3.93Å; I293-V304 HydrophobicContact CG2-CG2 3.85Å; I293-I328 HydrophobicContact CD1-CG2 4.29Å; I293-A330 HydrophobicContact CD1-CB 4.09Å; I293-L344 HydrophobicContact CD1-CD1 4.13Å; I293-L344 HydrophobicContact CD1-CD2 4.37Å; I293-Y345 CarbonylContact C-O 3.59Å; I293-Y345 WeakPolarHBondContact CA-O 3.27Å
294	V	93.3	Very high	92.1	Very high	8 Å²	8	54.8 Å²	54.8	5%	0.048	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	136.9	179.1	-179.2	0	0	0	0	109.9	K300 T301 L344 Y345 H347	V294-K300 WeakPolarHBondContact CA-O 3.47Å; V294-T301 HydrophobicContact CG2-CG2 4.17Å; V294-L344 WeakPolarHBondContact O-CA 3.14Å; V294-Y345 HydrophobicContact CB-CD2 4.38Å; V294-Y345 HydrophobicContact CB-CE1 4.04Å; V294-Y345 HydrophobicContact CB-CE2 3.84Å; V294-Y345 HydrophobicContact CG1-CE1 4.02Å; V294-Y345 HydrophobicContact CG1-CE2 4.21Å; V294-Y345 WeakPolarHBondContact CG1-OH 3.45Å; V294-Y345 HydrophobicContact CG2-CE2 4.43Å; V294-Y345 PolarHBondContact N-O 3.45Å; V294-Y345 WeakPolarHBondContact O-CD1 3.42Å; V294-Y345 PolarHBondContact O-N 2.67Å; V294-H347 HydrophobicContact CG2-CB 3.89Å
295	S	91.8	Very high	92.2	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	121	167.9	163.6	0	0	0	0	109.6	H297 L298 S299 K300 D342	S295-H297 VanDerWaalsContact C-N 3.35Å; S295-L298 WeakPolarHBondContact OG-CB 3.24Å; S295-L298 PolarHBondContact OG-N 2.97Å; S295-S299 WeakPolarHBondContact O-CA 3.39Å; S295-S299 PolarHBondContact O-N 2.9Å; S295-K300 PolarHBondContact N-O 2.98Å; S295-D342 WeakPolarHBondContact CA-OD2 3.47Å; S295-D342 WeakPolarHBondContact CB-OD2 3.28Å; S295-D342 PolarHBondContact OG-OD2 2.88Å
296	A	89.2	Confident	92.3	Very high	29 Å²	29	60.9 Å²	60.9	24%	0.24	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-39.9	175.7	0	0	0	0	0	111.9	D342 T343 Y345 A353	A296-D342 PolarHBondContact N-OD1 2.93Å; A296-D342 VanDerWaalsContact N-OD1 3.1Å; A296-T343 WeakPolarHBondContact CB-O 3.35Å; A296-T343 PolarHBondContact N-O 2.97Å; A296-Y345 HydrophobicContact CB-CD1 4.35Å; A296-Y345 HydrophobicContact CB-CE1 3.96Å; A296-A353 HydrophobicContact CB-CB 4.08Å
297	H	86.3	Confident	92.3	Very high	119 Å²	119	54.4 Å²	54.4	55%	0.551	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-39	-179.5	-175.7	-73.4	0	0	0	113.1	S295 D342	S295-H297 VanDerWaalsContact C-N 3.35Å; H297-D342 HydrophobicContact CB-CB 4.32Å; H297-D342 WeakPolarHBondContact CB-OD1 3.45Å; H297-D342 PolarHBondContact N-OD1 2.95Å
298	L	86.1	Confident	92.3	Very high	60 Å²	60	54.3 Å²	54.3	31%	0.314	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-8.3	-174.2	-62.6	175.3	0	0	0	114.4	S295 K300 E337	S295-L298 WeakPolarHBondContact OG-CB 3.24Å; S295-L298 PolarHBondContact OG-N 2.97Å; L298-K300 HydrophobicContact CB-CB 4.37Å; L298-K300 HydrophobicContact CB-CD 4.39Å; L298-K300 HydrophobicContact CB-CG 4.16Å; L298-K300 PolarHBondContact O-N 3.06Å; L298-E337 HydrophobicContact CD1-CB 4.37Å
299	S	88.1	Confident	92.2	Very high	94 Å²	94	49.3 Å²	49.3	66%	0.657	26%	0.26	S	S	*	.			trans	51.4	24.1	-171.8	-58.2	0	0	0	0	114	S295	S295-S299 WeakPolarHBondContact O-CA 3.39Å; S295-S299 PolarHBondContact O-N 2.9Å
300	K	90.8	Very high	92	Very high	94 Å²	94	44.8 Å²	44.8	41%	0.409	24%	0.241	S	C	.	.			trans	-90.4	136.1	176.8	-75.2	-175.8	178.2	-174.5	0	110.4	V294 S295 L298 Y302 E337	V294-K300 WeakPolarHBondContact CA-O 3.47Å; S295-K300 PolarHBondContact N-O 2.98Å; L298-K300 HydrophobicContact CB-CB 4.37Å; L298-K300 HydrophobicContact CB-CD 4.39Å; L298-K300 HydrophobicContact CB-CG 4.16Å; L298-K300 PolarHBondContact O-N 3.06Å; K300-Y302 HydrophobicContact CB-CD2 4.41Å; K300-Y302 HydrophobicContact CB-CE2 3.56Å; K300-Y302 WeakPolarHBondContact CD-OH 3.42Å; K300-Y302 WeakPolarHBondContact O-CD2 3.4Å; K300-E337 IonicContact NZ-OE1 2.79Å; K300-E337 PolarHBondContact NZ-OE1 2.67Å
301	T	92.3	Very high	91.7	Very high	71 Å²	71	45.9 Å²	45.9	44%	0.436	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	138	173.3	-49.9	0	0	0	0	110.6	K292 I293 V294 H347	K292-T301 HydrophobicContact CB-CG2 4.2Å; I293-T301 CarbonylContact O-C 3.55Å; I293-T301 WeakPolarHBondContact O-CA 3.5Å; V294-T301 HydrophobicContact CG2-CG2 4.17Å; T301-H347 HydrophobicContact CG2-CB 4.45Å
302	Y	93.6	Very high	90.9	Very high	26 Å²	26	45.5 Å²	45.5	10%	0.102	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	160.9	178.2	-59.3	-86.4	0	0	0	110.5	K292 I293 K300 A330 M332 E337	K292-Y302 CarbonylContact C-O 3.56Å; K292-Y302 WeakPolarHBondContact CA-O 2.97Å; I293-Y302 PolarHBondContact N-O 3.09Å; I293-Y302 PolarHBondContact O-N 2.9Å; K300-Y302 HydrophobicContact CB-CD2 4.41Å; K300-Y302 HydrophobicContact CB-CE2 3.56Å; K300-Y302 WeakPolarHBondContact CD-OH 3.42Å; K300-Y302 WeakPolarHBondContact O-CD2 3.4Å; Y302-A330 HydrophobicContact CG-CB 4.46Å; Y302-M332 HydrophobicContact CD1-CE 4.44Å; Y302-M332 HydrophobicContact CD1-CG 3.76Å; Y302-M332 HydrophobicContact CD2-CE 3.65Å; Y302-M332 HydrophobicContact CE1-CB 4.4Å; Y302-M332 HydrophobicContact CE1-CE 4.42Å; Y302-M332 HydrophobicContact CE1-CG 3.49Å; Y302-M332 VanDerWaalsContact CE1-CG 3.49Å; Y302-M332 HydrophobicContact CE2-CE 3.6Å; Y302-M332 HydrophobicContact CE2-CG 4.33Å; Y302-M332 HydrophobicContact CG-CE 4.08Å; Y302-M332 HydrophobicContact CG-CG 4.31Å; Y302-E337 WeakPolarHBondContact OH-CB 3.48Å
303	E	94.3	Very high	90.4	Very high	104 Å²	104	46.5 Å²	46.5	49%	0.486	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	131.4	176.4	-170	173.6	146.4	0	0	110.1	D291 N305 A330	D291-E303 WeakPolarHBondContact O-CA 3.42Å; E303-N305 PolarHBondContact O-N 3.44Å; E303-N305 PolarHBondContact O-ND2 3.24Å; E303-A330 CarbonylContact O-C 3.46Å; E303-A330 WeakPolarHBondContact O-CA 3.45Å
304	V	94.5	Very high	90.1	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.006	26%	0.256	C	S	.	.			trans	-76.4	96.1	-175	-178.9	0	0	0	0	110.5	V287 G290 D291 I293 L307 I328	V287-V304 HydrophobicContact CG2-CG2 4.02Å; G290-V304 PolarHBondContact N-O 3.24Å; D291-V304 PolarHBondContact O-N 3.26Å; I293-V304 HydrophobicContact CD1-CG2 3.8Å; I293-V304 HydrophobicContact CG1-CG2 3.93Å; I293-V304 HydrophobicContact CG2-CG2 3.85Å; V304-L307 HydrophobicContact CG1-CB 4.22Å; V304-L307 HydrophobicContact CG1-CD2 3.78Å; V304-I328 HydrophobicContact CG1-CG2 4.32Å; V304-I328 HydrophobicContact CG2-CG2 4.47Å
305	N	93.3	Very high	89.9	Confident	81 Å²	81	51.5 Å²	51.5	43%	0.433	26%	0.262	S	S	.	.			trans	-71.9	-39.1	179.1	-63.6	-62.8	0	0	0	111.9	K289 E303 I329 G331	K289-N305 WeakPolarHBondContact CD-O 3.5Å; K289-N305 WeakPolarHBondContact CE-O 3.46Å; K289-N305 PolarHBondContact NZ-O 2.61Å; E303-N305 PolarHBondContact O-N 3.44Å; E303-N305 PolarHBondContact O-ND2 3.24Å; N305-I329 WeakPolarHBondContact CB-O 3.37Å; N305-I329 PolarHBondContact N-O 2.69Å; N305-G331 PolarHBondContact ND2-N 3.32Å
306	E	93.4	Very high	89.9	Confident	52 Å²	52	54.1 Å²	54.1	24%	0.243	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	152.7	178.5	-162.4	176.9	112.6	0	0	110.3	R274 A316 Y327 I329	R274-E306 IonicContact NH1-OE1 2.71Å; E306-A316 HydrophobicContact CG-CB 4.09Å; E306-Y327 HydrophobicContact CG-CE2 4.26Å; E306-Y327 WeakPolarHBondContact OE1-CE2 3.46Å; E306-Y327 PolarHBondContact OE1-OH 3.35Å; E306-I329 HydrophobicContact CB-CB 4.14Å; E306-I329 HydrophobicContact CB-CD1 4.27Å; E306-I329 HydrophobicContact CB-CG1 4.33Å; E306-I329 PolarHBondContact N-O 2.9Å; E306-I329 PolarHBondContact O-N 2.86Å
307	L	94.3	Very high	89.9	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	157.4	172.8	65.2	93.4	0	0	0	108.9	V304 A316 T317 K319 L320 Y327 I328	V304-L307 HydrophobicContact CG1-CB 4.22Å; V304-L307 HydrophobicContact CG1-CD2 3.78Å; L307-A316 WeakPolarHBondContact O-CA 3.32Å; L307-T317 WeakPolarHBondContact CD1-OG1 3.33Å; L307-T317 PolarHBondContact O-N 2.87Å; L307-K319 VanDerWaalsContact CD1-C 3.48Å; L307-L320 HydrophobicContact CB-CD1 4.36Å; L307-L320 HydrophobicContact CD1-CB 4.46Å; L307-L320 HydrophobicContact CD1-CD1 4.15Å; L307-L320 HydrophobicContact CD1-CG 3.8Å; L307-Y327 CarbonylContact C-O 3.59Å; L307-Y327 WeakPolarHBondContact CA-O 3.26Å; L307-I328 HydrophobicContact CB-CG1 3.99Å
308	G	93.4	Very high	90	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.3	-174.7	178.4	0	0	0	0	0	115.1	H315 G326 Y327	G308-H315 VanDerWaalsContact CA-O 3.28Å; G308-H315 WeakPolarHBondContact CA-O 3.47Å; G308-G326 CarbonylContact O-C 3.58Å; G308-G326 WeakPolarHBondContact O-CA 3.31Å; G308-Y327 VanDerWaalsContact CA-CE1 3.45Å; G308-Y327 PolarHBondContact N-O 2.98Å; G308-Y327 WeakPolarHBondContact O-CD1 3.41Å; G308-Y327 PolarHBondContact O-N 2.93Å
309	L	91.8	Very high	90.3	Very high	1 Å²	1	56.4 Å²	56.4	1%	0.005	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	163.2	169.6	-62.7	-174.4	0	0	0	110.8	L67 F133 L142 R311 H315 L320 V325	L67-L309 HydrophobicContact CD1-CD1 4.19Å; L67-L309 HydrophobicContact CD1-CD2 4.18Å; L67-L309 HydrophobicContact CD1-CG 3.99Å; L67-L309 HydrophobicContact CD2-CD1 3.59Å; L67-L309 HydrophobicContact CD2-CG 4.3Å; F133-L309 HydrophobicContact CZ-CD1 4.15Å; L142-L309 HydrophobicContact CD1-CD1 4.48Å; L309-R311 HydrophobicContact CB-CG 4.2Å; L309-H315 PolarHBondContact N-O 3.15Å; L309-H315 PolarHBondContact O-N 2.81Å; L309-L320 HydrophobicContact CD2-CD2 3.78Å; L309-V325 WeakPolarHBondContact CD2-O 3.07Å
310	L	89.8	Confident	90.5	Very high	15 Å²	15	51.9 Å²	51.9	8%	0.079	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	115	172.6	-65.8	165.4	0	0	0	108.3	T129 A130 S131 E314 Y327	T129-L310 HydrophobicContact CG2-CD1 4.29Å; T129-L310 WeakPolarHBondContact O-CB 3.2Å; A130-L310 CarbonylContact C-O 3.48Å; A130-L310 WeakPolarHBondContact CA-O 3.44Å; S131-L310 PolarHBondContact N-O 3.32Å; L310-E314 HydrophobicContact CD2-CG 3.81Å; L310-Y327 HydrophobicContact CD2-CD1 4.06Å; L310-Y327 HydrophobicContact CG-CD1 4.29Å
311	R	86	Confident	90.6	Very high	61 Å²	61	48.8 Å²	48.8	23%	0.23	24%	0.242	C	C	.	.	S	Bend	trans	-140.2	76.9	-173.2	-62.7	-158.4	71.5	-132.1	-2.2	114.6	S131 F133 L309 E313	S131-R311 WeakPolarHBondContact O-CG 3.46Å; S131-R311 PolarHBondContact O-NE 3.4Å; F133-R311 VanDerWaalsContact CD2-CZ 3.42Å; L309-R311 HydrophobicContact CB-CG 4.2Å; R311-E313 PolarHBondContact N-O 2.86Å; R311-E313 PolarHBondContact O-N 3.04Å
312	P	77.4	Confident	90.6	Very high	17 Å²	17	45.5 Å²	45.5	11%	0.11	22%	0.222	C	C	.	.	S	Bend		-60.3	-7.7	-53	-4.8	22.3	0	0	0	113	L96 I102 L112	L96-P312 HydrophobicContact CD2-CG 4.21Å; I102-P312 HydrophobicContact CD1-CG 3.82Å; I102-P312 HydrophobicContact CG1-CG 3.89Å; L112-P312 HydrophobicContact CD2-CB 4.07Å
313	E	85.1	Confident	90.5	Very high	144 Å²	144	44.3 Å²	44.3	67%	0.673	22%	0.218	S	C	*	.	S	Bend	trans	-77	158.5	165.1	-63.4	-174.2	167.1	0	0	111	R311 H315	R311-E313 PolarHBondContact N-O 2.86Å; R311-E313 PolarHBondContact O-N 3.04Å; E313-H315 PolarHBondContact O-N 2.97Å
314	E	88.3	Confident	90.3	Very high	76 Å²	76	39.4 Å²	39.4	36%	0.355	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	124	176	-66.1	163.4	174.2	0	0	111.5	R274 L310 Y327	R274-E314 IonicContact CZ-OE1 3.94Å; R274-E314 IonicContact CZ-OE2 2.68Å; R274-E314 IonicContact NH1-OE1 3.71Å; R274-E314 IonicContact NH1-OE2 3.5Å; R274-E314 PolarHBondContact NH1-OE2 3.31Å; R274-E314 IonicContact NH2-OE1 2.71Å; R274-E314 PolarHBondContact NH2-OE1 3.1Å; R274-E314 IonicContact NH2-OE2 3.34Å; R274-E314 PolarHBondContact NH2-OE2 2.95Å; L310-E314 HydrophobicContact CD2-CG 3.81Å; E314-Y327 HydrophobicContact CB-CE1 3.84Å; E314-Y327 HydrophobicContact CG-CD1 4.46Å; E314-Y327 HydrophobicContact CG-CE1 4.14Å
315	H	88.6	Confident	90.3	Very high	36 Å²	36	39.4 Å²	39.4	17%	0.167	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	92.5	176.7	-168.6	107.9	0	0	0	109.3	G308 L309 E313	G308-H315 VanDerWaalsContact CA-O 3.28Å; G308-H315 WeakPolarHBondContact CA-O 3.47Å; L309-H315 PolarHBondContact N-O 3.15Å; L309-H315 PolarHBondContact O-N 2.81Å; E313-H315 PolarHBondContact O-N 2.97Å
316	A	90.9	Very high	90.3	Very high	55 Å²	55	35.6 Å²	35.6	46%	0.455	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	134.7	-179.9	0	0	0	0	0	112.2	E306 L307 Y327	E306-A316 HydrophobicContact CG-CB 4.09Å; L307-A316 WeakPolarHBondContact O-CA 3.32Å; A316-Y327 WeakPolarHBondContact CA-OH 3.41Å; A316-Y327 PolarHBondContact N-OH 3.24Å
317	T	90.4	Very high	90.3	Very high	15 Å²	15	33.2 Å²	33.2	9%	0.092	16%	0.164	C	C	.	.			trans	-126.9	175.3	176.9	69.6	0	0	0	0	110.8	L67 L307 K319	L67-T317 HydrophobicContact CD1-CG2 3.91Å; L67-T317 HydrophobicContact CG-CG2 4.34Å; L307-T317 WeakPolarHBondContact CD1-OG1 3.33Å; L307-T317 PolarHBondContact O-N 2.87Å; T317-K319 PolarHBondContact OG1-O 2.85Å
318	Q	88.4	Confident	90.3	Very high	141 Å²	141	33.3 Å²	33.3	66%	0.659	16%	0.164	S	C	*	.	S	Bend	trans	-89.6	-25.7	-179	-62.5	-59.2	-40.4	0	0	113.3	K288 K289	K288-Q318 WeakPolarHBondContact CA-O 3.31Å; K289-Q318 PolarHBondContact N-O 3.4Å
319	K	91.9	Very high	90.3	Very high	100 Å²	100	33.6 Å²	33.6	44%	0.435	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	151.2	-177.3	-54.6	-175.4	-177.6	170.3	0	111	V287 K288 L307 T317 F321	V287-K319 CarbonylContact O-C 3.35Å; V287-K319 WeakPolarHBondContact O-CA 3.22Å; K288-K319 HydrophobicContact CB-CG 3.99Å; L307-K319 VanDerWaalsContact CD1-C 3.48Å; T317-K319 PolarHBondContact OG1-O 2.85Å; K319-F321 HydrophobicContact CB-CE2 4.04Å; K319-F321 HydrophobicContact CB-CZ 4.08Å; K319-F321 HydrophobicContact CD-CE1 4.42Å; K319-F321 HydrophobicContact CD-CZ 3.98Å
320	L	92.7	Very high	90.3	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	146.8	160.1	-73.6	164.9	0	0	0	108.9	L67 I280 V282 R286 V287 L307 L309 Q324	L67-L320 HydrophobicContact CD1-CD2 3.96Å; I280-L320 HydrophobicContact CD1-CD1 4.17Å; V282-L320 HydrophobicContact CG2-CB 4.1Å; R286-L320 WeakPolarHBondContact CA-O 3.41Å; V287-L320 HydrophobicContact CG1-CB 4.06Å; V287-L320 PolarHBondContact N-O 2.91Å; V287-L320 PolarHBondContact O-N 2.9Å; L307-L320 HydrophobicContact CB-CD1 4.36Å; L307-L320 HydrophobicContact CD1-CB 4.46Å; L307-L320 HydrophobicContact CD1-CD1 4.15Å; L307-L320 HydrophobicContact CD1-CG 3.8Å; L309-L320 HydrophobicContact CD2-CD2 3.78Å; L320-Q324 HydrophobicContact CD2-CB 4.24Å
321	F	93	Very high	90	Very high	29 Å²	29	34.8 Å²	34.8	13%	0.127	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	164.2	-175.5	-59.5	-87.8	0	0	0	111.6	L67 V257 V282 R286 K319 Q324	L67-F321 HydrophobicContact CB-CD2 4.14Å; L67-F321 HydrophobicContact CB-CE2 4.11Å; V257-F321 HydrophobicContact CG1-CD1 3.81Å; V257-F321 HydrophobicContact CG1-CE1 4.4Å; V257-F321 HydrophobicContact CG2-CB 4.29Å; V257-F321 HydrophobicContact CG2-CD1 4.43Å; V282-F321 WeakPolarHBondContact CB-O 3.38Å; R286-F321 HydrophobicContact CB-CD1 4.07Å; K319-F321 HydrophobicContact CB-CE2 4.04Å; K319-F321 HydrophobicContact CB-CZ 4.08Å; K319-F321 HydrophobicContact CD-CE1 4.42Å; K319-F321 HydrophobicContact CD-CZ 3.98Å; F321-Q324 HydrophobicContact CB-CG 4.45Å; F321-Q324 VanDerWaalsContact O-CB 3.23Å; F321-Q324 WeakPolarHBondContact O-CB 3.08Å; F321-Q324 WeakPolarHBondContact O-CG 3.49Å; F321-Q324 PolarHBondContact O-N 3.4Å
322	A	92.6	Very high	90	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.008	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-46.5	139.9	173.9	0	0	0	0	0	113.2	V72 S256 V257 G285 Q324	V72-A322 HydrophobicContact CG2-CB 4.15Å; S256-A322 WeakPolarHBondContact O-CB 3.48Å; V257-A322 HydrophobicContact CG2-CB 4.34Å; G285-A322 PolarHBondContact O-N 3.04Å; A322-Q324 PolarHBondContact O-N 3.23Å
323	G	89.7	Confident	90.2	Very high	2 Å²	2	39 Å²	39	2%	0.021	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.3	-17.9	-173.6	0	0	0	0	0	115.4	I75 N77 V282	I75-G323 WeakPolarHBondContact CG2-O 3.46Å; N77-G323 PolarHBondContact ND2-O 3.4Å; N77-G323 PolarHBondContact OD1-O 2.98Å; V282-G323 WeakPolarHBondContact O-CA 3.41Å; V282-G323 PolarHBondContact O-N 3.13Å
324	Q	91.9	Very high	89.7	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.191	C	C	.	.			trans	-81.9	139.8	-174.4	-58.5	178.6	-10.4	0	0	111.8	L67 F70 I75 L142 V282 L320 F321 A322	L67-Q324 PolarHBondContact O-NE2 2.95Å; F70-Q324 PolarHBondContact O-NE2 3.45Å; I75-Q324 HydrophobicContact CD1-CG 3.51Å; L142-Q324 HydrophobicContact CD2-CG 4.05Å; V282-Q324 PolarHBondContact N-O 3.37Å; L320-Q324 HydrophobicContact CD2-CB 4.24Å; F321-Q324 HydrophobicContact CB-CG 4.45Å; F321-Q324 VanDerWaalsContact O-CB 3.23Å; F321-Q324 WeakPolarHBondContact O-CB 3.08Å; F321-Q324 WeakPolarHBondContact O-CG 3.49Å; F321-Q324 PolarHBondContact O-N 3.4Å; A322-Q324 PolarHBondContact O-N 3.23Å
325	V	93.2	Very high	88.8	Confident	1 Å²	1	33.3 Å²	33.3	1%	0.006	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	136.1	172.8	-174.1	0	0	0	0	108.9	N77 T129 N144 F266 I280 A281 L309	N77-V325 HydrophobicContact CB-CG2 4.35Å; N77-V325 WeakPolarHBondContact OD1-CG2 3.41Å; T129-V325 HydrophobicContact CG2-CG1 3.82Å; N144-V325 HydrophobicContact CB-CB 3.96Å; N144-V325 HydrophobicContact CB-CG2 4.01Å; N144-V325 PolarHBondContact ND2-N 3.04Å; F266-V325 HydrophobicContact CE1-CG1 3.67Å; F266-V325 HydrophobicContact CZ-CG1 3.74Å; I280-V325 WeakPolarHBondContact O-CA 3.45Å; A281-V325 HydrophobicContact CB-CG2 4.2Å; L309-V325 WeakPolarHBondContact CD2-O 3.07Å
326	G	93.4	Very high	88.1	Confident	1 Å²	1	39.4 Å²	39.4	1%	0.01	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.3	-164.2	-176.2	0	0	0	0	0	113	I280 G308	I280-G326 PolarHBondContact N-O 2.84Å; I280-G326 PolarHBondContact O-N 3.01Å; G308-G326 CarbonylContact O-C 3.58Å; G308-G326 WeakPolarHBondContact O-CA 3.31Å
327	Y	94.3	Very high	87.6	Confident	2 Å²	2	38.1 Å²	38.1	1%	0.008	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	153.3	175.8	75.9	-88.3	0	0	0	111.9	V277 A278 E306 L307 G308 L310 E314 A316 I329	V277-Y327 HydrophobicContact CG1-CD2 3.93Å; V277-Y327 HydrophobicContact CG1-CG 4.27Å; A278-Y327 CarbonylContact O-C 3.58Å; A278-Y327 WeakPolarHBondContact O-CA 3.36Å; E306-Y327 HydrophobicContact CG-CE2 4.26Å; E306-Y327 WeakPolarHBondContact OE1-CE2 3.46Å; E306-Y327 PolarHBondContact OE1-OH 3.35Å; L307-Y327 CarbonylContact C-O 3.59Å; L307-Y327 WeakPolarHBondContact CA-O 3.26Å; G308-Y327 VanDerWaalsContact CA-CE1 3.45Å; G308-Y327 PolarHBondContact N-O 2.98Å; G308-Y327 WeakPolarHBondContact O-CD1 3.41Å; G308-Y327 PolarHBondContact O-N 2.93Å; L310-Y327 HydrophobicContact CD2-CD1 4.06Å; L310-Y327 HydrophobicContact CG-CD1 4.29Å; E314-Y327 HydrophobicContact CB-CE1 3.84Å; E314-Y327 HydrophobicContact CG-CD1 4.46Å; E314-Y327 HydrophobicContact CG-CE1 4.14Å; A316-Y327 WeakPolarHBondContact CA-OH 3.41Å; A316-Y327 PolarHBondContact N-OH 3.24Å; Y327-I329 HydrophobicContact CD2-CD1 4.31Å; Y327-I329 HydrophobicContact CD2-CG1 3.98Å; Y327-I329 HydrophobicContact CE2-CD1 3.98Å; Y327-I329 HydrophobicContact CE2-CG1 4.06Å
328	I	94.3	Very high	87	Confident	2 Å²	2	37.5 Å²	37.5	1%	0.01	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	140.5	170.7	-75	-176	0	0	0	109.9	A278 I280 V287 I293 V304 L307 A330	A278-I328 PolarHBondContact N-O 2.84Å; A278-I328 PolarHBondContact O-N 2.92Å; I280-I328 HydrophobicContact CD1-CD1 3.45Å; I280-I328 VanDerWaalsContact CD1-CD1 3.45Å; I280-I328 HydrophobicContact CD1-CG1 3.8Å; I280-I328 HydrophobicContact CG1-CD1 4.19Å; I280-I328 HydrophobicContact CG1-CG1 4.09Å; V287-I328 HydrophobicContact CG1-CD1 4.16Å; V287-I328 HydrophobicContact CG2-CD1 4.42Å; I293-I328 HydrophobicContact CD1-CG2 4.29Å; V304-I328 HydrophobicContact CG1-CG2 4.32Å; V304-I328 HydrophobicContact CG2-CG2 4.47Å; L307-I328 HydrophobicContact CB-CG1 3.99Å; I328-A330 HydrophobicContact CG2-CB 4.06Å
329	I	93.6	Very high	86.6	Confident	7 Å²	7	34.3 Å²	34.3	4%	0.036	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	106.3	170.7	-51.2	-175.7	0	0	0	108	R274 V277 N305 E306 Y327	R274-I329 HydrophobicContact CB-CD1 4.2Å; R274-I329 HydrophobicContact CB-CG2 4.17Å; R274-I329 WeakPolarHBondContact O-CG2 3.44Å; V277-I329 HydrophobicContact CG1-CG1 4.29Å; V277-I329 HydrophobicContact CG2-CD1 4Å; V277-I329 HydrophobicContact CG2-CG1 4.12Å; N305-I329 WeakPolarHBondContact CB-O 3.37Å; N305-I329 PolarHBondContact N-O 2.69Å; E306-I329 HydrophobicContact CB-CB 4.14Å; E306-I329 HydrophobicContact CB-CD1 4.27Å; E306-I329 HydrophobicContact CB-CG1 4.33Å; E306-I329 PolarHBondContact N-O 2.9Å; E306-I329 PolarHBondContact O-N 2.86Å; Y327-I329 HydrophobicContact CD2-CD1 4.31Å; Y327-I329 HydrophobicContact CD2-CG1 3.98Å; Y327-I329 HydrophobicContact CE2-CD1 3.98Å; Y327-I329 HydrophobicContact CE2-CG1 4.06Å
330	A	89.8	Confident	86.4	Confident	6 Å²	6	30.4 Å²	30.4	5%	0.05	15%	0.152	C	C	.	.			trans	-112.1	13.9	-172.4	0	0	0	0	0	114.2	I293 Y302 E303 I328 M332	I293-A330 HydrophobicContact CD1-CB 4.09Å; Y302-A330 HydrophobicContact CG-CB 4.46Å; E303-A330 CarbonylContact O-C 3.46Å; E303-A330 WeakPolarHBondContact O-CA 3.45Å; I328-A330 HydrophobicContact CG2-CB 4.06Å; A330-M332 VanDerWaalsContact C-N 3.28Å; A330-M332 PolarHBondContact O-N 2.9Å
331	G	85.3	Confident	86.1	Confident	34 Å²	34	30.8 Å²	30.8	35%	0.351	16%	0.157	S	C	.	.			trans	76.5	9.9	179.6	0	0	0	0	0	115.2	N305	N305-G331 PolarHBondContact ND2-N 3.32Å
332	M	85.9	Confident	85.9	Confident	6 Å²	6	29.7 Å²	29.7	3%	0.03	15%	0.152	C	C	.	.			trans	-54.9	132.2	168.8	-69.8	162.1	174.2	0	0	110.2	G275 V276 Y302 A330 E337 A338 L344	G275-M332 WeakPolarHBondContact CA-O 3.35Å; V276-M332 HydrophobicContact CB-CB 3.99Å; V276-M332 HydrophobicContact CG2-CB 3.9Å; V276-M332 PolarHBondContact N-O 2.82Å; Y302-M332 HydrophobicContact CD1-CE 4.44Å; Y302-M332 HydrophobicContact CD1-CG 3.76Å; Y302-M332 HydrophobicContact CD2-CE 3.65Å; Y302-M332 HydrophobicContact CE1-CB 4.4Å; Y302-M332 HydrophobicContact CE1-CE 4.42Å; Y302-M332 HydrophobicContact CE1-CG 3.49Å; Y302-M332 VanDerWaalsContact CE1-CG 3.49Å; Y302-M332 HydrophobicContact CE2-CE 3.6Å; Y302-M332 HydrophobicContact CE2-CG 4.33Å; Y302-M332 HydrophobicContact CG-CE 4.08Å; Y302-M332 HydrophobicContact CG-CG 4.31Å; A330-M332 VanDerWaalsContact C-N 3.28Å; A330-M332 PolarHBondContact O-N 2.9Å; M332-E337 WeakPolarHBondContact CA-OE2 3.19Å; M332-E337 HydrophobicContact CB-CB 4.19Å; M332-E337 HydrophobicContact CG-CB 4.16Å; M332-A338 HydrophobicContact SD-CB 3.9Å; M332-L344 HydrophobicContact CE-CD2 4.32Å
333	K	81.1	Confident	85.9	Confident	161 Å²	161	29.7 Å²	29.7	70%	0.7	15%	0.152	S	C	*	.			trans	-101	-33.7	-171.2	-70	-177	-179.9	175.9	0	114.2	F270 E337	F270-K333 WeakPolarHBondContact CE2-O 3.37Å; K333-E337 PolarHBondContact N-OE2 3.42Å
334	D	73.6	Confident	86	Confident	91 Å²	91	29.7 Å²	29.7	49%	0.487	15%	0.151	S	C	.	.	S	Bend	trans	-113.3	140.8	175.8	-63	-63.2	0	0	0	108.8	K336 E337	D334-K336 HydrophobicContact CB-CB 4.39Å; D334-K336 PolarHBondContact O-N 2.84Å; D334-K336 VanDerWaalsContact O-N 3.08Å; D334-E337 HydrophobicContact CB-CG 4.42Å; D334-E337 VanDerWaalsContact O-CB 3.26Å; D334-E337 WeakPolarHBondContact O-CB 3.49Å; D334-E337 PolarHBondContact O-N 2.89Å
335	V	69.9	Low	86.2	Confident	9 Å²	9	31.3 Å²	31.3	6%	0.055	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-62.5	-20	175.1	-179.7	0	0	0	0	112	S268 F270 V276 E337 A338 L388	S268-V335 WeakPolarHBondContact OG-CG1 3.3Å; F270-V335 HydrophobicContact CB-CG2 3.9Å; F270-V335 HydrophobicContact CD2-CG2 4.15Å; F270-V335 HydrophobicContact CG-CG2 4.38Å; V276-V335 HydrophobicContact CG1-CG2 4.12Å; V276-V335 HydrophobicContact CG2-CB 4.43Å; V276-V335 HydrophobicContact CG2-CG2 3.87Å; V335-E337 PolarHBondContact O-N 2.76Å; V335-E337 VanDerWaalsContact O-N 3.16Å; V335-A338 CarbonylContact O-C 3.55Å; V335-A338 PolarHBondContact O-N 3.16Å; V335-L388 HydrophobicContact CB-CB 4.37Å; V335-L388 HydrophobicContact CB-CD2 4.09Å; V335-L388 WeakPolarHBondContact CB-O 3.49Å; V335-L388 VanDerWaalsContact CG1-O 3.31Å; V335-L388 WeakPolarHBondContact CG1-O 3.44Å; V335-L388 HydrophobicContact CG2-CB 3.9Å; V335-L388 HydrophobicContact CG2-CD2 4.18Å; V335-L388 WeakPolarHBondContact CG2-O 3.2Å
336	K	74.5	Confident	86.2	Confident	164 Å²	164	32.8 Å²	32.8	71%	0.713	17%	0.165	S	C	*	.	G	3₁₀ helix	trans	-61.5	-17.9	168.9	-63.9	-179.2	-179.3	176.9	0	114	D334 Q339	D334-K336 HydrophobicContact CB-CB 4.39Å; D334-K336 PolarHBondContact O-N 2.84Å; D334-K336 VanDerWaalsContact O-N 3.08Å; K336-Q339 PolarHBondContact O-NE2 2.68Å
337	E	79.7	Confident	86	Confident	28 Å²	28	37.3 Å²	37.3	13%	0.131	19%	0.185	C	C	.	.	G	3₁₀ helix	trans	-81.8	-25.1	171.7	-63.5	-164.5	133.3	0	0	113.3	L298 K300 Y302 M332 K333 D334 V335	L298-E337 HydrophobicContact CD1-CB 4.37Å; K300-E337 IonicContact NZ-OE1 2.79Å; K300-E337 PolarHBondContact NZ-OE1 2.67Å; Y302-E337 WeakPolarHBondContact OH-CB 3.48Å; M332-E337 WeakPolarHBondContact CA-OE2 3.19Å; M332-E337 HydrophobicContact CB-CB 4.19Å; M332-E337 HydrophobicContact CG-CB 4.16Å; K333-E337 PolarHBondContact N-OE2 3.42Å; D334-E337 HydrophobicContact CB-CG 4.42Å; D334-E337 VanDerWaalsContact O-CB 3.26Å; D334-E337 WeakPolarHBondContact O-CB 3.49Å; D334-E337 PolarHBondContact O-N 2.89Å; V335-E337 PolarHBondContact O-N 2.76Å; V335-E337 VanDerWaalsContact O-N 3.16Å
338	A	78.4	Confident	85.7	Confident	2 Å²	2	43 Å²	43	2%	0.017	22%	0.216	C	C	.	.	S	Bend	trans	-102.7	67.1	174.4	0	0	0	0	0	109.7	V276 M332 V335 I340	V276-A338 HydrophobicContact CB-CB 4.38Å; V276-A338 HydrophobicContact CG1-CB 3.69Å; M332-A338 HydrophobicContact SD-CB 3.9Å; V335-A338 CarbonylContact O-C 3.55Å; V335-A338 PolarHBondContact O-N 3.16Å; A338-I340 PolarHBondContact O-N 2.78Å
339	Q	80.4	Confident	85.4	Confident	74 Å²	74	48.4 Å²	48.4	35%	0.346	24%	0.241	S	C	.	.			trans	-56.8	125.4	175.1	-74.8	-70.8	-33.2	0	0	109.9	K336 G341 D342	K336-Q339 PolarHBondContact O-NE2 2.68Å; Q339-G341 PolarHBondContact O-N 2.88Å; Q339-D342 HydrophobicContact CB-CB 4.14Å; Q339-D342 WeakPolarHBondContact O-CB 3.43Å; Q339-D342 PolarHBondContact O-N 2.87Å
340	I	86.4	Confident	85.1	Confident	18 Å²	18	53 Å²	53	9%	0.092	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	127	176.1	-52.8	176	0	0	0	107.5	R160 F266 A338 F357 S391	R160-I340 HydrophobicContact CG-CG2 4.06Å; F266-I340 VanDerWaalsContact O-CG2 3.26Å; F266-I340 WeakPolarHBondContact O-CG2 3.46Å; A338-I340 PolarHBondContact O-N 2.78Å; I340-F357 HydrophobicContact CG2-CD2 3.8Å; I340-F357 HydrophobicContact CG2-CE2 3.67Å; I340-S391 WeakPolarHBondContact CD1-OG 3.37Å
341	G	86.4	Confident	85	Confident	9 Å²	9	54.2 Å²	54.2	9%	0.093	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	95.6	-1.5	-169.5	0	0	0	0	0	114	V265 Q339 F357	V265-G341 PolarHBondContact O-N 3.34Å; Q339-G341 PolarHBondContact O-N 2.88Å; G341-F357 VanDerWaalsContact CA-CE2 3.42Å; G341-F357 VanDerWaalsContact N-CD2 3.35Å
342	D	89.1	Confident	85	Confident	6 Å²	6	60.8 Å²	60.8	3%	0.032	30%	0.299	C	S	.	.			trans	-68.7	152.6	171.5	-168.2	22.1	0	0	0	111.7	V265 S295 A296 H297 Q339	V265-D342 PolarHBondContact N-O 3.5Å; S295-D342 WeakPolarHBondContact CA-OD2 3.47Å; S295-D342 WeakPolarHBondContact CB-OD2 3.28Å; S295-D342 PolarHBondContact OG-OD2 2.88Å; A296-D342 PolarHBondContact N-OD1 2.93Å; A296-D342 VanDerWaalsContact N-OD1 3.1Å; H297-D342 HydrophobicContact CB-CB 4.32Å; H297-D342 WeakPolarHBondContact CB-OD1 3.45Å; H297-D342 PolarHBondContact N-OD1 2.95Å; Q339-D342 HydrophobicContact CB-CB 4.14Å; Q339-D342 WeakPolarHBondContact O-CB 3.43Å; Q339-D342 PolarHBondContact O-N 2.87Å
343	T	92.4	Very high	85.1	Confident	1 Å²	1	63 Å²	63	1%	0.006	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	119.3	176.2	-54.6	0	0	0	0	109.4	K262 A263 A296 V351 L354	K262-T343 HydrophobicContact CD-CG2 4.45Å; K262-T343 HydrophobicContact CG-CG2 3.74Å; A263-T343 WeakPolarHBondContact O-CA 3.48Å; A296-T343 WeakPolarHBondContact CB-O 3.35Å; A296-T343 PolarHBondContact N-O 2.97Å; T343-V351 HydrophobicContact CG2-CG2 4.27Å; T343-L354 HydrophobicContact CG2-CD1 4.45Å; T343-L354 HydrophobicContact CG2-CG 4.32Å; T343-L354 WeakPolarHBondContact OG1-CB 3.34Å; T343-L354 PolarHBondContact OG1-N 3.09Å
344	L	93.1	Very high	85.3	Confident	2 Å²	2	57.1 Å²	57.1	1%	0.01	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	132.5	173.5	-58.5	174.8	0	0	0	109.7	F261 K262 A263 V265 I280 I293 V294 M332	F261-L344 HydrophobicContact CE1-CB 4.38Å; K262-L344 WeakPolarHBondContact CA-O 3.43Å; A263-L344 PolarHBondContact N-O 2.87Å; A263-L344 PolarHBondContact O-N 2.71Å; V265-L344 HydrophobicContact CG2-CD1 3.73Å; V265-L344 HydrophobicContact CG2-CG 3.87Å; I280-L344 HydrophobicContact CG2-CD1 4.04Å; I293-L344 HydrophobicContact CD1-CD1 4.13Å; I293-L344 HydrophobicContact CD1-CD2 4.37Å; V294-L344 WeakPolarHBondContact O-CA 3.14Å; M332-L344 HydrophobicContact CE-CD2 4.32Å
345	Y	94.3	Very high	85.6	Confident	33 Å²	33	58.5 Å²	58.5	13%	0.129	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	166.4	179.4	65.1	-88.7	0	0	0	111.7	F261 I293 V294 A296 P350 V351	F261-Y345 VanDerWaalsContact O-CA 3.28Å; F261-Y345 WeakPolarHBondContact O-CA 3.31Å; F261-Y345 VanDerWaalsContact O-CB 3.28Å; F261-Y345 WeakPolarHBondContact O-CB 3.39Å; I293-Y345 CarbonylContact C-O 3.59Å; I293-Y345 WeakPolarHBondContact CA-O 3.27Å; V294-Y345 HydrophobicContact CB-CD2 4.38Å; V294-Y345 HydrophobicContact CB-CE1 4.04Å; V294-Y345 HydrophobicContact CB-CE2 3.84Å; V294-Y345 HydrophobicContact CG1-CE1 4.02Å; V294-Y345 HydrophobicContact CG1-CE2 4.21Å; V294-Y345 WeakPolarHBondContact CG1-OH 3.45Å; V294-Y345 HydrophobicContact CG2-CE2 4.43Å; V294-Y345 PolarHBondContact N-O 3.45Å; V294-Y345 WeakPolarHBondContact O-CD1 3.42Å; V294-Y345 PolarHBondContact O-N 2.67Å; A296-Y345 HydrophobicContact CB-CD1 4.35Å; A296-Y345 HydrophobicContact CB-CE1 3.96Å; Y345-P350 HydrophobicContact CE2-CB 3.98Å; Y345-V351 HydrophobicContact CD1-CG2 4.18Å; Y345-V351 HydrophobicContact CG-CG2 3.93Å
346	H	94	Very high	85.8	Confident	33 Å²	33	60.4 Å²	60.4	15%	0.153	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	135.4	179.3	-77.3	-35.7	0	0	0	112	F261 R286 D291 D348 H349	F261-H346 WeakPolarHBondContact CB-CD2 3.26Å; F261-H346 WeakPolarHBondContact CB-NE2 3.39Å; F261-H346 AromaticContact CD1-CE1 3.7Å; F261-H346 AromaticContact CD1-ND1 3.82Å; F261-H346 AromaticContact CD1-NE2 3.92Å; F261-H346 AromaticContact CG-CE1 3.98Å; F261-H346 AromaticContact CG-NE2 3.74Å; R286-H346 PolarHBondContact O-NE2 2.83Å; D291-H346 VanDerWaalsContact CG-CE1 3.49Å; D291-H346 IonicContact OD2-CE1 3.72Å; D291-H346 PolarHBondContact OD2-CE1 2.85Å; D291-H346 IonicContact OD2-NE2 2.87Å; H346-D348 PolarHBondContact O-N 3.45Å; H346-D348 VanDerWaalsContact O-N 3.07Å; H346-H349 HydrophobicContact CB-CB 4.5Å; H346-H349 CarbonylContact O-C 3.6Å; H346-H349 PolarHBondContact O-N 3.2Å
347	H	90.2	Very high	85.8	Confident	96 Å²	96	54.6 Å²	54.6	44%	0.444	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.8	-42.4	179.5	172.2	-85.8	0	0	0	113.6	K292 V294 T301 H349	K292-H347 HydrophobicContact CB-CB 4.11Å; K292-H347 WeakPolarHBondContact O-CB 3.47Å; K292-H347 PolarHBondContact O-N 3.32Å; V294-H347 HydrophobicContact CG2-CB 3.89Å; T301-H347 HydrophobicContact CG2-CB 4.45Å; H347-H349 VanDerWaalsContact C-N 3.33Å; H347-H349 PolarHBondContact O-N 3.17Å
348	D	87.3	Confident	85.4	Confident	122 Å²	122	62.2 Å²	62.2	65%	0.652	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-8.3	-174.7	-49.3	-37.6	0	0	0	113.5	H346	H346-D348 PolarHBondContact O-N 3.45Å; H346-D348 VanDerWaalsContact O-N 3.07Å
349	H	87.4	Confident	85.1	Confident	115 Å²	115	67.1 Å²	67.1	53%	0.532	37%	0.369	S	S	.	.	S	Bend	trans	-136.3	79.1	-174.6	-65.1	84.5	0	0	0	110.6	H346 H347	H346-H349 HydrophobicContact CB-CB 4.5Å; H346-H349 CarbonylContact O-C 3.6Å; H346-H349 PolarHBondContact O-N 3.2Å; H347-H349 VanDerWaalsContact C-N 3.33Å; H347-H349 PolarHBondContact O-N 3.17Å
350	P	86.9	Confident	85.1	Confident	103 Å²	103	64.9 Å²	64.9	67%	0.669	36%	0.363	S	S	*	.			trans	-64.7	137.4	179.2	26.7	-34.4	0	0	0	112.4	Y345	Y345-P350 HydrophobicContact CE2-CB 3.98Å
351	V	88.3	Confident	84.8	Confident	32 Å²	32	70.4 Å²	70.4	19%	0.194	39%	0.386	C	S	.	.			trans	-121	154.7	179.5	-53.7	0	0	0	0	110.9	P260 K262 T343 Y345 A353	P260-V351 HydrophobicContact CB-CG1 3.63Å; K262-V351 HydrophobicContact CB-CG2 4.37Å; K262-V351 HydrophobicContact CD-CB 4.38Å; K262-V351 HydrophobicContact CD-CG2 3.99Å; K262-V351 HydrophobicContact CG-CG2 4.06Å; T343-V351 HydrophobicContact CG2-CG2 4.27Å; Y345-V351 HydrophobicContact CD1-CG2 4.18Å; Y345-V351 HydrophobicContact CG-CG2 3.93Å; V351-A353 PolarHBondContact O-N 3.44Å
352	Q	86.1	Confident	84.8	Confident	172 Å²	172	70.7 Å²	70.7	80%	0.804	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-62.8	130.5	165.6	-174.3	179.9	4.4	0	0	109.3	K262	K262-Q352 VanDerWaalsContact CE-O 3.26Å; K262-Q352 WeakPolarHBondContact CE-O 3.35Å; K262-Q352 PolarHBondContact NZ-O 2.79Å
353	A	87.4	Confident	84.6	Confident	52 Å²	52	72.1 Å²	72.1	43%	0.43	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-58.3	156.9	177	0	0	0	0	0	112.5	A296 V351	A296-A353 HydrophobicContact CB-CB 4.08Å; V351-A353 PolarHBondContact O-N 3.44Å
354	L	84.9	Confident	84.4	Confident	38 Å²	38	72.1 Å²	72.1	20%	0.199	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-72.8	159.7	166.6	-68.6	168.1	0	0	0	110.6	K262 L264 I283 T343 G356	K262-L354 VanDerWaalsContact CE-CD2 3.4Å; K262-L354 VanDerWaalsContact CE-CG 3.45Å; L264-L354 HydrophobicContact CB-CD1 3.6Å; L264-L354 HydrophobicContact CD1-CB 4.48Å; L264-L354 HydrophobicContact CD1-CD1 3.86Å; L264-L354 HydrophobicContact CG-CD1 4.2Å; I283-L354 HydrophobicContact CG1-CD1 3.98Å; T343-L354 HydrophobicContact CG2-CD1 4.45Å; T343-L354 HydrophobicContact CG2-CG 4.32Å; T343-L354 WeakPolarHBondContact OG1-CB 3.34Å; T343-L354 PolarHBondContact OG1-N 3.09Å; L354-G356 PolarHBondContact O-N 2.95Å
355	P	80.3	Confident	84.3	Confident	120 Å²	120	72.7 Å²	72.7	78%	0.779	40%	0.397	S	S	*	.			trans	-61.7	107.2	164.2	27.1	-33.8	0	0	0	109.5
356	G	73.9	Confident	84	Confident	48 Å²	48	71.1 Å²	71.1	50%	0.495	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-70.6	163.5	176.2	0	0	0	0	0	112.8	L354	L354-G356 PolarHBondContact O-N 2.95Å
357	F	74.1	Confident	83.8	Confident	43 Å²	43	69.6 Å²	69.6	19%	0.189	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-69.1	150.7	-179.3	-56.5	-68.3	0	0	0	112.8	Y156 R160 S163 L264 I340 G341	Y156-F357 HydrophobicContact CE2-CB 4.48Å; R160-F357 HydrophobicContact CB-CE1 4.48Å; R160-F357 HydrophobicContact CB-CZ 4.31Å; R160-F357 HydrophobicContact CG-CD1 4.28Å; R160-F357 HydrophobicContact CG-CD2 4.09Å; R160-F357 HydrophobicContact CG-CE1 4.23Å; R160-F357 HydrophobicContact CG-CE2 4.04Å; R160-F357 HydrophobicContact CG-CG 4.22Å; R160-F357 HydrophobicContact CG-CZ 4.11Å; S163-F357 VanDerWaalsContact OG-CE1 3.23Å; S163-F357 WeakPolarHBondContact OG-CE1 3.18Å; S163-F357 WeakPolarHBondContact OG-CZ 3.08Å; L264-F357 HydrophobicContact CD2-CZ 4.38Å; I340-F357 HydrophobicContact CG2-CD2 3.8Å; I340-F357 HydrophobicContact CG2-CE2 3.67Å; G341-F357 VanDerWaalsContact CA-CE2 3.42Å; G341-F357 VanDerWaalsContact N-CD2 3.35Å
358	K	72.8	Confident	83.8	Confident	187 Å²	187	65 Å²	65	81%	0.813	36%	0.362	S	S	*	.	P	Polyproline II helix	trans	-65.5	131.4	162.9	-64.3	170.5	-174.9	166.5	0	107.8	Y156	Y156-K358 WeakPolarHBondContact CE2-O 3.46Å
359	P	72.1	Confident	83.9	Confident	106 Å²	106	59.5 Å²	59.5	69%	0.688	33%	0.333	S	S	*	.	P	Polyproline II helix	trans	-64.3	144.9	-178.9	26.5	-34.8	0	0	0	111.3	K361	P359-K361 PolarHBondContact O-N 2.97Å
360	A	78.9	Confident	84	Confident	26 Å²	26	54.1 Å²	54.1	22%	0.215	31%	0.308	C	S	.	.	P	Polyproline II helix	trans	-53.2	122.8	174.2	0	0	0	0	0	111.3	Y156 L412	Y156-A360 HydrophobicContact CD1-CB 3.98Å; Y156-A360 HydrophobicContact CE1-CB 3.93Å; Y156-A360 HydrophobicContact CE2-CB 4.48Å; Y156-A360 HydrophobicContact CG-CB 4.29Å; A360-L412 HydrophobicContact CB-CD2 4.13Å
361	K	81.2	Confident	83.9	Confident	135 Å²	135	53 Å²	53	59%	0.587	30%	0.295	S	S	*	.			trans	-96.5	112.6	173.9	-69.5	-177.1	179.2	179.3	0	109.1	P359 M363	P359-K361 PolarHBondContact O-N 2.97Å; K361-M363 HydrophobicContact CB-CE 4.18Å; K361-M363 PolarHBondContact O-N 3.34Å
362	A	85.4	Confident	83.8	Confident	14 Å²	14	55.4 Å²	55.4	12%	0.116	31%	0.306	C	S	.	.			trans	-64.5	122.6	172.6	0	0	0	0	0	110.6	F365 T394 F411	A362-F365 HydrophobicContact CB-CE1 4.17Å; A362-F365 HydrophobicContact CB-CE2 3.9Å; A362-F365 HydrophobicContact CB-CZ 3.58Å; A362-F365 WeakPolarHBondContact O-CE2 3.36Å; A362-T394 HydrophobicContact CB-CG2 4.17Å; A362-F411 CarbonylContact C-O 3.47Å; A362-F411 WeakPolarHBondContact CA-O 3.18Å
363	M	84.9	Confident	83.9	Confident	36 Å²	36	50.4 Å²	50.4	18%	0.177	28%	0.283	C	S	.	.			trans	-98	-30	-178.5	-62.3	-59.8	-178.2	0	0	112	K361 F411 P440 L525 N550	K361-M363 HydrophobicContact CB-CE 4.18Å; K361-M363 PolarHBondContact O-N 3.34Å; M363-F411 PolarHBondContact N-O 2.91Å; M363-P440 WeakPolarHBondContact O-CD 3.45Å; M363-L525 HydrophobicContact CB-CD2 3.94Å; M363-L525 WeakPolarHBondContact O-CD2 3.48Å; M363-N550 HydrophobicContact CE-CB 3.83Å
364	V	88.7	Confident	84	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.006	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	130	-177.5	-179.4	0	0	0	0	110.1	G410 F411 L414 P437 T438 V529	V364-G410 CarbonylContact O-C 3.59Å; V364-G410 WeakPolarHBondContact O-CA 3.31Å; V364-F411 PolarHBondContact N-O 3.08Å; V364-F411 PolarHBondContact O-N 2.92Å; V364-L414 HydrophobicContact CG1-CD2 4.08Å; V364-P437 HydrophobicContact CG1-CB 3.54Å; V364-T438 CarbonylContact C-O 3.59Å; V364-T438 WeakPolarHBondContact CA-O 3.34Å; V364-V529 HydrophobicContact CG1-CG1 4.37Å; V364-V529 HydrophobicContact CG2-CG1 4.04Å; V364-V529 HydrophobicContact CG2-CG2 3.81Å
365	F	90.3	Very high	84.2	Confident	15 Å²	15	54.2 Å²	54.2	7%	0.066	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	135.6	177.4	-68.7	-98.2	0	0	0	111.8	A362 T394 L409 T438 P440 V462	A362-F365 HydrophobicContact CB-CE1 4.17Å; A362-F365 HydrophobicContact CB-CE2 3.9Å; A362-F365 HydrophobicContact CB-CZ 3.58Å; A362-F365 WeakPolarHBondContact O-CE2 3.36Å; F365-T394 WeakPolarHBondContact CE1-OG1 3.34Å; F365-L409 CarbonylContact C-O 3.43Å; F365-L409 VanDerWaalsContact CA-O 3.24Å; F365-L409 WeakPolarHBondContact CA-O 3.42Å; F365-T438 PolarHBondContact N-O 3.02Å; F365-T438 PolarHBondContact O-N 2.88Å; F365-T438 PolarHBondContact O-OG1 3.29Å; F365-P440 HydrophobicContact CD2-CB 4.4Å; F365-P440 HydrophobicContact CD2-CG 4.43Å; F365-P440 HydrophobicContact CE2-CB 3.93Å; F365-P440 HydrophobicContact CE2-CG 3.94Å; F365-V462 HydrophobicContact CB-CG1 3.77Å; F365-V462 HydrophobicContact CD1-CG1 3.37Å; F365-V462 HydrophobicContact CD2-CG1 4.11Å; F365-V462 HydrophobicContact CE1-CG1 3.89Å; F365-V462 HydrophobicContact CE1-CG2 4.29Å; F365-V462 HydrophobicContact CE2-CG2 4.38Å; F365-V462 HydrophobicContact CG-CG1 3.49Å; F365-V462 VanDerWaalsContact CG-CG1 3.49Å; F365-V462 HydrophobicContact CZ-CG1 4.46Å; F365-V462 HydrophobicContact CZ-CG2 4.22Å
366	A	88.9	Confident	84.8	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	141.8	173.2	0	0	0	0	0	110.5	L409 M417 V434	A366-L409 PolarHBondContact N-O 2.59Å; A366-L409 PolarHBondContact O-N 2.99Å; A366-M417 HydrophobicContact CB-SD 3.6Å; A366-M417 VanDerWaalsContact CB-SD 3.6Å; A366-V434 HydrophobicContact CB-CG1 3.84Å
367	G	89.4	Confident	85.7	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	126.1	165.9	0	0	0	0	0	110.3	W407 T435	G367-W407 CarbonylContact C-O 3.6Å; G367-W407 VanDerWaalsContact CA-O 3.29Å; G367-W407 WeakPolarHBondContact CA-O 3.25Å; G367-T435 WeakPolarHBondContact CA-OG1 3.15Å; G367-T435 PolarHBondContact N-OG1 3.06Å; G367-T435 PolarHBondContact O-N 3.16Å; G367-T435 PolarHBondContact O-OG1 3.29Å
368	M	90.5	Very high	86.5	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	126.8	172.8	-66.1	-167.1	175.7	0	0	110.1	G406 W407 L409 F411 M417 F420 N421 L424 V432 I433 V434	M368-G406 WeakPolarHBondContact O-CA 3.29Å; M368-W407 PolarHBondContact N-O 3.22Å; M368-W407 PolarHBondContact O-N 3.39Å; M368-L409 HydrophobicContact CG-CD1 4.36Å; M368-L409 HydrophobicContact SD-CD1 3.7Å; M368-F411 HydrophobicContact CE-CE2 3.96Å; M368-F411 HydrophobicContact CE-CZ 3.6Å; M368-F411 HydrophobicContact SD-CZ 4.45Å; M368-M417 HydrophobicContact CE-CG 4.07Å; M368-F420 HydrophobicContact CE-CD1 4.41Å; M368-F420 HydrophobicContact SD-CD1 4.46Å; M368-N421 HydrophobicContact CE-CB 4.23Å; M368-L424 HydrophobicContact SD-CD1 4.22Å; M368-V432 HydrophobicContact SD-CG2 4.25Å; M368-I433 WeakPolarHBondContact CA-O 3.46Å; M368-V434 HydrophobicContact CE-CG1 4.22Å; M368-V434 HydrophobicContact CE-CG2 4.05Å; M368-V434 HydrophobicContact CG-CG1 4.39Å; M368-V434 HydrophobicContact CG-CG2 4.26Å
369	Y	89.4	Confident	87.4	Confident	7 Å²	7	45.5 Å²	45.5	3%	0.027	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	145.6	-175.6	-61.9	-93.7	0	0	0	109.7	D398 L403 G404 V432 I433 T435	Y369-D398 PolarHBondContact OH-OD2 3.07Å; Y369-L403 HydrophobicContact CD1-CB 3.76Å; Y369-L403 HydrophobicContact CD1-CD1 4.48Å; Y369-L403 HydrophobicContact CD2-CB 4.34Å; Y369-L403 HydrophobicContact CD2-CD1 3.56Å; Y369-L403 HydrophobicContact CE1-CB 4.32Å; Y369-L403 HydrophobicContact CE2-CD1 4.03Å; Y369-L403 HydrophobicContact CG-CB 3.77Å; Y369-L403 HydrophobicContact CG-CD1 3.83Å; Y369-L403 HydrophobicContact CG-CG 4.46Å; Y369-G404 WeakPolarHBondContact CE1-O 3.33Å; Y369-V432 CarbonylContact O-C 3.51Å; Y369-V432 WeakPolarHBondContact O-CA 3.44Å; Y369-V432 WeakPolarHBondContact O-CB 2.95Å; Y369-I433 PolarHBondContact N-O 3.24Å; Y369-I433 PolarHBondContact O-N 3.03Å; Y369-T435 HydrophobicContact CD2-CG2 4.16Å; Y369-T435 HydrophobicContact CE2-CG2 3.9Å
370	P	90.3	Very high	88.4	Confident	2 Å²	2	44.9 Å²	44.9	1%	0.013	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	154.5	176.1	32.7	-35.3	0	0	0	110.8	D372 E375 L379 A405	P370-D372 WeakPolarHBondContact CB-O 3.41Å; P370-E375 HydrophobicContact CB-CB 4.21Å; P370-L379 HydrophobicContact CB-CD2 3.75Å; P370-L379 HydrophobicContact CG-CD2 4.29Å; P370-A405 WeakPolarHBondContact CD-O 3.29Å
371	M	83.9	Confident	88.9	Confident	80 Å²	80	45.9 Å²	45.9	39%	0.394	25%	0.246	S	C	.	.	S	Bend	trans	-63.5	-44.2	175.8	-74.7	-67.9	-63.8	0	0	111.1	I433 K663 I667	M371-I433 HydrophobicContact CG-CG1 4.44Å; M371-I433 HydrophobicContact SD-CD1 3.95Å; M371-I433 HydrophobicContact SD-CG1 3.44Å; M371-I433 WeakPolarHBondContact SD-CG1 3.34Å; M371-K663 PolarHBondContact O-NZ 3.33Å; M371-K663 VanDerWaalsContact O-NZ 3.17Å; M371-I667 HydrophobicContact CE-CD1 4.23Å; M371-I667 HydrophobicContact SD-CD1 4.28Å
372	D	86.3	Confident	89.4	Confident	81 Å²	81	39.5 Å²	39.5	43%	0.433	22%	0.219	S	C	.	.	S	Bend	trans	-119.1	143.4	167.3	-174.5	33.4	0	0	0	112.5	P370 S374 E375	P370-D372 WeakPolarHBondContact CB-O 3.41Å; D372-S374 PolarHBondContact O-N 3.23Å; D372-S374 VanDerWaalsContact OD2-CB 3.23Å; D372-S374 WeakPolarHBondContact OD2-CB 3.4Å; D372-S374 PolarHBondContact OD2-N 3.08Å; D372-S374 PolarHBondContact OD2-OG 3.21Å; D372-E375 WeakPolarHBondContact O-CB 3.42Å; D372-E375 PolarHBondContact O-N 3.47Å
373	Q	88.3	Confident	89.6	Confident	67 Å²	67	38.9 Å²	38.9	31%	0.313	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-70	-13.3	-179.2	-73	-72.6	-46	0	0	112.8	E375 Y376 L403 A405	Q373-E375 PolarHBondContact O-N 2.74Å; Q373-Y376 WeakPolarHBondContact O-CB 3.39Å; Q373-Y376 PolarHBondContact O-N 3.39Å; Q373-L403 PolarHBondContact NE2-O 3.26Å; Q373-A405 PolarHBondContact NE2-O 2.85Å
374	S	89.6	Confident	89.7	Confident	88 Å²	88	41.2 Å²	41.2	62%	0.615	22%	0.224	S	C	*	.	G	3₁₀ helix	trans	-65.6	-26.7	167.8	68.8	0	0	0	0	113.2	D372 Y376 P377	D372-S374 PolarHBondContact O-N 3.23Å; D372-S374 VanDerWaalsContact OD2-CB 3.23Å; D372-S374 WeakPolarHBondContact OD2-CB 3.4Å; D372-S374 PolarHBondContact OD2-N 3.08Å; D372-S374 PolarHBondContact OD2-OG 3.21Å; S374-Y376 VanDerWaalsContact C-N 3.35Å; S374-P377 WeakPolarHBondContact O-CD 3.45Å
375	E	90.2	Very high	89.5	Confident	83 Å²	83	46.1 Å²	46.1	39%	0.388	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-83.6	-9.7	-179.9	-57.4	174.9	149.6	0	0	112.8	P370 D372 Q373 P377 A378 L379	P370-E375 HydrophobicContact CB-CB 4.21Å; D372-E375 WeakPolarHBondContact O-CB 3.42Å; D372-E375 PolarHBondContact O-N 3.47Å; Q373-E375 PolarHBondContact O-N 2.74Å; E375-P377 VanDerWaalsContact C-CD 3.42Å; E375-P377 VanDerWaalsContact C-N 3.33Å; E375-A378 WeakPolarHBondContact O-CA 3.22Å; E375-A378 WeakPolarHBondContact O-CB 3.49Å; E375-A378 PolarHBondContact O-N 3.26Å; E375-L379 PolarHBondContact O-N 2.89Å
376	Y	91.3	Very high	89.4	Confident	56 Å²	56	45.4 Å²	45.4	22%	0.22	24%	0.239	C	C	.	.	H	α-helix	trans	-49.4	-41.7	-178.4	178.6	-90.8	0	0	0	114.1	Q373 S374 A378 R380 A405 W407	Q373-Y376 WeakPolarHBondContact O-CB 3.39Å; Q373-Y376 PolarHBondContact O-N 3.39Å; S374-Y376 VanDerWaalsContact C-N 3.35Å; Y376-A378 PolarHBondContact O-N 2.98Å; Y376-R380 VanDerWaalsContact O-CB 3.3Å; Y376-R380 WeakPolarHBondContact O-CB 3.12Å; Y376-R380 PolarHBondContact O-N 2.81Å; Y376-A405 HydrophobicContact CD2-CB 3.86Å; Y376-A405 HydrophobicContact CE2-CB 3.46Å; Y376-A405 VanDerWaalsContact CE2-CB 3.46Å; Y376-W407 HydrophobicContact CD1-CH2 4.35Å; Y376-W407 AromaticContact CD2-CH2 3.38Å; Y376-W407 HydrophobicContact CD2-CH2 3.38Å; Y376-W407 HydrophobicContact CD2-CZ2 4.32Å; Y376-W407 AromaticContact CD2-CZ3 3.65Å; Y376-W407 HydrophobicContact CD2-CZ3 3.65Å; Y376-W407 HydrophobicContact CE1-CH2 4.18Å; Y376-W407 HydrophobicContact CE1-CZ2 4.39Å; Y376-W407 HydrophobicContact CE2-CE3 4.41Å; Y376-W407 AromaticContact CE2-CH2 3.14Å; Y376-W407 HydrophobicContact CE2-CH2 3.14Å; Y376-W407 AromaticContact CE2-CZ2 3.66Å; Y376-W407 HydrophobicContact CE2-CZ2 3.66Å; Y376-W407 AromaticContact CE2-CZ3 3.59Å; Y376-W407 HydrophobicContact CE2-CZ3 3.59Å; Y376-W407 AromaticContact CG-CH2 3.99Å; Y376-W407 HydrophobicContact CG-CH2 3.99Å; Y376-W407 AromaticContact CZ-CH2 3.59Å; Y376-W407 AromaticContact CZ-CZ2 3.7Å
377	P	92.4	Very high	89.2	Confident	90 Å²	90	47 Å²	47	58%	0.584	25%	0.249	S	C	*	.	H	α-helix	trans	-67.3	-32.8	175.7	-19.3	33.8	0	0	0	113.8	S374 E375 S381	S374-P377 WeakPolarHBondContact O-CD 3.45Å; E375-P377 VanDerWaalsContact C-CD 3.42Å; E375-P377 VanDerWaalsContact C-N 3.33Å; P377-S381 PolarHBondContact O-N 2.89Å
378	A	91.7	Very high	88.7	Confident	65 Å²	65	48.4 Å²	48.4	54%	0.537	26%	0.257	S	S	.	.	H	α-helix	trans	-73.9	-47.6	177.9	0	0	0	0	0	110.8	E375 Y376 R380 S381 A382	E375-A378 WeakPolarHBondContact O-CA 3.22Å; E375-A378 WeakPolarHBondContact O-CB 3.49Å; E375-A378 PolarHBondContact O-N 3.26Å; Y376-A378 PolarHBondContact O-N 2.98Å; A378-R380 VanDerWaalsContact C-N 3.29Å; A378-R380 PolarHBondContact O-N 2.81Å; A378-S381 WeakPolarHBondContact O-CB 3.25Å; A378-S381 PolarHBondContact O-N 2.91Å; A378-S381 VanDerWaalsContact O-N 3.11Å; A378-A382 PolarHBondContact O-N 2.91Å
379	L	92.6	Very high	88.2	Confident	4 Å²	4	50.2 Å²	50.2	2%	0.021	27%	0.267	C	S	.	.	H	α-helix	trans	-59.7	-39.2	174.6	177.8	57	0	0	0	111.7	P370 E375 S381 A382 I383 W407 L424 A430 V432	P370-L379 HydrophobicContact CB-CD2 3.75Å; P370-L379 HydrophobicContact CG-CD2 4.29Å; E375-L379 PolarHBondContact O-N 2.89Å; L379-S381 PolarHBondContact O-N 2.92Å; L379-A382 PolarHBondContact O-N 2.68Å; L379-I383 HydrophobicContact CD1-CD1 3.79Å; L379-I383 HydrophobicContact CD1-CG1 3.96Å; L379-I383 HydrophobicContact CG-CD1 3.89Å; L379-I383 HydrophobicContact CG-CG1 4.45Å; L379-I383 WeakPolarHBondContact O-CG1 3.38Å; L379-I383 PolarHBondContact O-N 3.24Å; L379-W407 HydrophobicContact CB-CZ3 4.28Å; L379-W407 HydrophobicContact CD2-CE3 4.16Å; L379-W407 HydrophobicContact CD2-CZ3 3.75Å; L379-W407 HydrophobicContact CG-CE3 4.26Å; L379-W407 HydrophobicContact CG-CZ3 3.77Å; L379-L424 HydrophobicContact CD1-CD1 4.22Å; L379-A430 HydrophobicContact CD1-CB 4.16Å; L379-V432 HydrophobicContact CD1-CG1 3.44Å; L379-V432 VanDerWaalsContact CD1-CG1 3.44Å; L379-V432 HydrophobicContact CD2-CG1 3.55Å; L379-V432 HydrophobicContact CG-CG1 4.16Å
380	R	91.7	Very high	87.8	Confident	92 Å²	92	50.8 Å²	50.8	35%	0.347	27%	0.27	S	S	.	.	H	α-helix	trans	-55.9	-50.7	172.4	-176.5	173.1	174.1	-142.2	-20.8	111.7	Y376 A378 A382 I383 E384 W407	Y376-R380 VanDerWaalsContact O-CB 3.3Å; Y376-R380 WeakPolarHBondContact O-CB 3.12Å; Y376-R380 PolarHBondContact O-N 2.81Å; A378-R380 VanDerWaalsContact C-N 3.29Å; A378-R380 PolarHBondContact O-N 2.81Å; R380-A382 VanDerWaalsContact C-N 3.32Å; R380-A382 PolarHBondContact O-N 2.62Å; R380-I383 PolarHBondContact O-N 3.2Å; R380-E384 HydrophobicContact CG-CG 4.33Å; R380-E384 IonicContact CZ-OE1 3.81Å; R380-E384 IonicContact CZ-OE2 2.62Å; R380-E384 IonicContact NE-OE1 3.42Å; R380-E384 PolarHBondContact NE-OE1 3.22Å; R380-E384 IonicContact NE-OE2 3.84Å; R380-E384 PolarHBondContact NE-OE2 2.79Å; R380-E384 IonicContact NH2-OE1 3.74Å; R380-E384 PolarHBondContact NH2-OE1 3.44Å; R380-E384 IonicContact NH2-OE2 3.81Å; R380-E384 PolarHBondContact NH2-OE2 3.07Å; R380-E384 VanDerWaalsContact O-CB 3.32Å; R380-E384 WeakPolarHBondContact O-CB 3.35Å; R380-E384 WeakPolarHBondContact O-CG 3.42Å; R380-E384 PolarHBondContact O-N 3.16Å; R380-W407 HydrophobicContact CB-CH2 3.66Å; R380-W407 HydrophobicContact CB-CZ2 3.48Å; R380-W407 VanDerWaalsContact CB-CZ2 3.48Å; R380-W407 HydrophobicContact CG-CH2 4.39Å; R380-W407 HydrophobicContact CG-CZ2 3.71Å
381	S	89.2	Confident	87.1	Confident	47 Å²	47	53.6 Å²	53.6	33%	0.329	29%	0.289	S	S	.	.	H	α-helix	trans	-62.4	-38.7	178.9	-176.3	0	0	0	0	111.8	P377 A378 L379 R385	P377-S381 PolarHBondContact O-N 2.89Å; A378-S381 WeakPolarHBondContact O-CB 3.25Å; A378-S381 PolarHBondContact O-N 2.91Å; A378-S381 VanDerWaalsContact O-N 3.11Å; L379-S381 PolarHBondContact O-N 2.92Å; S381-R385 WeakPolarHBondContact O-CB 3.48Å; S381-R385 WeakPolarHBondContact O-CD 3.4Å; S381-R385 WeakPolarHBondContact O-CG 3.36Å; S381-R385 PolarHBondContact O-N 2.95Å; S381-R385 PolarHBondContact OG-NE 2.74Å
382	A	91.5	Very high	87	Confident	2 Å²	2	50 Å²	50	2%	0.017	27%	0.272	C	S	.	.	H	α-helix	trans	-64.9	-49	176.5	0	0	0	0	0	112.2	A378 L379 R380 R385 L386 L424 Y428 A430	A378-A382 PolarHBondContact O-N 2.91Å; L379-A382 PolarHBondContact O-N 2.68Å; R380-A382 VanDerWaalsContact C-N 3.32Å; R380-A382 PolarHBondContact O-N 2.62Å; A382-R385 PolarHBondContact O-N 3.3Å; A382-L386 WeakPolarHBondContact O-CB 3.47Å; A382-L386 PolarHBondContact O-N 2.97Å; A382-L424 HydrophobicContact CB-CD2 3.81Å; A382-Y428 HydrophobicContact CB-CD1 4.05Å; A382-Y428 HydrophobicContact CB-CD2 4.1Å; A382-Y428 HydrophobicContact CB-CG 3.63Å; A382-A430 HydrophobicContact CB-CB 4.24Å
383	I	91.5	Very high	87.2	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-62	-50	176.2	-67.2	168.7	0	0	0	110.2	L379 R380 R385 L386 T387 V395 W407 L409 L424	L379-I383 HydrophobicContact CD1-CD1 3.79Å; L379-I383 HydrophobicContact CD1-CG1 3.96Å; L379-I383 HydrophobicContact CG-CD1 3.89Å; L379-I383 HydrophobicContact CG-CG1 4.45Å; L379-I383 WeakPolarHBondContact O-CG1 3.38Å; L379-I383 PolarHBondContact O-N 3.24Å; R380-I383 PolarHBondContact O-N 3.2Å; I383-R385 PolarHBondContact O-N 2.83Å; I383-L386 PolarHBondContact O-N 3.09Å; I383-T387 HydrophobicContact CG2-CG2 4.32Å; I383-T387 WeakPolarHBondContact O-CG2 3.27Å; I383-T387 PolarHBondContact O-N 3.45Å; I383-T387 PolarHBondContact O-OG1 3.38Å; I383-V395 HydrophobicContact CG2-CG1 4.16Å; I383-V395 HydrophobicContact CG2-CG2 4.05Å; I383-W407 HydrophobicContact CD1-CB 4.31Å; I383-W407 HydrophobicContact CD1-CD2 3.72Å; I383-W407 HydrophobicContact CD1-CE3 3.62Å; I383-W407 HydrophobicContact CD1-CG 4.02Å; I383-W407 HydrophobicContact CD1-CZ3 4.29Å; I383-L409 HydrophobicContact CD1-CD1 4.35Å; I383-L409 HydrophobicContact CG2-CD1 4.41Å; I383-L409 HydrophobicContact CG2-CD2 4.24Å; I383-L424 HydrophobicContact CG1-CD1 4.25Å; I383-L424 HydrophobicContact CG1-CD2 4.2Å
384	E	86.8	Confident	87.2	Confident	86 Å²	86	45.9 Å²	45.9	40%	0.402	26%	0.255	S	S	.	.	H	α-helix	trans	-59.6	-31.4	-179.6	-74.3	177.2	168.6	0	0	112.4	R380 L388	R380-E384 HydrophobicContact CG-CG 4.33Å; R380-E384 IonicContact CZ-OE1 3.81Å; R380-E384 IonicContact CZ-OE2 2.62Å; R380-E384 IonicContact NE-OE1 3.42Å; R380-E384 PolarHBondContact NE-OE1 3.22Å; R380-E384 IonicContact NE-OE2 3.84Å; R380-E384 PolarHBondContact NE-OE2 2.79Å; R380-E384 IonicContact NH2-OE1 3.74Å; R380-E384 PolarHBondContact NH2-OE1 3.44Å; R380-E384 IonicContact NH2-OE2 3.81Å; R380-E384 PolarHBondContact NH2-OE2 3.07Å; R380-E384 VanDerWaalsContact O-CB 3.32Å; R380-E384 WeakPolarHBondContact O-CB 3.35Å; R380-E384 WeakPolarHBondContact O-CG 3.42Å; R380-E384 PolarHBondContact O-N 3.16Å; E384-L388 WeakPolarHBondContact O-CG 3.49Å
385	R	84.1	Confident	87.3	Confident	103 Å²	103	44.6 Å²	44.6	39%	0.389	24%	0.243	S	C	.	.	H	α-helix	trans	-78.9	-45.6	173.5	-71.5	168.1	-173.1	-133	-1.6	113.4	S381 A382 I383 T387 L388 Y428	S381-R385 WeakPolarHBondContact O-CB 3.48Å; S381-R385 WeakPolarHBondContact O-CD 3.4Å; S381-R385 WeakPolarHBondContact O-CG 3.36Å; S381-R385 PolarHBondContact O-N 2.95Å; S381-R385 PolarHBondContact OG-NE 2.74Å; A382-R385 PolarHBondContact O-N 3.3Å; I383-R385 PolarHBondContact O-N 2.83Å; R385-T387 VanDerWaalsContact C-N 3.31Å; R385-T387 PolarHBondContact O-N 3.35Å; R385-L388 WeakPolarHBondContact O-CB 3.49Å; R385-L388 PolarHBondContact O-N 3.45Å; R385-L388 VanDerWaalsContact O-N 3.08Å; R385-Y428 HydrophobicContact CB-CE1 4.06Å
386	L	87.1	Confident	87.3	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-65.8	-36.7	-176.5	-171.6	56.2	0	0	0	110.9	A382 I383 L388 N389 D390 F420 R423 L424 Y428	A382-L386 WeakPolarHBondContact O-CB 3.47Å; A382-L386 PolarHBondContact O-N 2.97Å; I383-L386 PolarHBondContact O-N 3.09Å; L386-L388 PolarHBondContact O-N 3.35Å; L386-N389 PolarHBondContact O-N 3.47Å; L386-N389 VanDerWaalsContact O-N 3.08Å; L386-D390 PolarHBondContact O-N 2.99Å; L386-F420 HydrophobicContact CB-CE2 4.07Å; L386-F420 HydrophobicContact CB-CZ 4.2Å; L386-F420 HydrophobicContact CD2-CD1 4.19Å; L386-F420 HydrophobicContact CD2-CD2 3.64Å; L386-F420 HydrophobicContact CD2-CE1 4.09Å; L386-F420 HydrophobicContact CD2-CE2 3.52Å; L386-F420 HydrophobicContact CD2-CG 3.98Å; L386-F420 HydrophobicContact CD2-CZ 3.76Å; L386-F420 HydrophobicContact CG-CD2 3.91Å; L386-F420 HydrophobicContact CG-CE2 3.52Å; L386-F420 HydrophobicContact CG-CZ 4.03Å; L386-R423 HydrophobicContact CD1-CB 4.35Å; L386-R423 HydrophobicContact CD2-CB 4Å; L386-L424 HydrophobicContact CB-CD2 4.46Å; L386-L424 HydrophobicContact CD2-CD2 3.78Å; L386-L424 HydrophobicContact CD2-CG 3.9Å; L386-Y428 HydrophobicContact CB-CE2 4.23Å; L386-Y428 HydrophobicContact CD1-CE2 4.48Å
387	T	86.4	Confident	87.2	Confident	33 Å²	33	51 Å²	51	20%	0.202	27%	0.268	C	S	.	.	H	α-helix	trans	-75.7	0	173.8	62.7	0	0	0	0	115.3	I383 R385 D390 V393 V395 F420	I383-T387 HydrophobicContact CG2-CG2 4.32Å; I383-T387 WeakPolarHBondContact O-CG2 3.27Å; I383-T387 PolarHBondContact O-N 3.45Å; I383-T387 PolarHBondContact O-OG1 3.38Å; R385-T387 VanDerWaalsContact C-N 3.31Å; R385-T387 PolarHBondContact O-N 3.35Å; T387-D390 WeakPolarHBondContact CA-O 3.27Å; T387-V393 HydrophobicContact CG2-CB 3.87Å; T387-V393 HydrophobicContact CG2-CG1 3.79Å; T387-V395 HydrophobicContact CG2-CG2 3.59Å; T387-F420 HydrophobicContact CG2-CE2 3.92Å; T387-F420 HydrophobicContact CG2-CZ 3.85Å
388	L	77.8	Confident	87	Confident	31 Å²	31	47.9 Å²	47.9	16%	0.162	25%	0.246	C	C	.	.	H	α-helix	trans	-78.1	-40.4	161.2	-69.2	169.5	0	0	0	110.4	F270 V335 E384 R385 L386	F270-L388 HydrophobicContact CB-CB 4.3Å; F270-L388 HydrophobicContact CD1-CD1 3.99Å; F270-L388 HydrophobicContact CD2-CD1 4.49Å; F270-L388 HydrophobicContact CE1-CD1 4.08Å; F270-L388 HydrophobicContact CG-CB 4.47Å; F270-L388 HydrophobicContact CG-CD1 4.19Å; F270-L388 HydrophobicContact CZ-CD1 4.39Å; V335-L388 HydrophobicContact CB-CB 4.37Å; V335-L388 HydrophobicContact CB-CD2 4.09Å; V335-L388 WeakPolarHBondContact CB-O 3.49Å; V335-L388 VanDerWaalsContact CG1-O 3.31Å; V335-L388 WeakPolarHBondContact CG1-O 3.44Å; V335-L388 HydrophobicContact CG2-CB 3.9Å; V335-L388 HydrophobicContact CG2-CD2 4.18Å; V335-L388 WeakPolarHBondContact CG2-O 3.2Å; E384-L388 WeakPolarHBondContact O-CG 3.49Å; R385-L388 WeakPolarHBondContact O-CB 3.49Å; R385-L388 PolarHBondContact O-N 3.45Å; R385-L388 VanDerWaalsContact O-N 3.08Å; L386-L388 PolarHBondContact O-N 3.35Å
389	N	79.4	Confident	86.6	Confident	38 Å²	38	49.3 Å²	49.3	20%	0.203	25%	0.252	C	S	.	.	H	α-helix	trans	-81.2	-23.1	179.5	-74.2	-41.1	0	0	0	113.4	F270 L386	F270-N389 WeakPolarHBondContact CB-OD1 3.15Å; F270-N389 PolarHBondContact N-OD1 3.05Å; L386-N389 PolarHBondContact O-N 3.47Å; L386-N389 VanDerWaalsContact O-N 3.08Å
390	D	81.8	Confident	86	Confident	19 Å²	19	49.7 Å²	49.7	10%	0.102	26%	0.255	C	S	.	.			trans	-120.7	96.9	172.2	-163.7	-35.7	0	0	0	111.1	L386 T387 S392 V393 H416	L386-D390 PolarHBondContact O-N 2.99Å; T387-D390 WeakPolarHBondContact CA-O 3.27Å; D390-S392 PolarHBondContact O-N 2.68Å; D390-S392 WeakPolarHBondContact OD1-CA 3.48Å; D390-S392 WeakPolarHBondContact OD1-CB 3.47Å; D390-S392 PolarHBondContact OD1-N 2.68Å; D390-S392 PolarHBondContact OD1-OG 3.48Å; D390-V393 HydrophobicContact CB-CG2 4.34Å; D390-H416 IonicContact OD2-CE1 3.34Å; D390-H416 IonicContact OD2-NE2 3.69Å; D390-H416 PolarHBondContact OD2-NE2 2.83Å
391	S	74.4	Confident	85.2	Confident	60 Å²	60	52.5 Å²	52.5	42%	0.42	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-0.3	178.7	57.8	0	0	0	0	113.9	I340	I340-S391 WeakPolarHBondContact CD1-OG 3.37Å
392	S	83	Confident	84.4	Confident	5 Å²	5	52.5 Å²	52.5	4%	0.035	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-12.2	176.8	75.6	0	0	0	0	113.6	D390 H416	D390-S392 PolarHBondContact O-N 2.68Å; D390-S392 WeakPolarHBondContact OD1-CA 3.48Å; D390-S392 WeakPolarHBondContact OD1-CB 3.47Å; D390-S392 PolarHBondContact OD1-N 2.68Å; D390-S392 PolarHBondContact OD1-OG 3.48Å; S392-H416 PolarHBondContact OG-CE1 3.1Å
393	V	89.4	Confident	83.8	Confident	11 Å²	11	52.7 Å²	52.7	7%	0.067	28%	0.279	C	S	.	.			trans	-84.5	117.7	177.3	179.8	0	0	0	0	111.6	T387 D390 L409 G410 F411 H416 F420	T387-V393 HydrophobicContact CG2-CB 3.87Å; T387-V393 HydrophobicContact CG2-CG1 3.79Å; D390-V393 HydrophobicContact CB-CG2 4.34Å; V393-L409 HydrophobicContact CG1-CB 4.48Å; V393-G410 WeakPolarHBondContact CA-O 3.37Å; V393-F411 HydrophobicContact CG1-CD1 4.33Å; V393-F411 HydrophobicContact CG1-CE1 3.9Å; V393-F411 HydrophobicContact CG1-CZ 4.47Å; V393-F411 HydrophobicContact CG2-CD1 3.9Å; V393-F411 HydrophobicContact CG2-CE1 3.95Å; V393-H416 WeakPolarHBondContact CG2-NE2 2.9Å; V393-F420 HydrophobicContact CB-CE2 4.24Å; V393-F420 HydrophobicContact CG1-CE2 4.08Å; V393-F420 HydrophobicContact CG1-CZ 4.17Å; V393-F420 HydrophobicContact CG2-CD2 3.76Å; V393-F420 HydrophobicContact CG2-CE2 3.78Å
394	T	89.1	Confident	83.5	Confident	51 Å²	51	53.9 Å²	53.9	31%	0.313	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	125.8	174.5	63.7	0	0	0	0	110.8	A362 F365 L409 G410	A362-T394 HydrophobicContact CB-CG2 4.17Å; F365-T394 WeakPolarHBondContact CE1-OG1 3.34Å; T394-L409 WeakPolarHBondContact O-CA 3.46Å; T394-G410 PolarHBondContact N-O 3.37Å; T394-G410 PolarHBondContact O-N 3.11Å; T394-G410 WeakPolarHBondContact OG1-CA 3.33Å; T394-G410 PolarHBondContact OG1-N 2.81Å
395	V	91.1	Very high	83.7	Confident	60 Å²	60	51.2 Å²	51.2	36%	0.364	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	121.6	-179	-175.8	0	0	0	0	111.4	I383 T387 W407 L409	I383-V395 HydrophobicContact CG2-CG1 4.16Å; I383-V395 HydrophobicContact CG2-CG2 4.05Å; T387-V395 HydrophobicContact CG2-CG2 3.59Å; V395-W407 HydrophobicContact CG1-CG 4.49Å; V395-L409 HydrophobicContact CB-CD2 4.01Å; V395-L409 HydrophobicContact CG1-CD2 3.83Å; V395-L409 HydrophobicContact CG2-CD2 3.85Å
396	Q	90.5	Very high	84	Confident	98 Å²	98	46.3 Å²	46.3	46%	0.458	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	152.3	167.6	-60.9	177.7	-0.5	0	0	109.8	W407 R408	Q396-W407 CarbonylContact O-C 3.55Å; Q396-W407 WeakPolarHBondContact O-CA 3.3Å; Q396-W407 WeakPolarHBondContact O-CB 3.23Å; Q396-R408 HydrophobicContact CB-CB 4.23Å; Q396-R408 PolarHBondContact N-O 3.39Å; Q396-R408 PolarHBondContact O-N 3Å
397	R	90.4	Very high	84.3	Confident	177 Å²	177	46.5 Å²	46.5	67%	0.668	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.1	139.8	172.7	-66.3	-176.6	-176.2	172.8	2.5	109.6
398	D	87.3	Confident	84.6	Confident	24 Å²	24	45.9 Å²	45.9	13%	0.128	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	158.6	-179.1	-158.3	2.8	0	0	0	109.9	Y369 G406 R408	Y369-D398 PolarHBondContact OH-OD2 3.07Å; D398-G406 PolarHBondContact N-O 3.32Å; D398-G406 CarbonylContact O-C 3.58Å; D398-G406 PolarHBondContact O-N 2.97Å; D398-R408 HydrophobicContact CB-CB 4.07Å; D398-R408 IonicContact OD2-NH1 3.47Å
399	S	84.3	Confident	85.3	Confident	94 Å²	94	44.4 Å²	44.4	66%	0.657	25%	0.253	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-148.1	120.4	-179.2	60.8	0	0	0	0	111.1
400	S	78.9	Confident	85.9	Confident	12 Å²	12	42.6 Å²	42.6	8%	0.084	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	145.6	-179	145.8	0	0	0	0	110.5	A402 L403 G404 E572	S400-A402 PolarHBondContact OG-N 2.97Å; S400-L403 WeakPolarHBondContact OG-CB 3.41Å; S400-L403 PolarHBondContact OG-N 3.08Å; S400-G404 PolarHBondContact N-O 3.03Å; S400-G404 WeakPolarHBondContact O-CA 3.35Å; S400-G404 PolarHBondContact O-N 3.22Å; S400-E572 WeakPolarHBondContact CB-OE1 3.33Å; S400-E572 VanDerWaalsContact OG-CD 3.3Å; S400-E572 VanDerWaalsContact OG-CG 3.31Å; S400-E572 WeakPolarHBondContact OG-CG 3.46Å; S400-E572 PolarHBondContact OG-OE1 2.85Å
401	L	74.4	Confident	86.4	Confident	151 Å²	151	41.7 Å²	41.7	79%	0.791	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-31.1	175.9	-66.5	174.9	0	0	0	112.2	E572	L401-E572 PolarHBondContact N-OE1 3.13Å; L401-E572 VanDerWaalsContact N-OE1 3.11Å
402	A	74	Confident	87	Confident	47 Å²	47	39.8 Å²	39.8	39%	0.388	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-33.7	179.2	0	0	0	0	0	114.3	S400 E572 F666	S400-A402 PolarHBondContact OG-N 2.97Å; A402-E572 WeakPolarHBondContact CB-OE1 3.46Å; A402-E572 PolarHBondContact N-OE1 3.35Å; A402-F666 HydrophobicContact CB-CE1 4.19Å; A402-F666 HydrophobicContact CB-CZ 4.1Å
403	L	78.8	Confident	87.2	Confident	6 Å²	6	39.5 Å²	39.5	3%	0.031	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-20.6	-171.9	-56.4	179.2	0	0	0	113.5	Y369 Q373 S400 I433 T435 F666	Y369-L403 HydrophobicContact CD1-CB 3.76Å; Y369-L403 HydrophobicContact CD1-CD1 4.48Å; Y369-L403 HydrophobicContact CD2-CB 4.34Å; Y369-L403 HydrophobicContact CD2-CD1 3.56Å; Y369-L403 HydrophobicContact CE1-CB 4.32Å; Y369-L403 HydrophobicContact CE2-CD1 4.03Å; Y369-L403 HydrophobicContact CG-CB 3.77Å; Y369-L403 HydrophobicContact CG-CD1 3.83Å; Y369-L403 HydrophobicContact CG-CG 4.46Å; Q373-L403 PolarHBondContact NE2-O 3.26Å; S400-L403 WeakPolarHBondContact OG-CB 3.41Å; S400-L403 PolarHBondContact OG-N 3.08Å; L403-I433 HydrophobicContact CD1-CG2 4.11Å; L403-I433 HydrophobicContact CD2-CD1 3.95Å; L403-I433 HydrophobicContact CD2-CG2 4.41Å; L403-T435 HydrophobicContact CD1-CG2 4.09Å; L403-F666 HydrophobicContact CD2-CD1 4.15Å; L403-F666 HydrophobicContact CG-CE1 4.46Å
404	G	85.4	Confident	86.9	Confident	25 Å²	25	41.3 Å²	41.3	26%	0.258	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	90.1	-150.2	-177.1	0	0	0	0	0	112.9	Y369 S400	Y369-G404 WeakPolarHBondContact CE1-O 3.33Å; S400-G404 PolarHBondContact N-O 3.03Å; S400-G404 WeakPolarHBondContact O-CA 3.35Å; S400-G404 PolarHBondContact O-N 3.22Å
405	A	89.6	Confident	86.8	Confident	31 Å²	31	40 Å²	40	26%	0.256	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	145.9	178.4	0	0	0	0	0	111.6	P370 Q373 Y376	P370-A405 WeakPolarHBondContact CD-O 3.29Å; Q373-A405 PolarHBondContact NE2-O 2.85Å; Y376-A405 HydrophobicContact CD2-CB 3.86Å; Y376-A405 HydrophobicContact CE2-CB 3.46Å; Y376-A405 VanDerWaalsContact CE2-CB 3.46Å
406	G	91.8	Very high	86.7	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.2	-154.1	178.9	0	0	0	0	0	112.3	M368 D398	M368-G406 WeakPolarHBondContact O-CA 3.29Å; D398-G406 PolarHBondContact N-O 3.32Å; D398-G406 CarbonylContact O-C 3.58Å; D398-G406 PolarHBondContact O-N 2.97Å
407	W	93.3	Very high	86.7	Confident	4 Å²	4	33.6 Å²	33.6	2%	0.015	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	138.7	-177.7	-66.6	-94.7	0	0	0	111.9	G367 M368 Y376 L379 R380 I383 V395 Q396 L409	G367-W407 CarbonylContact C-O 3.6Å; G367-W407 VanDerWaalsContact CA-O 3.29Å; G367-W407 WeakPolarHBondContact CA-O 3.25Å; M368-W407 PolarHBondContact N-O 3.22Å; M368-W407 PolarHBondContact O-N 3.39Å; Y376-W407 HydrophobicContact CD1-CH2 4.35Å; Y376-W407 AromaticContact CD2-CH2 3.38Å; Y376-W407 HydrophobicContact CD2-CH2 3.38Å; Y376-W407 HydrophobicContact CD2-CZ2 4.32Å; Y376-W407 AromaticContact CD2-CZ3 3.65Å; Y376-W407 HydrophobicContact CD2-CZ3 3.65Å; Y376-W407 HydrophobicContact CE1-CH2 4.18Å; Y376-W407 HydrophobicContact CE1-CZ2 4.39Å; Y376-W407 HydrophobicContact CE2-CE3 4.41Å; Y376-W407 AromaticContact CE2-CH2 3.14Å; Y376-W407 HydrophobicContact CE2-CH2 3.14Å; Y376-W407 AromaticContact CE2-CZ2 3.66Å; Y376-W407 HydrophobicContact CE2-CZ2 3.66Å; Y376-W407 AromaticContact CE2-CZ3 3.59Å; Y376-W407 HydrophobicContact CE2-CZ3 3.59Å; Y376-W407 AromaticContact CG-CH2 3.99Å; Y376-W407 HydrophobicContact CG-CH2 3.99Å; Y376-W407 AromaticContact CZ-CH2 3.59Å; Y376-W407 AromaticContact CZ-CZ2 3.7Å; L379-W407 HydrophobicContact CB-CZ3 4.28Å; L379-W407 HydrophobicContact CD2-CE3 4.16Å; L379-W407 HydrophobicContact CD2-CZ3 3.75Å; L379-W407 HydrophobicContact CG-CE3 4.26Å; L379-W407 HydrophobicContact CG-CZ3 3.77Å; R380-W407 HydrophobicContact CB-CH2 3.66Å; R380-W407 HydrophobicContact CB-CZ2 3.48Å; R380-W407 VanDerWaalsContact CB-CZ2 3.48Å; R380-W407 HydrophobicContact CG-CH2 4.39Å; R380-W407 HydrophobicContact CG-CZ2 3.71Å; I383-W407 HydrophobicContact CD1-CB 4.31Å; I383-W407 HydrophobicContact CD1-CD2 3.72Å; I383-W407 HydrophobicContact CD1-CE3 3.62Å; I383-W407 HydrophobicContact CD1-CG 4.02Å; I383-W407 HydrophobicContact CD1-CZ3 4.29Å; V395-W407 HydrophobicContact CG1-CG 4.49Å; Q396-W407 CarbonylContact O-C 3.55Å; Q396-W407 WeakPolarHBondContact O-CA 3.3Å; Q396-W407 WeakPolarHBondContact O-CB 3.23Å; W407-L409 HydrophobicContact CB-CD2 3.86Å; W407-L409 HydrophobicContact CB-CG 4.2Å
408	R	91.3	Very high	86.6	Confident	19 Å²	19	28.8 Å²	28.8	7%	0.072	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	107.9	164.1	-163.6	72.5	170.9	-165.6	7.7	106.8	Q396 D398 T438 V462	Q396-R408 HydrophobicContact CB-CB 4.23Å; Q396-R408 PolarHBondContact N-O 3.39Å; Q396-R408 PolarHBondContact O-N 3Å; D398-R408 HydrophobicContact CB-CB 4.07Å; D398-R408 IonicContact OD2-NH1 3.47Å; R408-T438 PolarHBondContact NH2-OG1 2.8Å; R408-V462 HydrophobicContact CG-CG1 3.77Å; R408-V462 PolarHBondContact NE-O 3.23Å; R408-V462 PolarHBondContact NH2-O 3.39Å
409	L	93.6	Very high	86.7	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	142.8	177.3	-60.3	-166.9	0	0	0	109.9	F365 A366 M368 I383 V393 T394 V395 W407 F411 F420	F365-L409 CarbonylContact C-O 3.43Å; F365-L409 VanDerWaalsContact CA-O 3.24Å; F365-L409 WeakPolarHBondContact CA-O 3.42Å; A366-L409 PolarHBondContact N-O 2.59Å; A366-L409 PolarHBondContact O-N 2.99Å; M368-L409 HydrophobicContact CG-CD1 4.36Å; M368-L409 HydrophobicContact SD-CD1 3.7Å; I383-L409 HydrophobicContact CD1-CD1 4.35Å; I383-L409 HydrophobicContact CG2-CD1 4.41Å; I383-L409 HydrophobicContact CG2-CD2 4.24Å; V393-L409 HydrophobicContact CG1-CB 4.48Å; T394-L409 WeakPolarHBondContact O-CA 3.46Å; V395-L409 HydrophobicContact CB-CD2 4.01Å; V395-L409 HydrophobicContact CG1-CD2 3.83Å; V395-L409 HydrophobicContact CG2-CD2 3.85Å; W407-L409 HydrophobicContact CB-CD2 3.86Å; W407-L409 HydrophobicContact CB-CG 4.2Å; L409-F411 HydrophobicContact CB-CE1 4.41Å; L409-F411 HydrophobicContact CB-CE2 3.51Å; L409-F411 HydrophobicContact CB-CZ 3.45Å; L409-F411 VanDerWaalsContact CB-CZ 3.45Å; L409-F411 HydrophobicContact CD1-CZ 3.9Å; L409-F411 HydrophobicContact CG-CZ 4.33Å; L409-F420 HydrophobicContact CD1-CD1 4.27Å; L409-F420 HydrophobicContact CD1-CE1 3.5Å; L409-F420 VanDerWaalsContact CD1-CE1 3.5Å; L409-F420 HydrophobicContact CD1-CZ 4.09Å
410	G	92.4	Very high	87.1	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	135.8	175.9	0	0	0	0	0	111	V364 V393 T394	V364-G410 CarbonylContact O-C 3.59Å; V364-G410 WeakPolarHBondContact O-CA 3.31Å; V393-G410 WeakPolarHBondContact CA-O 3.37Å; T394-G410 PolarHBondContact N-O 3.37Å; T394-G410 PolarHBondContact O-N 3.11Å; T394-G410 WeakPolarHBondContact OG1-CA 3.33Å; T394-G410 PolarHBondContact OG1-N 2.81Å
411	F	91.5	Very high	87.7	Confident	0 Å²	0	25 Å²	25	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	160.6	-170.8	-56.1	-81.3	0	0	0	110.7	A362 M363 V364 M368 V393 L409 G413 H416 M417 F420	A362-F411 CarbonylContact C-O 3.47Å; A362-F411 WeakPolarHBondContact CA-O 3.18Å; M363-F411 PolarHBondContact N-O 2.91Å; V364-F411 PolarHBondContact N-O 3.08Å; V364-F411 PolarHBondContact O-N 2.92Å; M368-F411 HydrophobicContact CE-CE2 3.96Å; M368-F411 HydrophobicContact CE-CZ 3.6Å; M368-F411 HydrophobicContact SD-CZ 4.45Å; V393-F411 HydrophobicContact CG1-CD1 4.33Å; V393-F411 HydrophobicContact CG1-CE1 3.9Å; V393-F411 HydrophobicContact CG1-CZ 4.47Å; V393-F411 HydrophobicContact CG2-CD1 3.9Å; V393-F411 HydrophobicContact CG2-CE1 3.95Å; L409-F411 HydrophobicContact CB-CE1 4.41Å; L409-F411 HydrophobicContact CB-CE2 3.51Å; L409-F411 HydrophobicContact CB-CZ 3.45Å; L409-F411 VanDerWaalsContact CB-CZ 3.45Å; L409-F411 HydrophobicContact CD1-CZ 3.9Å; L409-F411 HydrophobicContact CG-CZ 4.33Å; F411-G413 VanDerWaalsContact C-N 3.29Å; F411-G413 PolarHBondContact O-N 3.16Å; F411-H416 AromaticContact CD1-CD2 3.89Å; F411-H416 AromaticContact CD1-NE2 3.67Å; F411-M417 HydrophobicContact CB-CB 4.25Å; F411-M417 HydrophobicContact CD1-CB 4.3Å; F411-M417 HydrophobicContact CD2-CB 3.68Å; F411-M417 HydrophobicContact CD2-CG 3.71Å; F411-M417 HydrophobicContact CD2-SD 4.47Å; F411-M417 HydrophobicContact CE2-CB 4.07Å; F411-M417 HydrophobicContact CE2-CG 3.64Å; F411-M417 HydrophobicContact CG-CB 3.8Å; F411-M417 HydrophobicContact CG-CG 4.31Å; F411-M417 HydrophobicContact CZ-CG 4.19Å; F411-F420 HydrophobicContact CD1-CB 4.37Å; F411-F420 HydrophobicContact CE1-CB 3.72Å; F411-F420 AromaticContact CE1-CD1 3.72Å; F411-F420 HydrophobicContact CE1-CD1 3.72Å; F411-F420 HydrophobicContact CE1-CD2 4.13Å; F411-F420 HydrophobicContact CE1-CE1 4.32Å; F411-F420 AromaticContact CE1-CG 3.6Å; F411-F420 HydrophobicContact CE1-CG 3.6Å; F411-F420 AromaticContact CZ-CD1 3.97Å; F411-F420 HydrophobicContact CZ-CD1 3.97Å; F411-F420 HydrophobicContact CZ-CE1 4.45Å; F411-F420 HydrophobicContact CZ-CG 4.31Å
412	L	87.4	Confident	88.4	Confident	20 Å²	20	19.4 Å²	19.4	11%	0.105	11%	0.114	C	C	.	.	S	Bend	trans	-67.9	-27.7	174.7	-65.8	174.2	0	0	0	112.8	D153 A360 H416	D153-L412 WeakPolarHBondContact O-CB 3.43Å; D153-L412 VanDerWaalsContact O-CD1 3.22Å; D153-L412 WeakPolarHBondContact O-CD1 3.41Å; A360-L412 HydrophobicContact CB-CD2 4.13Å; L412-H416 PolarHBondContact N-ND1 3.01Å
413	G	86.2	Confident	89.3	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.1	C	C	.	.	S	Bend	trans	-176	-169.1	176	0	0	0	0	0	112.7	D153 F411 M417	D153-G413 VanDerWaalsContact CG-CA 3.49Å; D153-G413 VanDerWaalsContact OD2-CA 3.23Å; D153-G413 WeakPolarHBondContact OD2-CA 3.45Å; F411-G413 VanDerWaalsContact C-N 3.29Å; F411-G413 PolarHBondContact O-N 3.16Å; G413-M417 PolarHBondContact O-N 2.84Å; G413-M417 VanDerWaalsContact O-N 3.12Å
414	L	84.5	Confident	89.9	Confident	48 Å²	48	18 Å²	18	25%	0.251	10%	0.098	S	C	.	.	H	α-helix	trans	-70.1	-44.7	-177.7	-78	-161	0	0	0	114.1	D153 V364 H416 M417 E418 P437 V529	D153-L414 PolarHBondContact OD2-N 3Å; V364-L414 HydrophobicContact CG1-CD2 4.08Å; L414-H416 PolarHBondContact O-N 2.71Å; L414-M417 HydrophobicContact CD2-CE 3.82Å; L414-M417 WeakPolarHBondContact O-CB 3.4Å; L414-M417 PolarHBondContact O-N 2.93Å; L414-M417 VanDerWaalsContact O-N 3.09Å; L414-E418 PolarHBondContact O-N 2.62Å; L414-P437 HydrophobicContact CD2-CB 3.83Å; L414-P437 HydrophobicContact CD2-CG 3.83Å; L414-V529 HydrophobicContact CD1-CG1 4.48Å; L414-V529 WeakPolarHBondContact CD1-O 3.38Å; L414-V529 HydrophobicContact CD2-CG1 3.92Å; L414-V529 HydrophobicContact CG-CG1 4.06Å
415	L	85.6	Confident	90	Very high	25 Å²	25	21.5 Å²	21.5	13%	0.131	11%	0.108	C	C	.	.	H	α-helix	trans	-64.4	-37.4	-178.2	179.5	62.1	0	0	0	110.1	R121 I123 H151 D153 F154 E418 V419	R121-L415 VanDerWaalsContact NH1-CD1 3.3Å; I123-L415 HydrophobicContact CD1-CD1 4.13Å; I123-L415 HydrophobicContact CD1-CD2 3.82Å; I123-L415 HydrophobicContact CD1-CG 4.28Å; H151-L415 HydrophobicContact CB-CD2 3.99Å; H151-L415 WeakPolarHBondContact CD2-CD2 3.28Å; H151-L415 VanDerWaalsContact CG-CD2 3.45Å; D153-L415 WeakPolarHBondContact OD2-CB 3.41Å; D153-L415 PolarHBondContact OD2-N 3.37Å; F154-L415 HydrophobicContact CE2-CD2 4.08Å; F154-L415 HydrophobicContact CE2-CG 4.21Å; L415-E418 PolarHBondContact O-N 3.06Å; L415-V419 HydrophobicContact CD1-CG2 4.05Å; L415-V419 HydrophobicContact CG-CG2 4.29Å; L415-V419 VanDerWaalsContact O-CB 3.27Å; L415-V419 WeakPolarHBondContact O-CB 3.45Å; L415-V419 WeakPolarHBondContact O-CG2 3.36Å; L415-V419 PolarHBondContact O-N 2.6Å
416	H	89.6	Confident	90	Very high	2 Å²	2	23.2 Å²	23.2	1%	0.009	11%	0.111	C	C	.	.	H	α-helix	trans	-61.5	-49.5	171	176	-170.9	0	0	0	110.9	D153 F154 D390 S392 V393 F411 L412 L414 E418 V419 F420	D153-H416 HydrophobicContact CB-CB 4.17Å; D153-H416 PolarHBondContact OD2-N 2.76Å; F154-H416 HydrophobicContact CE1-CB 3.82Å; F154-H416 HydrophobicContact CZ-CB 4.16Å; D390-H416 IonicContact OD2-CE1 3.34Å; D390-H416 IonicContact OD2-NE2 3.69Å; D390-H416 PolarHBondContact OD2-NE2 2.83Å; S392-H416 PolarHBondContact OG-CE1 3.1Å; V393-H416 WeakPolarHBondContact CG2-NE2 2.9Å; F411-H416 AromaticContact CD1-CD2 3.89Å; F411-H416 AromaticContact CD1-NE2 3.67Å; L412-H416 PolarHBondContact N-ND1 3.01Å; L414-H416 PolarHBondContact O-N 2.71Å; H416-E418 VanDerWaalsContact C-N 3.32Å; H416-E418 PolarHBondContact O-N 3.08Å; H416-V419 PolarHBondContact O-N 2.77Å; H416-F420 WeakPolarHBondContact O-CB 3.26Å; H416-F420 PolarHBondContact O-N 3.44Å
417	M	89.8	Confident	89.9	Confident	20 Å²	20	27 Å²	27	10%	0.099	13%	0.128	C	C	.	.	H	α-helix	trans	-55.3	-43.8	175.5	-178.4	-171.9	75.9	0	0	112.9	A366 M368 F411 G413 L414 N421 V434 P437	A366-M417 HydrophobicContact CB-SD 3.6Å; A366-M417 VanDerWaalsContact CB-SD 3.6Å; M368-M417 HydrophobicContact CE-CG 4.07Å; F411-M417 HydrophobicContact CB-CB 4.25Å; F411-M417 HydrophobicContact CD1-CB 4.3Å; F411-M417 HydrophobicContact CD2-CB 3.68Å; F411-M417 HydrophobicContact CD2-CG 3.71Å; F411-M417 HydrophobicContact CD2-SD 4.47Å; F411-M417 HydrophobicContact CE2-CB 4.07Å; F411-M417 HydrophobicContact CE2-CG 3.64Å; F411-M417 HydrophobicContact CG-CB 3.8Å; F411-M417 HydrophobicContact CG-CG 4.31Å; F411-M417 HydrophobicContact CZ-CG 4.19Å; G413-M417 PolarHBondContact O-N 2.84Å; G413-M417 VanDerWaalsContact O-N 3.12Å; L414-M417 HydrophobicContact CD2-CE 3.82Å; L414-M417 WeakPolarHBondContact O-CB 3.4Å; L414-M417 PolarHBondContact O-N 2.93Å; L414-M417 VanDerWaalsContact O-N 3.09Å; M417-N421 WeakPolarHBondContact O-CB 3.37Å; M417-N421 PolarHBondContact O-N 2.84Å; M417-V434 HydrophobicContact CE-CG1 4.42Å; M417-V434 HydrophobicContact SD-CG1 4.08Å; M417-P437 HydrophobicContact SD-CB 4.49Å
418	E	88	Confident	89.7	Confident	76 Å²	76	29.9 Å²	29.9	36%	0.355	14%	0.14	S	C	.	.	H	α-helix	trans	-66.1	-45.7	177.7	-75.9	-179.6	-149.6	0	0	112.9	R121 L414 L415 H416 F420 N421 Q422	R121-E418 IonicContact CZ-OE2 3.18Å; R121-E418 IonicContact NH1-OE2 2.75Å; R121-E418 PolarHBondContact NH1-OE2 2.77Å; R121-E418 IonicContact NH2-OE2 2.75Å; R121-E418 PolarHBondContact NH2-OE2 2.84Å; R121-E418 VanDerWaalsContact NH2-OE2 3.15Å; L414-E418 PolarHBondContact O-N 2.62Å; L415-E418 PolarHBondContact O-N 3.06Å; H416-E418 VanDerWaalsContact C-N 3.32Å; H416-E418 PolarHBondContact O-N 3.08Å; E418-F420 VanDerWaalsContact C-N 3.34Å; E418-N421 WeakPolarHBondContact O-CB 3.45Å; E418-N421 PolarHBondContact O-N 3Å; E418-Q422 WeakPolarHBondContact O-CB 3.26Å; E418-Q422 PolarHBondContact O-N 3.26Å
419	V	90.4	Very high	89.5	Confident	3 Å²	3	35.7 Å²	35.7	2%	0.018	17%	0.172	C	C	.	.	H	α-helix	trans	-63.5	-42.4	178.1	165.4	0	0	0	0	110.1	V117 I123 V125 F154 L415 H416 Q422 R423	V117-V419 HydrophobicContact CG1-CG1 4.18Å; V117-V419 HydrophobicContact CG2-CB 4.5Å; V117-V419 HydrophobicContact CG2-CG1 4.21Å; V117-V419 HydrophobicContact CG2-CG2 4.05Å; I123-V419 HydrophobicContact CD1-CG2 4.43Å; V125-V419 HydrophobicContact CB-CG1 4.45Å; V125-V419 HydrophobicContact CG1-CG1 3.74Å; V125-V419 HydrophobicContact CG2-CG1 3.85Å; V125-V419 HydrophobicContact CG2-CG2 4.26Å; F154-V419 HydrophobicContact CZ-CB 4.42Å; F154-V419 HydrophobicContact CZ-CG1 4.49Å; F154-V419 HydrophobicContact CZ-CG2 4.38Å; L415-V419 HydrophobicContact CD1-CG2 4.05Å; L415-V419 HydrophobicContact CG-CG2 4.29Å; L415-V419 VanDerWaalsContact O-CB 3.27Å; L415-V419 WeakPolarHBondContact O-CB 3.45Å; L415-V419 WeakPolarHBondContact O-CG2 3.36Å; L415-V419 PolarHBondContact O-N 2.6Å; H416-V419 PolarHBondContact O-N 2.77Å; V419-Q422 PolarHBondContact O-N 3.13Å; V419-R423 WeakPolarHBondContact O-CB 3.31Å; V419-R423 VanDerWaalsContact O-CG 3.25Å; V419-R423 WeakPolarHBondContact O-CG 3.5Å; V419-R423 PolarHBondContact O-N 2.92Å
420	F	92	Very high	89.2	Confident	5 Å²	5	36.3 Å²	36.3	2%	0.022	18%	0.178	C	C	.	.	H	α-helix	trans	-61.2	-44.8	174.6	-172.6	-87.8	0	0	0	111.7	M368 L386 T387 V393 L409 F411 H416 E418 R423 L424	M368-F420 HydrophobicContact CE-CD1 4.41Å; M368-F420 HydrophobicContact SD-CD1 4.46Å; L386-F420 HydrophobicContact CB-CE2 4.07Å; L386-F420 HydrophobicContact CB-CZ 4.2Å; L386-F420 HydrophobicContact CD2-CD1 4.19Å; L386-F420 HydrophobicContact CD2-CD2 3.64Å; L386-F420 HydrophobicContact CD2-CE1 4.09Å; L386-F420 HydrophobicContact CD2-CE2 3.52Å; L386-F420 HydrophobicContact CD2-CG 3.98Å; L386-F420 HydrophobicContact CD2-CZ 3.76Å; L386-F420 HydrophobicContact CG-CD2 3.91Å; L386-F420 HydrophobicContact CG-CE2 3.52Å; L386-F420 HydrophobicContact CG-CZ 4.03Å; T387-F420 HydrophobicContact CG2-CE2 3.92Å; T387-F420 HydrophobicContact CG2-CZ 3.85Å; V393-F420 HydrophobicContact CB-CE2 4.24Å; V393-F420 HydrophobicContact CG1-CE2 4.08Å; V393-F420 HydrophobicContact CG1-CZ 4.17Å; V393-F420 HydrophobicContact CG2-CD2 3.76Å; V393-F420 HydrophobicContact CG2-CE2 3.78Å; L409-F420 HydrophobicContact CD1-CD1 4.27Å; L409-F420 HydrophobicContact CD1-CE1 3.5Å; L409-F420 VanDerWaalsContact CD1-CE1 3.5Å; L409-F420 HydrophobicContact CD1-CZ 4.09Å; F411-F420 HydrophobicContact CD1-CB 4.37Å; F411-F420 HydrophobicContact CE1-CB 3.72Å; F411-F420 AromaticContact CE1-CD1 3.72Å; F411-F420 HydrophobicContact CE1-CD1 3.72Å; F411-F420 HydrophobicContact CE1-CD2 4.13Å; F411-F420 HydrophobicContact CE1-CE1 4.32Å; F411-F420 AromaticContact CE1-CG 3.6Å; F411-F420 HydrophobicContact CE1-CG 3.6Å; F411-F420 AromaticContact CZ-CD1 3.97Å; F411-F420 HydrophobicContact CZ-CD1 3.97Å; F411-F420 HydrophobicContact CZ-CE1 4.45Å; F411-F420 HydrophobicContact CZ-CG 4.31Å; H416-F420 WeakPolarHBondContact O-CB 3.26Å; H416-F420 PolarHBondContact O-N 3.44Å; E418-F420 VanDerWaalsContact C-N 3.34Å; F420-R423 PolarHBondContact O-N 3.39Å; F420-L424 HydrophobicContact CD1-CD1 4.06Å; F420-L424 HydrophobicContact CD1-CG 4.26Å; F420-L424 HydrophobicContact CE1-CD1 3.78Å; F420-L424 HydrophobicContact CE1-CD2 4.41Å; F420-L424 HydrophobicContact CE1-CG 4.07Å; F420-L424 PolarHBondContact O-N 3.35Å
421	N	90.9	Very high	88.9	Confident	44 Å²	44	38.6 Å²	38.6	24%	0.235	19%	0.193	C	C	.	.	H	α-helix	trans	-61.1	-45.4	174.9	175.9	73.1	0	0	0	112.3	M368 M417 E418 R423 L424 E425 V432 V434	M368-N421 HydrophobicContact CE-CB 4.23Å; M417-N421 WeakPolarHBondContact O-CB 3.37Å; M417-N421 PolarHBondContact O-N 2.84Å; E418-N421 WeakPolarHBondContact O-CB 3.45Å; E418-N421 PolarHBondContact O-N 3Å; N421-R423 VanDerWaalsContact C-N 3.3Å; N421-R423 PolarHBondContact O-N 3.36Å; N421-L424 PolarHBondContact O-N 3.09Å; N421-E425 PolarHBondContact O-N 3.34Å; N421-E425 VanDerWaalsContact O-N 3.15Å; N421-V432 WeakPolarHBondContact OD1-CG2 3.47Å; N421-V434 WeakPolarHBondContact OD1-CG2 3.29Å
422	Q	90.5	Very high	88.7	Confident	32 Å²	32	39 Å²	39	15%	0.15	20%	0.196	C	C	.	.	H	α-helix	trans	-63.9	-35.1	176.6	-175.6	169.7	-9.6	0	0	111.8	V117 E120 E418 V419 E425 Q426	V117-Q422 HydrophobicContact CB-CG 4.37Å; V117-Q422 HydrophobicContact CG2-CB 4.47Å; V117-Q422 HydrophobicContact CG2-CG 4.16Å; E120-Q422 PolarHBondContact OE2-NE2 2.93Å; E418-Q422 WeakPolarHBondContact O-CB 3.26Å; E418-Q422 PolarHBondContact O-N 3.26Å; V419-Q422 PolarHBondContact O-N 3.13Å; Q422-E425 PolarHBondContact O-N 2.99Å; Q422-Q426 HydrophobicContact CG-CG 4.36Å; Q422-Q426 WeakPolarHBondContact O-CB 3.43Å; Q422-Q426 VanDerWaalsContact O-CG 3.32Å; Q422-Q426 WeakPolarHBondContact O-CG 3.33Å; Q422-Q426 PolarHBondContact O-N 2.87Å
423	R	91.9	Very high	88.6	Confident	23 Å²	23	38 Å²	38	9%	0.087	19%	0.191	C	C	.	.	H	α-helix	trans	-70.5	-36	174	-70.5	-178.8	72.4	-166.4	-3.6	113	V117 L386 V419 F420 N421 E425 Q426 E427	V117-R423 HydrophobicContact CG1-CG 3.87Å; L386-R423 HydrophobicContact CD1-CB 4.35Å; L386-R423 HydrophobicContact CD2-CB 4Å; V419-R423 WeakPolarHBondContact O-CB 3.31Å; V419-R423 VanDerWaalsContact O-CG 3.25Å; V419-R423 WeakPolarHBondContact O-CG 3.5Å; V419-R423 PolarHBondContact O-N 2.92Å; F420-R423 PolarHBondContact O-N 3.39Å; N421-R423 VanDerWaalsContact C-N 3.3Å; N421-R423 PolarHBondContact O-N 3.36Å; R423-E425 VanDerWaalsContact C-N 3.31Å; R423-E425 PolarHBondContact O-N 2.86Å; R423-Q426 PolarHBondContact O-N 3.03Å; R423-E427 IonicContact CZ-OE1 2.71Å; R423-E427 IonicContact NE-OE1 2.84Å; R423-E427 PolarHBondContact NE-OE1 2.86Å; R423-E427 IonicContact NE-OE2 2.93Å; R423-E427 IonicContact NH2-OE1 3.75Å; R423-E427 PolarHBondContact NH2-OE1 2.67Å; R423-E427 IonicContact NH2-OE2 3.09Å; R423-E427 PolarHBondContact NH2-OE2 3.06Å; R423-E427 VanDerWaalsContact O-CB 3.25Å; R423-E427 WeakPolarHBondContact O-CB 3.37Å; R423-E427 PolarHBondContact O-N 2.86Å
424	L	91.1	Very high	88.6	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-60.1	-41.7	170.5	-72.9	177.7	0	0	0	111.8	M368 L379 A382 I383 L386 F420 N421 Y428 N429 A430	M368-L424 HydrophobicContact SD-CD1 4.22Å; L379-L424 HydrophobicContact CD1-CD1 4.22Å; A382-L424 HydrophobicContact CB-CD2 3.81Å; I383-L424 HydrophobicContact CG1-CD1 4.25Å; I383-L424 HydrophobicContact CG1-CD2 4.2Å; L386-L424 HydrophobicContact CB-CD2 4.46Å; L386-L424 HydrophobicContact CD2-CD2 3.78Å; L386-L424 HydrophobicContact CD2-CG 3.9Å; F420-L424 HydrophobicContact CD1-CD1 4.06Å; F420-L424 HydrophobicContact CD1-CG 4.26Å; F420-L424 HydrophobicContact CE1-CD1 3.78Å; F420-L424 HydrophobicContact CE1-CD2 4.41Å; F420-L424 HydrophobicContact CE1-CG 4.07Å; F420-L424 PolarHBondContact O-N 3.35Å; N421-L424 PolarHBondContact O-N 3.09Å; L424-Y428 HydrophobicContact CD2-CD2 4.49Å; L424-Y428 CarbonylContact O-C 3.52Å; L424-Y428 WeakPolarHBondContact O-CB 3.43Å; L424-Y428 PolarHBondContact O-N 3.08Å; L424-N429 PolarHBondContact O-N 3.42Å; L424-A430 PolarHBondContact O-N 3.04Å
425	E	89.4	Confident	88.5	Confident	100 Å²	100	37.6 Å²	37.6	47%	0.467	19%	0.19	S	C	.	.	H	α-helix	trans	-71	-44.5	177.9	-171.1	155.5	-124.3	0	0	112.2	N421 Q422 R423 N429 S431	N421-E425 PolarHBondContact O-N 3.34Å; N421-E425 VanDerWaalsContact O-N 3.15Å; Q422-E425 PolarHBondContact O-N 2.99Å; R423-E425 VanDerWaalsContact C-N 3.31Å; R423-E425 PolarHBondContact O-N 2.86Å; E425-N429 VanDerWaalsContact O-CA 3.22Å; E425-N429 WeakPolarHBondContact O-CA 3.35Å; E425-N429 PolarHBondContact O-N 3.19Å; E425-N429 VanDerWaalsContact O-N 3.15Å; E425-S431 PolarHBondContact OE1-OG 3.47Å
426	Q	89.3	Confident	88.2	Confident	66 Å²	66	38.9 Å²	38.9	31%	0.308	20%	0.201	S	C	.	.	H	α-helix	trans	-79.3	-42.5	-176.5	-69.8	-178.4	-12.8	0	0	114.5	E120 Q422 R423	E120-Q426 PolarHBondContact OE2-NE2 3.12Å; Q422-Q426 HydrophobicContact CG-CG 4.36Å; Q422-Q426 WeakPolarHBondContact O-CB 3.43Å; Q422-Q426 VanDerWaalsContact O-CG 3.32Å; Q422-Q426 WeakPolarHBondContact O-CG 3.33Å; Q422-Q426 PolarHBondContact O-N 2.87Å; R423-Q426 PolarHBondContact O-N 3.03Å
427	E	88.9	Confident	88	Confident	80 Å²	80	40.4 Å²	40.4	37%	0.374	21%	0.211	S	C	.	.	H	α-helix	trans	-86.6	-28.5	-175.4	-61.5	178.1	-168.4	0	0	112.8	R423	R423-E427 IonicContact CZ-OE1 2.71Å; R423-E427 IonicContact NE-OE1 2.84Å; R423-E427 PolarHBondContact NE-OE1 2.86Å; R423-E427 IonicContact NE-OE2 2.93Å; R423-E427 IonicContact NH2-OE1 3.75Å; R423-E427 PolarHBondContact NH2-OE1 2.67Å; R423-E427 IonicContact NH2-OE2 3.09Å; R423-E427 PolarHBondContact NH2-OE2 3.06Å; R423-E427 VanDerWaalsContact O-CB 3.25Å; R423-E427 WeakPolarHBondContact O-CB 3.37Å; R423-E427 PolarHBondContact O-N 2.86Å
428	Y	88.9	Confident	87.9	Confident	65 Å²	65	40.3 Å²	40.3	26%	0.255	21%	0.212	S	C	.	.	H	α-helix	trans	-124.8	-1.4	-172.2	-58.3	-81.7	0	0	0	114.5	A382 R385 L386 L424 A430	A382-Y428 HydrophobicContact CB-CD1 4.05Å; A382-Y428 HydrophobicContact CB-CD2 4.1Å; A382-Y428 HydrophobicContact CB-CG 3.63Å; R385-Y428 HydrophobicContact CB-CE1 4.06Å; L386-Y428 HydrophobicContact CB-CE2 4.23Å; L386-Y428 HydrophobicContact CD1-CE2 4.48Å; L424-Y428 HydrophobicContact CD2-CD2 4.49Å; L424-Y428 CarbonylContact O-C 3.52Å; L424-Y428 WeakPolarHBondContact O-CB 3.43Å; L424-Y428 PolarHBondContact O-N 3.08Å; Y428-A430 PolarHBondContact O-N 3.12Å
429	N	88.1	Confident	88	Confident	140 Å²	140	36.8 Å²	36.8	75%	0.749	20%	0.195	S	C	*	.			trans	53.3	37.7	-175.3	-162	100.2	0	0	0	112.1	L424 E425	L424-N429 PolarHBondContact O-N 3.42Å; E425-N429 VanDerWaalsContact O-CA 3.22Å; E425-N429 WeakPolarHBondContact O-CA 3.35Å; E425-N429 PolarHBondContact O-N 3.19Å; E425-N429 VanDerWaalsContact O-N 3.15Å
430	A	87.8	Confident	88	Confident	14 Å²	14	37 Å²	37	12%	0.116	20%	0.197	C	C	.	.			trans	-108.4	87.4	-174.8	0	0	0	0	0	111.2	L379 A382 L424 Y428	L379-A430 HydrophobicContact CD1-CB 4.16Å; A382-A430 HydrophobicContact CB-CB 4.24Å; L424-A430 PolarHBondContact O-N 3.04Å; Y428-A430 PolarHBondContact O-N 3.12Å
431	S	84.2	Confident	87.9	Confident	47 Å²	47	37 Å²	37	33%	0.329	20%	0.197	S	C	.	.			trans	-74.8	125.7	178.2	-59.1	0	0	0	0	111.6	E425	E425-S431 PolarHBondContact OE1-OG 3.47Å
432	V	88	Confident	87.9	Confident	8 Å²	8	36.6 Å²	36.6	5%	0.048	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	153.5	-175.7	-60.3	0	0	0	0	114.6	M368 Y369 L379 N421 V434	M368-V432 HydrophobicContact SD-CG2 4.25Å; Y369-V432 CarbonylContact O-C 3.51Å; Y369-V432 WeakPolarHBondContact O-CA 3.44Å; Y369-V432 WeakPolarHBondContact O-CB 2.95Å; L379-V432 HydrophobicContact CD1-CG1 3.44Å; L379-V432 VanDerWaalsContact CD1-CG1 3.44Å; L379-V432 HydrophobicContact CD2-CG1 3.55Å; L379-V432 HydrophobicContact CG-CG1 4.16Å; N421-V432 WeakPolarHBondContact OD1-CG2 3.47Å; V432-V434 HydrophobicContact CG2-CG2 3.87Å
433	I	85.9	Confident	87.8	Confident	1 Å²	1	35.1 Å²	35.1	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	105.8	164.5	-55.9	172	0	0	0	107.2	M368 Y369 M371 L403 I667 L670	M368-I433 WeakPolarHBondContact CA-O 3.46Å; Y369-I433 PolarHBondContact N-O 3.24Å; Y369-I433 PolarHBondContact O-N 3.03Å; M371-I433 HydrophobicContact CG-CG1 4.44Å; M371-I433 HydrophobicContact SD-CD1 3.95Å; M371-I433 HydrophobicContact SD-CG1 3.44Å; M371-I433 WeakPolarHBondContact SD-CG1 3.34Å; L403-I433 HydrophobicContact CD1-CG2 4.11Å; L403-I433 HydrophobicContact CD2-CD1 3.95Å; L403-I433 HydrophobicContact CD2-CG2 4.41Å; I433-I667 HydrophobicContact CD1-CD1 3.76Å; I433-I667 HydrophobicContact CD1-CG1 4.02Å; I433-I667 HydrophobicContact CG1-CD1 4.06Å; I433-I667 HydrophobicContact CG1-CG1 4.16Å; I433-I667 HydrophobicContact CG2-CG1 4.11Å; I433-L670 HydrophobicContact CG2-CD1 4.42Å
434	V	84.9	Confident	87.5	Confident	25 Å²	25	36.4 Å²	36.4	15%	0.152	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	127.7	169.8	-166.3	0	0	0	0	108.6	A366 M368 M417 N421 V432	A366-V434 HydrophobicContact CB-CG1 3.84Å; M368-V434 HydrophobicContact CE-CG1 4.22Å; M368-V434 HydrophobicContact CE-CG2 4.05Å; M368-V434 HydrophobicContact CG-CG1 4.39Å; M368-V434 HydrophobicContact CG-CG2 4.26Å; M417-V434 HydrophobicContact CE-CG1 4.42Å; M417-V434 HydrophobicContact SD-CG1 4.08Å; N421-V434 WeakPolarHBondContact OD1-CG2 3.29Å; V432-V434 HydrophobicContact CG2-CG2 3.87Å
435	T	82.8	Confident	87.1	Confident	13 Å²	13	36.7 Å²	36.7	8%	0.08	20%	0.196	C	C	.	.	P	Polyproline II helix	trans	-79.7	166.1	172.2	51.7	0	0	0	0	111.2	G367 Y369 L403 L670	G367-T435 WeakPolarHBondContact CA-OG1 3.15Å; G367-T435 PolarHBondContact N-OG1 3.06Å; G367-T435 PolarHBondContact O-N 3.16Å; G367-T435 PolarHBondContact O-OG1 3.29Å; Y369-T435 HydrophobicContact CD2-CG2 4.16Å; Y369-T435 HydrophobicContact CE2-CG2 3.9Å; L403-T435 HydrophobicContact CD1-CG2 4.09Å; T435-L670 HydrophobicContact CG2-CD1 4.05Å
436	S	79.7	Confident	86.4	Confident	53 Å²	53	34.6 Å²	34.6	37%	0.371	19%	0.192	S	C	.	.	P	Polyproline II helix	trans	-57.1	134.5	179.1	-57.6	0	0	0	0	111.5
437	P	85.4	Confident	85.3	Confident	34 Å²	34	33 Å²	33	22%	0.221	19%	0.189	C	C	.	.	P	Polyproline II helix	trans	-63.8	148.7	179.7	26.2	-34.6	0	0	0	111.8	V364 L414 M417 V529 V530	V364-P437 HydrophobicContact CG1-CB 3.54Å; L414-P437 HydrophobicContact CD2-CB 3.83Å; L414-P437 HydrophobicContact CD2-CG 3.83Å; M417-P437 HydrophobicContact SD-CB 4.49Å; P437-V529 HydrophobicContact CB-CG1 4.26Å; P437-V529 HydrophobicContact CG-CG1 4.34Å; P437-V530 HydrophobicContact CG-CG2 4.12Å
438	T	87.1	Confident	84.1	Confident	18 Å²	18	32.9 Å²	32.9	11%	0.11	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-137.4	159.6	-178.2	55.1	0	0	0	0	110.5	V364 F365 R408 P464	V364-T438 CarbonylContact C-O 3.59Å; V364-T438 WeakPolarHBondContact CA-O 3.34Å; F365-T438 PolarHBondContact N-O 3.02Å; F365-T438 PolarHBondContact O-N 2.88Å; F365-T438 PolarHBondContact O-OG1 3.29Å; R408-T438 PolarHBondContact NH2-OG1 2.8Å; T438-P464 HydrophobicContact CG2-CG 3.96Å
439	V	90.5	Very high	82.8	Confident	1 Å²	1	37.2 Å²	37.2	1%	0.006	22%	0.221	C	C	.	.			trans	-105.2	153.9	174.5	-55.4	0	0	0	0	110.6	Y441 P479 L525 N526 V529	V439-Y441 HydrophobicContact CG2-CD1 4.33Å; V439-Y441 HydrophobicContact CG2-CD2 3.98Å; V439-Y441 HydrophobicContact CG2-CE1 3.89Å; V439-Y441 HydrophobicContact CG2-CE2 3.49Å; V439-Y441 VanDerWaalsContact CG2-CE2 3.49Å; V439-Y441 HydrophobicContact CG2-CG 4.4Å; V439-Y441 VanDerWaalsContact CG2-CZ 3.46Å; V439-Y441 VanDerWaalsContact O-CD2 3.29Å; V439-Y441 WeakPolarHBondContact O-CD2 3.36Å; V439-Y441 PolarHBondContact O-N 3.31Å; V439-P479 HydrophobicContact CB-CG 3.86Å; V439-P479 HydrophobicContact CG2-CG 3.73Å; V439-L525 HydrophobicContact CB-CD2 4.11Å; V439-L525 HydrophobicContact CG1-CB 4.11Å; V439-L525 HydrophobicContact CG1-CD2 3.67Å; V439-L525 HydrophobicContact CG1-CG 3.65Å; V439-N526 HydrophobicContact CG1-CB 4.11Å; V439-N526 HydrophobicContact CG2-CB 3.83Å; V439-V529 HydrophobicContact CG1-CG2 4.2Å
440	P	90.6	Very high	81.6	Confident	8 Å²	8	32.2 Å²	32.2	5%	0.052	19%	0.194	C	C	.	.			trans	-71.3	113.1	171.3	29.9	-33	0	0	0	109.6	M363 F365 T460 P479 Y553	M363-P440 WeakPolarHBondContact O-CD 3.45Å; F365-P440 HydrophobicContact CD2-CB 4.4Å; F365-P440 HydrophobicContact CD2-CG 4.43Å; F365-P440 HydrophobicContact CE2-CB 3.93Å; F365-P440 HydrophobicContact CE2-CG 3.94Å; P440-T460 HydrophobicContact CB-CG2 4.03Å; P440-P479 WeakPolarHBondContact O-CD 3.4Å; P440-P479 WeakPolarHBondContact O-CG 3.36Å; P440-Y553 WeakPolarHBondContact O-CE1 3.49Å; P440-Y553 PolarHBondContact O-OH 3.37Å
441	Y	90.8	Very high	80.5	Confident	4 Å²	4	33.6 Å²	33.6	2%	0.016	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	160.7	170.2	-65.6	-85.1	0	0	0	110.2	V439 T460 I461 E478 N526 L558 I576	V439-Y441 HydrophobicContact CG2-CD1 4.33Å; V439-Y441 HydrophobicContact CG2-CD2 3.98Å; V439-Y441 HydrophobicContact CG2-CE1 3.89Å; V439-Y441 HydrophobicContact CG2-CE2 3.49Å; V439-Y441 VanDerWaalsContact CG2-CE2 3.49Å; V439-Y441 HydrophobicContact CG2-CG 4.4Å; V439-Y441 VanDerWaalsContact CG2-CZ 3.46Å; V439-Y441 VanDerWaalsContact O-CD2 3.29Å; V439-Y441 WeakPolarHBondContact O-CD2 3.36Å; V439-Y441 PolarHBondContact O-N 3.31Å; Y441-T460 CarbonylContact O-C 3.49Å; Y441-T460 WeakPolarHBondContact O-CA 3.35Å; Y441-I461 PolarHBondContact N-O 2.79Å; Y441-I461 VanDerWaalsContact N-O 3.08Å; Y441-I461 PolarHBondContact O-N 2.77Å; Y441-E478 HydrophobicContact CD1-CB 3.86Å; Y441-E478 HydrophobicContact CE1-CB 3.75Å; Y441-N526 WeakPolarHBondContact OH-CB 3.34Å; Y441-N526 PolarHBondContact OH-ND2 2.64Å; Y441-N526 PolarHBondContact OH-OD1 3.03Å; Y441-N526 VanDerWaalsContact OH-OD1 3.08Å; Y441-L558 HydrophobicContact CD1-CD1 3.24Å; Y441-L558 HydrophobicContact CE1-CD1 3.48Å; Y441-L558 VanDerWaalsContact CE1-CD1 3.48Å; Y441-L558 HydrophobicContact CE1-CD2 4.12Å; Y441-L558 HydrophobicContact CE1-CG 4.46Å; Y441-L558 HydrophobicContact CG-CD1 4.14Å; Y441-I576 HydrophobicContact CD1-CG2 4.43Å; Y441-I576 HydrophobicContact CD2-CB 4.29Å; Y441-I576 HydrophobicContact CD2-CD1 3.42Å; Y441-I576 VanDerWaalsContact CD2-CD1 3.42Å; Y441-I576 HydrophobicContact CD2-CG1 4.45Å; Y441-I576 HydrophobicContact CD2-CG2 4.15Å; Y441-I576 HydrophobicContact CE1-CG2 4.06Å; Y441-I576 HydrophobicContact CE2-CB 3.73Å; Y441-I576 HydrophobicContact CE2-CD1 3.67Å; Y441-I576 HydrophobicContact CE2-CG1 4.31Å; Y441-I576 HydrophobicContact CE2-CG2 3.76Å; Y441-I576 HydrophobicContact CG-CD1 4.24Å; Y441-I576 HydrophobicContact CG-CG2 4.44Å
442	K	90.1	Very high	79.3	Confident	37 Å²	37	40.4 Å²	40.4	16%	0.161	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	152.2	167	-74.3	178.2	168.1	-163.7	0	110.9	E458 A459 Y476 L477 Y553	K442-E458 VanDerWaalsContact CE-OE2 3.3Å; K442-E458 WeakPolarHBondContact CE-OE2 3.33Å; K442-E458 IonicContact NZ-OE1 3.61Å; K442-E458 PolarHBondContact NZ-OE1 2.9Å; K442-E458 IonicContact NZ-OE2 3.29Å; K442-E458 PolarHBondContact NZ-OE2 2.8Å; K442-A459 CarbonylContact C-O 3.5Å; K442-A459 WeakPolarHBondContact CA-O 3.15Å; K442-Y476 WeakPolarHBondContact O-CA 3.43Å; K442-L477 HydrophobicContact CB-CB 4.14Å; K442-L477 HydrophobicContact CB-CD1 4.18Å; K442-L477 HydrophobicContact CB-CG 4.34Å; K442-L477 HydrophobicContact CD-CD1 4.21Å; K442-L477 PolarHBondContact N-O 2.72Å; K442-L477 PolarHBondContact O-N 2.7Å; K442-Y553 HydrophobicContact CB-CD1 4.27Å; K442-Y553 HydrophobicContact CB-CE1 4.26Å; K442-Y553 HydrophobicContact CD-CD1 3.88Å; K442-Y553 HydrophobicContact CD-CD2 4.29Å; K442-Y553 HydrophobicContact CD-CE1 3.92Å; K442-Y553 HydrophobicContact CD-CE2 4.34Å; K442-Y553 HydrophobicContact CD-CG 4.06Å; K442-Y553 HydrophobicContact CG-CD1 4.02Å; K442-Y553 HydrophobicContact CG-CE1 3.7Å
443	A	88.2	Confident	78.2	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	132.7	165.9	0	0	0	0	0	110.1	E458 A459 I461 P468 V473 Y476	A443-E458 WeakPolarHBondContact O-CA 3.37Å; A443-A459 PolarHBondContact N-O 3.19Å; A443-A459 PolarHBondContact O-N 3.11Å; A443-I461 HydrophobicContact CB-CD1 3.8Å; A443-P468 HydrophobicContact CB-CG 4.09Å; A443-V473 HydrophobicContact CB-CG1 3.91Å; A443-V473 HydrophobicContact CB-CG2 4.02Å; A443-Y476 HydrophobicContact CB-CD1 3.92Å; A443-Y476 HydrophobicContact CB-CE1 4.25Å
444	I	85.8	Confident	77	Confident	50 Å²	50	51.4 Å²	51.4	26%	0.256	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	112.7	171.5	-56	179.7	0	0	0	107.5	V473 L474 E475 L477	I444-V473 CarbonylContact O-C 3.58Å; I444-V473 WeakPolarHBondContact O-CA 3.49Å; I444-L474 HydrophobicContact CG2-CB 4.43Å; I444-L474 HydrophobicContact CG2-CD1 4.16Å; I444-L474 PolarHBondContact O-N 2.97Å; I444-E475 HydrophobicContact CD1-CB 4.48Å; I444-E475 PolarHBondContact N-O 2.93Å; I444-L477 HydrophobicContact CD1-CD1 4.36Å; I444-L477 HydrophobicContact CD1-CD2 4.29Å; I444-L477 HydrophobicContact CG1-CD1 4.38Å
445	L	83.2	Confident	75.8	Confident	7 Å²	7	53.8 Å²	53.8	4%	0.037	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	129.6	-171.9	-63.9	174.1	0	0	0	111.5	L450 I451 H454 E457 A459	L445-L450 HydrophobicContact CD1-CB 3.94Å; L445-L450 HydrophobicContact CD2-CB 4.41Å; L445-L450 HydrophobicContact CD2-CD1 4.25Å; L445-I451 HydrophobicContact CB-CG1 4.12Å; L445-H454 HydrophobicContact CD1-CB 4.11Å; L445-E457 PolarHBondContact N-O 3.09Å; L445-A459 HydrophobicContact CD1-CB 4.04Å; L445-A459 HydrophobicContact CD2-CB 4.24Å; L445-A459 HydrophobicContact CG-CB 4.19Å
446	S	74.1	Confident	75.1	Confident	56 Å²	56	54.4 Å²	54.4	39%	0.392	31%	0.312	S	S	.	.			trans	-84.1	-10.2	-179.2	68.7	0	0	0	0	114.4	V472	S446-V472 PolarHBondContact N-O 3.15Å; S446-V472 WeakPolarHBondContact OG-CA 3.46Å; S446-V472 PolarHBondContact OG-O 2.94Å
447	S	66.9	Low	74.9	Confident	33 Å²	33	58.1 Å²	58.1	23%	0.231	32%	0.324	C	S	.	.			trans	-120	124.9	-166.5	74.7	0	0	0	0	114.1	K449 L450 I451	S447-K449 PolarHBondContact O-N 2.95Å; S447-L450 PolarHBondContact O-N 2.77Å; S447-L450 WeakPolarHBondContact OG-CG 3.45Å; S447-I451 WeakPolarHBondContact O-CG1 3.23Å; S447-I451 PolarHBondContact O-N 2.81Å; S447-I451 VanDerWaalsContact O-N 3.07Å
448	A	63	Low	74.6	Confident	77 Å²	77	61.1 Å²	61.1	64%	0.636	34%	0.335	S	S	*	.	H	α-helix	trans	-59.2	-14.1	179.5	0	0	0	0	0	115
449	K	62.2	Low	74.5	Confident	155 Å²	155	60.6 Å²	60.6	67%	0.674	33%	0.333	S	S	*	.	H	α-helix	trans	-76.1	-54	170.1	-171.6	-169.9	170.1	-162.7	0	111	S447 I451 K452 E453	S447-K449 PolarHBondContact O-N 2.95Å; K449-I451 VanDerWaalsContact C-N 3.27Å; K449-I451 PolarHBondContact O-N 2.84Å; K449-K452 PolarHBondContact O-N 3.48Å; K449-K452 VanDerWaalsContact O-N 3.13Å; K449-E453 PolarHBondContact O-N 3.37Å
450	L	61.6	Low	74.2	Confident	36 Å²	36	64.7 Å²	64.7	19%	0.188	36%	0.357	C	S	.	.	H	α-helix	trans	-66	-32.1	-179.2	-65.8	178.2	0	0	0	111.8	L445 S447 K452 E453 H454 V472	L445-L450 HydrophobicContact CD1-CB 3.94Å; L445-L450 HydrophobicContact CD2-CB 4.41Å; L445-L450 HydrophobicContact CD2-CD1 4.25Å; S447-L450 PolarHBondContact O-N 2.77Å; S447-L450 WeakPolarHBondContact OG-CG 3.45Å; L450-K452 VanDerWaalsContact C-N 3.25Å; L450-K452 PolarHBondContact O-N 2.94Å; L450-E453 PolarHBondContact O-N 2.7Å; L450-H454 PolarHBondContact O-CD2 2.96Å; L450-H454 PolarHBondContact O-N 3.32Å; L450-V472 HydrophobicContact CD1-CB 3.74Å; L450-V472 HydrophobicContact CD1-CG1 4.31Å; L450-V472 HydrophobicContact CD1-CG2 3.71Å
451	I	65.4	Low	74	Confident	43 Å²	43	64.6 Å²	64.6	22%	0.221	36%	0.357	C	S	.	.	H	α-helix	trans	-57.8	-38.3	173.5	-65.8	168.6	0	0	0	111.4	L445 S447 K449 G455 G456 E457	L445-I451 HydrophobicContact CB-CG1 4.12Å; S447-I451 WeakPolarHBondContact O-CG1 3.23Å; S447-I451 PolarHBondContact O-N 2.81Å; S447-I451 VanDerWaalsContact O-N 3.07Å; K449-I451 VanDerWaalsContact C-N 3.27Å; K449-I451 PolarHBondContact O-N 2.84Å; I451-G455 CarbonylContact O-C 3.55Å; I451-G455 WeakPolarHBondContact O-CA 3.41Å; I451-G455 PolarHBondContact O-N 2.82Å; I451-G455 VanDerWaalsContact O-N 3.08Å; I451-G456 WeakPolarHBondContact CA-O 3.36Å; I451-G456 PolarHBondContact O-N 3.43Å; I451-G456 VanDerWaalsContact O-N 3.1Å; I451-E457 HydrophobicContact CD1-CG 4.14Å; I451-E457 HydrophobicContact CG1-CG 4.37Å; I451-E457 HydrophobicContact CG2-CG 4.14Å
452	K	60	Low	73.7	Confident	189 Å²	189	65.2 Å²	65.2	82%	0.822	36%	0.36	S	S	*	.	H	α-helix	trans	-75.7	-22.2	173.7	-73.8	-174.2	174.4	-175.1	0	114.1	K449 L450	K449-K452 PolarHBondContact O-N 3.48Å; K449-K452 VanDerWaalsContact O-N 3.13Å; L450-K452 VanDerWaalsContact C-N 3.25Å; L450-K452 PolarHBondContact O-N 2.94Å
453	E	63.9	Low	73.4	Confident	129 Å²	129	64.7 Å²	64.7	60%	0.603	36%	0.359	S	S	*	.	H	α-helix	trans	-88	-34.5	-176.3	-160.8	161.3	176.1	0	0	111.7	K449 L450	K449-E453 PolarHBondContact O-N 3.37Å; L450-E453 PolarHBondContact O-N 2.7Å
454	H	60.3	Low	73.2	Confident	111 Å²	111	65.1 Å²	65.1	51%	0.514	36%	0.362	S	S	.	.	H	α-helix	trans	-93.6	-9.4	173.6	-68.4	-79	0	0	0	114.1	L445 L450	L445-H454 HydrophobicContact CD1-CB 4.11Å; L450-H454 PolarHBondContact O-CD2 2.96Å; L450-H454 PolarHBondContact O-N 3.32Å
455	G	59.6	Low	72.9	Confident	75 Å²	75	64.1 Å²	64.1	77%	0.773	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	13.1	177.4	0	0	0	0	0	115.2	I451	I451-G455 CarbonylContact O-C 3.55Å; I451-G455 WeakPolarHBondContact O-CA 3.41Å; I451-G455 PolarHBondContact O-N 2.82Å; I451-G455 VanDerWaalsContact O-N 3.08Å
456	G	69.6	Low	72.9	Confident	27 Å²	27	70.6 Å²	70.6	28%	0.278	39%	0.392	S	S	.	.	S	Bend	trans	-177.8	174.6	-178.2	0	0	0	0	0	112.4	I451	I451-G456 WeakPolarHBondContact CA-O 3.36Å; I451-G456 PolarHBondContact O-N 3.43Å; I451-G456 VanDerWaalsContact O-N 3.1Å
457	E	74.2	Confident	73.3	Confident	131 Å²	131	68.6 Å²	68.6	61%	0.612	38%	0.376	S	S	*	.	S	Bend	trans	-80.8	-18.7	-179.5	-58	-172.3	157.8	0	0	113.2	L445 I451	L445-E457 PolarHBondContact N-O 3.09Å; I451-E457 HydrophobicContact CD1-CG 4.14Å; I451-E457 HydrophobicContact CG1-CG 4.37Å; I451-E457 HydrophobicContact CG2-CG 4.14Å
458	E	80.6	Confident	74	Confident	97 Å²	97	68.3 Å²	68.3	45%	0.453	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	131.9	172.6	-60.3	-173.8	140.8	0	0	111.3	K442 A443	K442-E458 VanDerWaalsContact CE-OE2 3.3Å; K442-E458 WeakPolarHBondContact CE-OE2 3.33Å; K442-E458 IonicContact NZ-OE1 3.61Å; K442-E458 PolarHBondContact NZ-OE1 2.9Å; K442-E458 IonicContact NZ-OE2 3.29Å; K442-E458 PolarHBondContact NZ-OE2 2.8Å; A443-E458 WeakPolarHBondContact O-CA 3.37Å
459	A	83.1	Confident	74.8	Confident	7 Å²	7	70.5 Å²	70.5	6%	0.058	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	122.8	166.3	0	0	0	0	0	111	K442 A443 L445	K442-A459 CarbonylContact C-O 3.5Å; K442-A459 WeakPolarHBondContact CA-O 3.15Å; A443-A459 PolarHBondContact N-O 3.19Å; A443-A459 PolarHBondContact O-N 3.11Å; L445-A459 HydrophobicContact CD1-CB 4.04Å; L445-A459 HydrophobicContact CD2-CB 4.24Å; L445-A459 HydrophobicContact CG-CB 4.19Å
460	T	85.6	Confident	75.6	Confident	86 Å²	86	69.3 Å²	69.3	53%	0.528	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	120.3	174	-53.5	0	0	0	0	110.6	P440 Y441 V462	P440-T460 HydrophobicContact CB-CG2 4.03Å; Y441-T460 CarbonylContact O-C 3.49Å; Y441-T460 WeakPolarHBondContact O-CA 3.35Å; T460-V462 HydrophobicContact CG2-CG2 4.26Å
461	I	86.6	Confident	76.4	Confident	7 Å²	7	72.2 Å²	72.2	4%	0.036	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	104.4	-175.7	-56.3	152.1	0	0	0	108.8	Y441 A443 F467 P468 I576	Y441-I461 PolarHBondContact N-O 2.79Å; Y441-I461 VanDerWaalsContact N-O 3.08Å; Y441-I461 PolarHBondContact O-N 2.77Å; A443-I461 HydrophobicContact CB-CD1 3.8Å; I461-F467 HydrophobicContact CD1-CD2 3.99Å; I461-F467 HydrophobicContact CD1-CE2 4.39Å; I461-F467 HydrophobicContact CG2-CB 4.32Å; I461-F467 HydrophobicContact CG2-CD2 4.3Å; I461-P468 VanDerWaalsContact CD1-CD 3.43Å; I461-P468 HydrophobicContact CD1-CG 4.06Å; I461-I576 HydrophobicContact CG2-CD1 4.17Å
462	V	83.6	Confident	77.1	Confident	16 Å²	16	72.2 Å²	72.2	10%	0.097	39%	0.391	C	S	.	.			trans	-97.2	-26.9	178.7	175	0	0	0	0	112.5	F365 R408 T460	F365-V462 HydrophobicContact CB-CG1 3.77Å; F365-V462 HydrophobicContact CD1-CG1 3.37Å; F365-V462 HydrophobicContact CD2-CG1 4.11Å; F365-V462 HydrophobicContact CE1-CG1 3.89Å; F365-V462 HydrophobicContact CE1-CG2 4.29Å; F365-V462 HydrophobicContact CE2-CG2 4.38Å; F365-V462 HydrophobicContact CG-CG1 3.49Å; F365-V462 VanDerWaalsContact CG-CG1 3.49Å; F365-V462 HydrophobicContact CZ-CG1 4.46Å; F365-V462 HydrophobicContact CZ-CG2 4.22Å; R408-V462 HydrophobicContact CG-CG1 3.77Å; R408-V462 PolarHBondContact NE-O 3.23Å; R408-V462 PolarHBondContact NH2-O 3.39Å; T460-V462 HydrophobicContact CG2-CG2 4.26Å
463	N	83.7	Confident	78.1	Confident	26 Å²	26	63.7 Å²	63.7	14%	0.139	36%	0.355	C	S	.	.	S	Bend	trans	-112.2	119	178.3	-174.4	-22	0	0	0	110.3	A465 Q466	N463-A465 PolarHBondContact O-N 3.38Å; N463-A465 VanDerWaalsContact O-N 3.12Å; N463-A465 WeakPolarHBondContact OD1-CB 3.29Å; N463-A465 PolarHBondContact OD1-N 2.83Å; N463-Q466 HydrophobicContact CB-CG 4.28Å; N463-Q466 WeakPolarHBondContact O-CB 2.99Å; N463-Q466 PolarHBondContact O-N 2.88Å
464	P	83.6	Confident	79	Confident	9 Å²	9	63.3 Å²	63.3	6%	0.058	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-53.2	-27.7	176.2	-30.4	37.3	0	0	0	115.7	T438 Q466 F467 K560 T574 I576	T438-P464 HydrophobicContact CG2-CG 3.96Å; P464-Q466 VanDerWaalsContact C-N 3.26Å; P464-Q466 PolarHBondContact O-N 2.96Å; P464-F467 WeakPolarHBondContact O-CB 3.24Å; P464-F467 PolarHBondContact O-N 3.43Å; P464-K560 WeakPolarHBondContact O-CE 3.43Å; P464-T574 HydrophobicContact CB-CG2 4.09Å; P464-T574 WeakPolarHBondContact CB-O 3.48Å; P464-I576 HydrophobicContact CB-CD1 4.32Å; P464-I576 HydrophobicContact CB-CG1 4.12Å; P464-I576 HydrophobicContact CG-CD1 4.33Å; P464-I576 HydrophobicContact CG-CG1 4.43Å
465	A	80.4	Confident	80.3	Confident	30 Å²	30	62.9 Å²	62.9	25%	0.248	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-62.8	-35.4	175	0	0	0	0	0	111.9	N463 F467 K560 E571	N463-A465 PolarHBondContact O-N 3.38Å; N463-A465 VanDerWaalsContact O-N 3.12Å; N463-A465 WeakPolarHBondContact OD1-CB 3.29Å; N463-A465 PolarHBondContact OD1-N 2.83Å; A465-F467 VanDerWaalsContact C-N 3.32Å; A465-F467 PolarHBondContact O-N 2.91Å; A465-K560 PolarHBondContact O-NZ 2.73Å; A465-E571 HydrophobicContact CB-CB 4.44Å
466	Q	82	Confident	81.8	Confident	143 Å²	143	59.9 Å²	59.9	67%	0.668	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-85.9	5.4	-178.7	-62.5	174.6	-16.2	0	0	113.7	N463 P464 P468	N463-Q466 HydrophobicContact CB-CG 4.28Å; N463-Q466 WeakPolarHBondContact O-CB 2.99Å; N463-Q466 PolarHBondContact O-N 2.88Å; P464-Q466 VanDerWaalsContact C-N 3.26Å; P464-Q466 PolarHBondContact O-N 2.96Å; Q466-P468 WeakPolarHBondContact O-CD 3.47Å
467	F	84.4	Confident	82.9	Confident	14 Å²	14	59.5 Å²	59.5	6%	0.061	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-60.8	119.1	178.1	-173.3	-88.5	0	0	0	110.7	I461 P464 A465 Y476 L558 K560 I576	I461-F467 HydrophobicContact CD1-CD2 3.99Å; I461-F467 HydrophobicContact CD1-CE2 4.39Å; I461-F467 HydrophobicContact CG2-CB 4.32Å; I461-F467 HydrophobicContact CG2-CD2 4.3Å; P464-F467 WeakPolarHBondContact O-CB 3.24Å; P464-F467 PolarHBondContact O-N 3.43Å; A465-F467 VanDerWaalsContact C-N 3.32Å; A465-F467 PolarHBondContact O-N 2.91Å; F467-Y476 HydrophobicContact CD1-CE1 4.22Å; F467-Y476 HydrophobicContact CD2-CE1 4.46Å; F467-Y476 HydrophobicContact CE1-CD1 4.18Å; F467-Y476 AromaticContact CE1-CE1 3.43Å; F467-Y476 HydrophobicContact CE1-CE1 3.43Å; F467-Y476 VanDerWaalsContact CE1-CE1 3.43Å; F467-Y476 HydrophobicContact CE1-CE2 4.22Å; F467-Y476 AromaticContact CE1-CZ 3.46Å; F467-Y476 VanDerWaalsContact CE1-CZ 3.46Å; F467-Y476 WeakPolarHBondContact CE1-OH 3.32Å; F467-Y476 AromaticContact CE2-CD1 3.69Å; F467-Y476 HydrophobicContact CE2-CD1 3.69Å; F467-Y476 AromaticContact CE2-CE1 3.73Å; F467-Y476 HydrophobicContact CE2-CE1 3.73Å; F467-Y476 HydrophobicContact CE2-CG 4.39Å; F467-Y476 AromaticContact CZ-CD1 3.42Å; F467-Y476 HydrophobicContact CZ-CD1 3.42Å; F467-Y476 VanDerWaalsContact CZ-CD1 3.42Å; F467-Y476 HydrophobicContact CZ-CD2 4.2Å; F467-Y476 AromaticContact CZ-CE1 3.16Å; F467-Y476 HydrophobicContact CZ-CE1 3.16Å; F467-Y476 AromaticContact CZ-CE2 3.99Å; F467-Y476 HydrophobicContact CZ-CE2 3.99Å; F467-Y476 AromaticContact CZ-CG 3.94Å; F467-Y476 HydrophobicContact CZ-CG 3.94Å; F467-Y476 AromaticContact CZ-CZ 3.48Å; F467-Y476 VanDerWaalsContact CZ-CZ 3.48Å; F467-L558 HydrophobicContact CE2-CB 4.41Å; F467-L558 HydrophobicContact CZ-CB 4.16Å; F467-K560 HydrophobicContact CB-CD 4.3Å; F467-K560 HydrophobicContact CD1-CB 3.82Å; F467-K560 HydrophobicContact CE1-CB 4.33Å; F467-K560 HydrophobicContact CG-CB 4.38Å; F467-I576 HydrophobicContact CB-CD1 4.43Å; F467-I576 HydrophobicContact CB-CG1 4.45Å; F467-I576 HydrophobicContact CD2-CD1 3.5Å; F467-I576 VanDerWaalsContact CD2-CD1 3.5Å; F467-I576 HydrophobicContact CD2-CG1 3.65Å; F467-I576 HydrophobicContact CD2-CG2 4.28Å; F467-I576 HydrophobicContact CE2-CD1 4.14Å; F467-I576 HydrophobicContact CE2-CG1 4.12Å; F467-I576 HydrophobicContact CE2-CG2 3.88Å; F467-I576 HydrophobicContact CG-CD1 4.34Å; F467-I576 HydrophobicContact CG-CG1 4.24Å
468	P	81.6	Confident	83.8	Confident	27 Å²	27	53.6 Å²	53.6	18%	0.175	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-75.9	148.6	-172.7	29.5	-33.5	0	0	0	112.4	A443 I461 Q466 V472 V473 Y476	A443-P468 HydrophobicContact CB-CG 4.09Å; I461-P468 VanDerWaalsContact CD1-CD 3.43Å; I461-P468 HydrophobicContact CD1-CG 4.06Å; Q466-P468 WeakPolarHBondContact O-CD 3.47Å; P468-V472 HydrophobicContact CB-CG2 4.31Å; P468-V473 HydrophobicContact CB-CG2 4.08Å; P468-V473 HydrophobicContact CG-CG2 3.76Å; P468-Y476 HydrophobicContact CG-CE1 4.39Å; P468-Y476 PolarHBondContact O-OH 3.14Å
469	D	79.4	Confident	84.4	Confident	123 Å²	123	49.1 Å²	49.1	66%	0.658	26%	0.263	S	S	*	.	P	Polyproline II helix	trans	-64.3	145.2	-179.7	-81.5	-47.8	0	0	0	113	S471 V472	D469-S471 PolarHBondContact O-N 2.78Å; D469-V472 VanDerWaalsContact O-CG2 3.25Å; D469-V472 WeakPolarHBondContact O-CG2 3.48Å; D469-V472 PolarHBondContact O-N 2.88Å
470	R	77.9	Confident	84.9	Confident	129 Å²	129	49.1 Å²	49.1	49%	0.487	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-6.3	-178.2	-161.3	174.7	-171.1	133.8	-5.2	114.4	Y476 D557	R470-Y476 WeakPolarHBondContact CA-OH 3.49Å; R470-Y476 HydrophobicContact CB-CE2 4.42Å; R470-Y476 HydrophobicContact CG-CE2 4.13Å; R470-Y476 PolarHBondContact N-OH 2.87Å; R470-D557 IonicContact CZ-OD1 2.86Å; R470-D557 IonicContact NH1-OD1 2.82Å; R470-D557 PolarHBondContact NH1-OD1 3.39Å; R470-D557 IonicContact NH2-OD1 3.2Å; R470-D557 PolarHBondContact NH2-OD1 3.11Å
471	S	79.1	Confident	85.2	Confident	98 Å²	98	45.1 Å²	45.1	69%	0.685	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-20.1	171.7	49.8	0	0	0	0	113.5	D469	D469-S471 PolarHBondContact O-N 2.78Å
472	V	79.1	Confident	85.5	Confident	43 Å²	43	46.8 Å²	46.8	26%	0.261	25%	0.246	S	C	.	.	S	Bend	trans	-118	10.4	-176.7	-60.7	0	0	0	0	113.7	S446 L450 P468 D469	S446-V472 PolarHBondContact N-O 3.15Å; S446-V472 WeakPolarHBondContact OG-CA 3.46Å; S446-V472 PolarHBondContact OG-O 2.94Å; L450-V472 HydrophobicContact CD1-CB 3.74Å; L450-V472 HydrophobicContact CD1-CG1 4.31Å; L450-V472 HydrophobicContact CD1-CG2 3.71Å; P468-V472 HydrophobicContact CB-CG2 4.31Å; D469-V472 VanDerWaalsContact O-CG2 3.25Å; D469-V472 WeakPolarHBondContact O-CG2 3.48Å; D469-V472 PolarHBondContact O-N 2.88Å
473	V	81.9	Confident	86	Confident	10 Å²	10	46 Å²	46	6%	0.061	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	135.5	-178.5	177.9	0	0	0	0	109	A443 I444 P468 E475 Y476	A443-V473 HydrophobicContact CB-CG1 3.91Å; A443-V473 HydrophobicContact CB-CG2 4.02Å; I444-V473 CarbonylContact O-C 3.58Å; I444-V473 WeakPolarHBondContact O-CA 3.49Å; P468-V473 HydrophobicContact CB-CG2 4.08Å; P468-V473 HydrophobicContact CG-CG2 3.76Å; V473-E475 VanDerWaalsContact CG1-O 3.26Å; V473-E475 WeakPolarHBondContact CG1-O 3.38Å; V473-Y476 HydrophobicContact CB-CE1 4.15Å; V473-Y476 HydrophobicContact CG1-CD1 3.92Å; V473-Y476 HydrophobicContact CG1-CD2 4.26Å; V473-Y476 HydrophobicContact CG1-CE1 3.8Å; V473-Y476 HydrophobicContact CG1-CE2 4.16Å; V473-Y476 HydrophobicContact CG1-CG 4.15Å; V473-Y476 HydrophobicContact CG2-CE1 3.85Å
474	L	82.4	Confident	86.4	Confident	121 Å²	121	45 Å²	45	63%	0.634	24%	0.237	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-77.3	-60.1	169.4	-62.8	178.4	0	0	0	109.8	I444	I444-L474 HydrophobicContact CG2-CB 4.43Å; I444-L474 HydrophobicContact CG2-CD1 4.16Å; I444-L474 PolarHBondContact O-N 2.97Å
475	E	87.9	Confident	86.9	Confident	102 Å²	102	44.6 Å²	44.6	48%	0.477	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	146.9	-178.9	-60.8	-169.9	168	0	0	110.9	I444 V473 A555	I444-E475 HydrophobicContact CD1-CB 4.48Å; I444-E475 PolarHBondContact N-O 2.93Å; V473-E475 VanDerWaalsContact CG1-O 3.26Å; V473-E475 WeakPolarHBondContact CG1-O 3.38Å; E475-A555 WeakPolarHBondContact OE2-CB 3.42Å
476	Y	91.7	Very high	87.4	Confident	11 Å²	11	43.3 Å²	43.3	4%	0.043	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	137.9	167	-55.9	-84.9	0	0	0	108.9	K442 A443 F467 P468 R470 V473 A555 A556 L558	K442-Y476 WeakPolarHBondContact O-CA 3.43Å; A443-Y476 HydrophobicContact CB-CD1 3.92Å; A443-Y476 HydrophobicContact CB-CE1 4.25Å; F467-Y476 HydrophobicContact CD1-CE1 4.22Å; F467-Y476 HydrophobicContact CD2-CE1 4.46Å; F467-Y476 HydrophobicContact CE1-CD1 4.18Å; F467-Y476 AromaticContact CE1-CE1 3.43Å; F467-Y476 HydrophobicContact CE1-CE1 3.43Å; F467-Y476 VanDerWaalsContact CE1-CE1 3.43Å; F467-Y476 HydrophobicContact CE1-CE2 4.22Å; F467-Y476 AromaticContact CE1-CZ 3.46Å; F467-Y476 VanDerWaalsContact CE1-CZ 3.46Å; F467-Y476 WeakPolarHBondContact CE1-OH 3.32Å; F467-Y476 AromaticContact CE2-CD1 3.69Å; F467-Y476 HydrophobicContact CE2-CD1 3.69Å; F467-Y476 AromaticContact CE2-CE1 3.73Å; F467-Y476 HydrophobicContact CE2-CE1 3.73Å; F467-Y476 HydrophobicContact CE2-CG 4.39Å; F467-Y476 AromaticContact CZ-CD1 3.42Å; F467-Y476 HydrophobicContact CZ-CD1 3.42Å; F467-Y476 VanDerWaalsContact CZ-CD1 3.42Å; F467-Y476 HydrophobicContact CZ-CD2 4.2Å; F467-Y476 AromaticContact CZ-CE1 3.16Å; F467-Y476 HydrophobicContact CZ-CE1 3.16Å; F467-Y476 AromaticContact CZ-CE2 3.99Å; F467-Y476 HydrophobicContact CZ-CE2 3.99Å; F467-Y476 AromaticContact CZ-CG 3.94Å; F467-Y476 HydrophobicContact CZ-CG 3.94Å; F467-Y476 AromaticContact CZ-CZ 3.48Å; F467-Y476 VanDerWaalsContact CZ-CZ 3.48Å; P468-Y476 HydrophobicContact CG-CE1 4.39Å; P468-Y476 PolarHBondContact O-OH 3.14Å; R470-Y476 WeakPolarHBondContact CA-OH 3.49Å; R470-Y476 HydrophobicContact CB-CE2 4.42Å; R470-Y476 HydrophobicContact CG-CE2 4.13Å; R470-Y476 PolarHBondContact N-OH 2.87Å; V473-Y476 HydrophobicContact CB-CE1 4.15Å; V473-Y476 HydrophobicContact CG1-CD1 3.92Å; V473-Y476 HydrophobicContact CG1-CD2 4.26Å; V473-Y476 HydrophobicContact CG1-CE1 3.8Å; V473-Y476 HydrophobicContact CG1-CE2 4.16Å; V473-Y476 HydrophobicContact CG1-CG 4.15Å; V473-Y476 HydrophobicContact CG2-CE1 3.85Å; Y476-A555 WeakPolarHBondContact O-CA 3.45Å; Y476-A556 PolarHBondContact O-N 3.21Å; Y476-L558 HydrophobicContact CG-CB 4.44Å
477	L	92.8	Very high	87.9	Confident	20 Å²	20	36.7 Å²	36.7	11%	0.105	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	132.4	176.5	-38.8	172.9	0	0	0	109.7	K442 I444 Y553 Q554 A555	K442-L477 HydrophobicContact CB-CB 4.14Å; K442-L477 HydrophobicContact CB-CD1 4.18Å; K442-L477 HydrophobicContact CB-CG 4.34Å; K442-L477 HydrophobicContact CD-CD1 4.21Å; K442-L477 PolarHBondContact N-O 2.72Å; K442-L477 PolarHBondContact O-N 2.7Å; I444-L477 HydrophobicContact CD1-CD1 4.36Å; I444-L477 HydrophobicContact CD1-CD2 4.29Å; I444-L477 HydrophobicContact CG1-CD1 4.38Å; L477-Y553 HydrophobicContact CB-CD1 3.99Å; L477-Y553 HydrophobicContact CB-CG 4.47Å; L477-Q554 CarbonylContact C-O 3.52Å; L477-Q554 VanDerWaalsContact CA-O 3.27Å; L477-Q554 WeakPolarHBondContact CA-O 3.13Å; L477-A555 HydrophobicContact CD2-CB 3.89Å
478	E	92.6	Very high	88.2	Confident	6 Å²	6	37.4 Å²	37.4	3%	0.028	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	145.2	168.7	68.2	-170.1	155.5	0	0	111.1	Y441 M480 R503 P524 Y553 Q554 A556 L558	Y441-E478 HydrophobicContact CD1-CB 3.86Å; Y441-E478 HydrophobicContact CE1-CB 3.75Å; E478-M480 HydrophobicContact CG-SD 3.94Å; E478-R503 IonicContact OE1-CZ 2.72Å; E478-R503 IonicContact OE1-NH1 3.13Å; E478-R503 PolarHBondContact OE1-NH1 2.95Å; E478-R503 IonicContact OE1-NH2 2.78Å; E478-R503 PolarHBondContact OE1-NH2 3.47Å; E478-R503 IonicContact OE2-CZ 3.34Å; E478-R503 IonicContact OE2-NH1 3.66Å; E478-R503 IonicContact OE2-NH2 3.86Å; E478-R503 PolarHBondContact OE2-NH2 3.32Å; E478-P524 HydrophobicContact CG-CB 4.22Å; E478-P524 WeakPolarHBondContact OE2-CB 3.47Å; E478-Y553 WeakPolarHBondContact O-CA 3.35Å; E478-Q554 PolarHBondContact N-O 3.24Å; E478-Q554 PolarHBondContact O-N 3.26Å; E478-A556 HydrophobicContact CB-CB 4.36Å; E478-A556 HydrophobicContact CG-CB 3.73Å; E478-A556 WeakPolarHBondContact OE1-CB 3.4Å; E478-L558 HydrophobicContact CB-CD1 4.25Å
479	P	92.9	Very high	88.7	Confident	3 Å²	3	39 Å²	39	2%	0.019	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	131.3	174.9	27.6	-32.2	0	0	0	110.2	V439 P440 L525 Y553	V439-P479 HydrophobicContact CB-CG 3.86Å; V439-P479 HydrophobicContact CG2-CG 3.73Å; P440-P479 WeakPolarHBondContact O-CD 3.4Å; P440-P479 WeakPolarHBondContact O-CG 3.36Å; P479-L525 HydrophobicContact CB-CB 4.43Å; P479-L525 HydrophobicContact CB-CD2 4.43Å; P479-L525 HydrophobicContact CG-CB 4.16Å; P479-L525 HydrophobicContact CG-CD2 4.21Å; P479-L525 WeakPolarHBondContact O-CB 3.1Å; P479-L525 PolarHBondContact O-N 2.89Å; P479-Y553 HydrophobicContact CB-CD1 4.34Å; P479-Y553 HydrophobicContact CB-CE1 3.94Å; P479-Y553 HydrophobicContact CG-CE1 4.39Å
480	M	93.6	Very high	89.3	Confident	7 Å²	7	37.7 Å²	37.7	3%	0.034	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	153.4	179.9	-57	-61.6	-69.5	0	0	110.7	E478 L522 F523 P524 A551 D552 Q554	E478-M480 HydrophobicContact CG-SD 3.94Å; M480-L522 HydrophobicContact CB-CD1 4.02Å; M480-L522 HydrophobicContact CB-CG 4.47Å; M480-L522 HydrophobicContact CE-CD2 4.12Å; M480-L522 HydrophobicContact CE-CG 3.84Å; M480-F523 CarbonylContact C-O 3.54Å; M480-F523 VanDerWaalsContact CA-O 3.3Å; M480-F523 WeakPolarHBondContact CA-O 3.33Å; M480-F523 VanDerWaalsContact CE-C 3.49Å; M480-P524 HydrophobicContact CE-CB 4.48Å; M480-P524 HydrophobicContact CE-CG 3.98Å; M480-P524 VanDerWaalsContact SD-CA 3.59Å; M480-P524 HydrophobicContact SD-CB 3.96Å; M480-P524 HydrophobicContact SD-CG 4.01Å; M480-A551 HydrophobicContact CB-CB 4.42Å; M480-A551 CarbonylContact O-C 3.5Å; M480-A551 WeakPolarHBondContact O-CA 3.44Å; M480-A551 PolarHBondContact O-N 2.92Å; M480-D552 PolarHBondContact N-O 3.47Å; M480-Q554 HydrophobicContact CG-CB 3.47Å; M480-Q554 VanDerWaalsContact CG-CB 3.47Å; M480-Q554 HydrophobicContact SD-CB 4.02Å
481	V	92.6	Very high	90	Very high	3 Å²	3	33.5 Å²	33.5	2%	0.018	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	142.1	178.3	-68	0	0	0	0	111.6	G483 L522 F523 L525 I528 Y548 E549	V481-G483 PolarHBondContact O-N 2.95Å; V481-L522 WeakPolarHBondContact O-CA 3.19Å; V481-F523 HydrophobicContact CG2-CB 4.13Å; V481-F523 PolarHBondContact N-O 2.97Å; V481-F523 PolarHBondContact O-N 3.41Å; V481-L525 HydrophobicContact CG1-CB 4.3Å; V481-L525 HydrophobicContact CG1-CD1 3.92Å; V481-L525 HydrophobicContact CG2-CD1 4.36Å; V481-I528 HydrophobicContact CG2-CD1 3.54Å; V481-I528 HydrophobicContact CG2-CG1 4.11Å; V481-Y548 HydrophobicContact CB-CD2 4.18Å; V481-Y548 HydrophobicContact CG1-CD2 4Å; V481-Y548 HydrophobicContact CG2-CD2 4.43Å; V481-E549 CarbonylContact C-O 3.52Å; V481-E549 WeakPolarHBondContact CA-O 3.32Å; V481-E549 VanDerWaalsContact CB-O 3.24Å; V481-E549 WeakPolarHBondContact CB-O 3.35Å
482	L	93.2	Very high	90.6	Very high	42 Å²	42	29.3 Å²	29.3	22%	0.22	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	95.6	173.4	-176.6	64.4	0	0	0	108.5	K507 K520 Y521 Y548 E549 A551	L482-K507 HydrophobicContact CD1-CG 4.17Å; L482-K520 HydrophobicContact CD1-CB 4.28Å; L482-Y521 CarbonylContact C-O 3.59Å; L482-Y548 WeakPolarHBondContact O-CA 3.48Å; L482-E549 PolarHBondContact N-O 2.96Å; L482-E549 PolarHBondContact O-N 3.12Å; L482-A551 HydrophobicContact CB-CB 4.22Å
483	G	92.6	Very high	91.3	Very high	0 Å²	0	30 Å²	30	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	126.7	175.9	0	0	0	0	0	112	V481 K520 Y521 D547	V481-G483 PolarHBondContact O-N 2.95Å; G483-K520 WeakPolarHBondContact O-CA 3.42Å; G483-Y521 PolarHBondContact N-O 2.75Å; G483-Y521 PolarHBondContact O-N 2.75Å; G483-D547 CarbonylContact C-O 3.52Å; G483-D547 WeakPolarHBondContact CA-O 3.2Å
484	T	92.4	Very high	91.8	Very high	5 Å²	5	35 Å²	35	3%	0.031	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	118.3	170.5	-61.7	0	0	0	0	109	L486 M518 K520 F546 D547	T484-L486 HydrophobicContact CG2-CD1 3.82Å; T484-M518 HydrophobicContact CG2-CG 3.98Å; T484-M518 HydrophobicContact CG2-SD 4.29Å; T484-K520 HydrophobicContact CG2-CG 4.42Å; T484-K520 WeakPolarHBondContact OG1-CE 3.36Å; T484-F546 WeakPolarHBondContact O-CA 3.32Å; T484-D547 PolarHBondContact N-O 3.21Å; T484-D547 PolarHBondContact O-N 3Å
485	I	93.6	Very high	92.4	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	129.5	176	-59.4	163	0	0	0	108.5	I495 C499 M518 L519 F523 F532 L536 S545 F546	I485-I495 HydrophobicContact CD1-CG2 4.02Å; I485-I495 HydrophobicContact CG2-CG2 4.14Å; I485-C499 VanDerWaalsContact CD1-SG 3.54Å; I485-M518 WeakPolarHBondContact O-CA 3.49Å; I485-L519 HydrophobicContact CB-CB 4.35Å; I485-L519 PolarHBondContact N-O 2.98Å; I485-L519 PolarHBondContact O-N 3.5Å; I485-F523 HydrophobicContact CD1-CZ 4.45Å; I485-F532 HydrophobicContact CD1-CZ 4.18Å; I485-L536 HydrophobicContact CG1-CD2 4.32Å; I485-L536 HydrophobicContact CG2-CD1 4.27Å; I485-L536 HydrophobicContact CG2-CD2 4.2Å; I485-S545 WeakPolarHBondContact CA-O 3.15Å; I485-F546 HydrophobicContact CD1-CD2 4.47Å; I485-F546 HydrophobicContact CG1-CD2 3.54Å; I485-F546 HydrophobicContact CG1-CE2 4.08Å
486	L	91.8	Very high	92.7	Very high	3 Å²	3	27.4 Å²	27.4	2%	0.016	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	133.6	164.7	-86.7	68.3	0	0	0	108.6	I178 A180 V183 T484 I512 V517 M518 A544 S545	I178-L486 HydrophobicContact CG2-CD2 3.94Å; A180-L486 HydrophobicContact CB-CD1 4.11Å; V183-L486 HydrophobicContact CG2-CD2 4.43Å; T484-L486 HydrophobicContact CG2-CD1 3.82Å; L486-I512 HydrophobicContact CD2-CD1 3.33Å; L486-I512 HydrophobicContact CG-CD1 3.66Å; L486-V517 WeakPolarHBondContact CA-O 3.46Å; L486-M518 HydrophobicContact CD1-CB 4.19Å; L486-M518 HydrophobicContact CD1-CE 4.34Å; L486-M518 HydrophobicContact CD1-CG 3.76Å; L486-M518 HydrophobicContact CG-CB 4.41Å; L486-M518 HydrophobicContact CG-CG 4.5Å; L486-A544 CarbonylContact O-C 3.55Å; L486-A544 WeakPolarHBondContact O-CA 3.49Å; L486-S545 PolarHBondContact N-O 3.37Å; L486-S545 PolarHBondContact O-N 2.75Å
487	A	92.9	Very high	92.8	Very high	3 Å²	3	30.7 Å²	30.7	3%	0.025	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	160.1	177	0	0	0	0	0	112.2	I495 R516 V517 A544	A487-I495 HydrophobicContact CB-CD1 3.3Å; A487-R516 WeakPolarHBondContact O-CA 3.25Å; A487-V517 PolarHBondContact N-O 2.96Å; A487-V517 VanDerWaalsContact N-O 3.11Å; A487-V517 PolarHBondContact O-N 3.28Å; A487-A544 HydrophobicContact CB-CB 3.85Å
488	P	91.2	Very high	92.9	Very high	30 Å²	30	30.3 Å²	30.3	20%	0.195	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	140.7	166.7	-13.4	27.9	0	0	0	111.1	A490 Y491 Q515 Y543	P488-A490 PolarHBondContact O-N 2.93Å; P488-A490 VanDerWaalsContact O-N 3.15Å; P488-Y491 HydrophobicContact CB-CD2 4.02Å; P488-Y491 HydrophobicContact CB-CE2 4.35Å; P488-Y491 HydrophobicContact CG-CD2 4.08Å; P488-Y491 HydrophobicContact CG-CE2 4.23Å; P488-Y491 PolarHBondContact O-N 2.96Å; P488-Q515 CarbonylContact C-O 3.44Å; P488-Q515 WeakPolarHBondContact CA-O 3.27Å; P488-Y543 HydrophobicContact CG-CG 4.26Å
489	D	91.8	Very high	92.9	Very high	60 Å²	60	30 Å²	30	32%	0.321	19%	0.186	S	C	.	.	G	3₁₀ helix	trans	-63	-28.3	-169.1	-172.6	63.9	0	0	0	113.9	Y491 T492 Y511 Q515	D489-Y491 PolarHBondContact O-N 2.94Å; D489-T492 VanDerWaalsContact CA-OG1 3.3Å; D489-T492 WeakPolarHBondContact CA-OG1 3.25Å; D489-T492 VanDerWaalsContact O-CB 3.27Å; D489-T492 WeakPolarHBondContact O-CB 3.16Å; D489-T492 PolarHBondContact O-N 3.28Å; D489-T492 PolarHBondContact O-OG1 2.86Å; D489-T492 PolarHBondContact OD1-OG1 2.94Å; D489-Y511 HydrophobicContact CB-CE1 4.08Å; D489-Y511 WeakPolarHBondContact OD1-CE1 3.43Å; D489-Y511 PolarHBondContact OD1-OH 2.65Å; D489-Q515 PolarHBondContact N-O 3.49Å
490	A	91.9	Very high	92.9	Very high	95 Å²	95	36.1 Å²	36.1	79%	0.785	22%	0.218	S	C	*	.	G	3₁₀ helix	trans	-55.5	-17.3	172.2	0	0	0	0	0	114.4	P488	P488-A490 PolarHBondContact O-N 2.93Å; P488-A490 VanDerWaalsContact O-N 3.15Å
491	Y	93.1	Very high	92.8	Very high	42 Å²	42	38.4 Å²	38.4	17%	0.165	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-103.3	-9	175.7	-60.1	-85.2	0	0	0	113.9	P488 D489 G493 K494 I495 M539 S541 Y543	P488-Y491 HydrophobicContact CB-CD2 4.02Å; P488-Y491 HydrophobicContact CB-CE2 4.35Å; P488-Y491 HydrophobicContact CG-CD2 4.08Å; P488-Y491 HydrophobicContact CG-CE2 4.23Å; P488-Y491 PolarHBondContact O-N 2.96Å; D489-Y491 PolarHBondContact O-N 2.94Å; Y491-G493 PolarHBondContact O-N 3.17Å; Y491-K494 WeakPolarHBondContact O-CB 3.43Å; Y491-K494 PolarHBondContact O-N 2.87Å; Y491-I495 WeakPolarHBondContact O-CG1 3.38Å; Y491-I495 PolarHBondContact O-N 2.96Å; Y491-I495 VanDerWaalsContact O-N 3.09Å; Y491-M539 VanDerWaalsContact CD1-O 3.25Å; Y491-M539 WeakPolarHBondContact CD1-O 3.44Å; Y491-S541 WeakPolarHBondContact OH-CB 3.38Å; Y491-S541 PolarHBondContact OH-OG 2.98Å; Y491-S541 VanDerWaalsContact OH-OG 3.1Å; Y491-Y543 AromaticContact CE2-CD2 3.98Å; Y491-Y543 HydrophobicContact CE2-CD2 3.98Å
492	T	91.9	Very high	92.7	Very high	10 Å²	10	39.5 Å²	39.5	6%	0.061	24%	0.239	C	C	.	.	H	α-helix	trans	-48.8	-54	-172.2	-62	0	0	0	0	112.7	D489 K494 I495 M496 M509 V517	D489-T492 VanDerWaalsContact CA-OG1 3.3Å; D489-T492 WeakPolarHBondContact CA-OG1 3.25Å; D489-T492 VanDerWaalsContact O-CB 3.27Å; D489-T492 WeakPolarHBondContact O-CB 3.16Å; D489-T492 PolarHBondContact O-N 3.28Å; D489-T492 PolarHBondContact O-OG1 2.86Å; D489-T492 PolarHBondContact OD1-OG1 2.94Å; T492-K494 VanDerWaalsContact C-N 3.29Å; T492-K494 PolarHBondContact O-N 3.01Å; T492-I495 PolarHBondContact O-N 3.08Å; T492-M496 HydrophobicContact CG2-CG 4.11Å; T492-M496 HydrophobicContact CG2-SD 3.79Å; T492-M496 WeakPolarHBondContact O-CG 3.36Å; T492-M496 PolarHBondContact O-N 2.93Å; T492-M509 HydrophobicContact CG2-CE 4.14Å; T492-V517 WeakPolarHBondContact OG1-CG1 3.44Å
493	G	92.5	Very high	92.6	Very high	57 Å²	57	39.8 Å²	39.8	59%	0.588	24%	0.237	S	C	*	.	H	α-helix	trans	-61.7	-31.5	-177.9	0	0	0	0	0	114.6	Y491 S497	Y491-G493 PolarHBondContact O-N 3.17Å; G493-S497 PolarHBondContact O-N 3.08Å
494	K	93.6	Very high	92.7	Very high	116 Å²	116	40.2 Å²	40.2	50%	0.504	24%	0.241	S	C	.	.	H	α-helix	trans	-70.1	-43.3	173.4	-72.2	177.7	-179.4	170.7	0	111	Y491 T492 S497 L498 M539	Y491-K494 WeakPolarHBondContact O-CB 3.43Å; Y491-K494 PolarHBondContact O-N 2.87Å; T492-K494 VanDerWaalsContact C-N 3.29Å; T492-K494 PolarHBondContact O-N 3.01Å; K494-S497 PolarHBondContact O-N 3.42Å; K494-L498 PolarHBondContact O-N 2.99Å; K494-L498 VanDerWaalsContact O-N 3.07Å; K494-M539 HydrophobicContact CB-CE 4.12Å
495	I	94	Very high	92.8	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-66.7	-46.1	-179.4	-65.6	173.6	0	0	0	110.4	I485 A487 Y491 T492 S497 L498 C499 L519 L536 A544	I485-I495 HydrophobicContact CD1-CG2 4.02Å; I485-I495 HydrophobicContact CG2-CG2 4.14Å; A487-I495 HydrophobicContact CB-CD1 3.3Å; Y491-I495 WeakPolarHBondContact O-CG1 3.38Å; Y491-I495 PolarHBondContact O-N 2.96Å; Y491-I495 VanDerWaalsContact O-N 3.09Å; T492-I495 PolarHBondContact O-N 3.08Å; I495-S497 VanDerWaalsContact C-N 3.28Å; I495-S497 PolarHBondContact O-N 2.78Å; I495-L498 WeakPolarHBondContact O-CB 3.4Å; I495-L498 PolarHBondContact O-N 2.79Å; I495-L498 VanDerWaalsContact O-N 3.13Å; I495-C499 PolarHBondContact O-N 2.85Å; I495-C499 PolarHBondContact O-SG 2.84Å; I495-L519 HydrophobicContact CG2-CD1 4.07Å; I495-L536 HydrophobicContact CB-CD1 4.41Å; I495-L536 HydrophobicContact CD1-CD1 4.06Å; I495-L536 HydrophobicContact CG1-CD1 3.82Å; I495-L536 HydrophobicContact CG2-CD1 3.88Å; I495-A544 HydrophobicContact CD1-CB 4.2Å
496	M	94.3	Very high	92.9	Very high	62 Å²	62	47.3 Å²	47.3	31%	0.305	28%	0.279	S	S	.	.	H	α-helix	trans	-57.8	-40.1	175.9	-66.5	-178.2	78	0	0	112	T492 C499 L500 Y521	T492-M496 HydrophobicContact CG2-CG 4.11Å; T492-M496 HydrophobicContact CG2-SD 3.79Å; T492-M496 WeakPolarHBondContact O-CG 3.36Å; T492-M496 PolarHBondContact O-N 2.93Å; M496-C499 PolarHBondContact O-N 2.77Å; M496-L500 WeakPolarHBondContact O-CB 3.49Å; M496-L500 PolarHBondContact O-N 3.48Å; M496-Y521 WeakPolarHBondContact CG-OH 3.36Å
497	S	94.1	Very high	93.1	Very high	80 Å²	80	53.1 Å²	53.1	56%	0.559	30%	0.304	S	S	*	.	H	α-helix	trans	-64.4	-43.1	175.3	-173.7	0	0	0	0	112.5	G493 K494 I495 S501	G493-S497 PolarHBondContact O-N 3.08Å; K494-S497 PolarHBondContact O-N 3.42Å; I495-S497 VanDerWaalsContact C-N 3.28Å; I495-S497 PolarHBondContact O-N 2.78Å; S497-S501 WeakPolarHBondContact O-CB 3.37Å; S497-S501 PolarHBondContact O-N 3.43Å
498	L	93.6	Very high	93.1	Very high	12 Å²	12	55.1 Å²	55.1	6%	0.063	32%	0.318	C	S	.	.	H	α-helix	trans	-60.1	-46.3	172.2	178.9	65.2	0	0	0	111.2	K494 I495 S501 R502 F532 L535 L536 M539	K494-L498 PolarHBondContact O-N 2.99Å; K494-L498 VanDerWaalsContact O-N 3.07Å; I495-L498 WeakPolarHBondContact O-CB 3.4Å; I495-L498 PolarHBondContact O-N 2.79Å; I495-L498 VanDerWaalsContact O-N 3.13Å; L498-S501 WeakPolarHBondContact O-CB 3.38Å; L498-S501 PolarHBondContact O-N 3.01Å; L498-S501 PolarHBondContact O-OG 3.49Å; L498-R502 PolarHBondContact O-N 3.28Å; L498-F532 HydrophobicContact CD2-CD2 4.14Å; L498-F532 HydrophobicContact CD2-CE2 3.95Å; L498-F532 HydrophobicContact CG-CD2 4.16Å; L498-F532 HydrophobicContact CG-CE2 3.89Å; L498-L535 HydrophobicContact CD1-CB 4.19Å; L498-L535 HydrophobicContact CD1-CD1 4.22Å; L498-L535 HydrophobicContact CD2-CB 4.13Å; L498-L536 HydrophobicContact CD2-CB 4.1Å; L498-L536 HydrophobicContact CD2-CD1 4.4Å; L498-M539 HydrophobicContact CB-CE 4.28Å; L498-M539 HydrophobicContact CB-SD 4.08Å; L498-M539 HydrophobicContact CD1-SD 4.22Å; L498-M539 HydrophobicContact CD2-SD 3.95Å; L498-M539 HydrophobicContact CG-SD 4.3Å
499	C	94.1	Very high	93.2	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-61.8	-49.1	-179.4	-62.6	0	0	0	0	111.7	I485 I495 M496 S501 R502 G504 Y521 F523	I485-C499 VanDerWaalsContact CD1-SG 3.54Å; I495-C499 PolarHBondContact O-N 2.85Å; I495-C499 PolarHBondContact O-SG 2.84Å; M496-C499 PolarHBondContact O-N 2.77Å; C499-S501 VanDerWaalsContact C-N 3.3Å; C499-S501 PolarHBondContact O-N 3.09Å; C499-R502 CarbonylContact O-C 3.55Å; C499-R502 PolarHBondContact O-N 3.32Å; C499-R502 VanDerWaalsContact O-N 3.08Å; C499-G504 WeakPolarHBondContact O-CA 3.42Å; C499-G504 PolarHBondContact O-N 3.07Å; C499-Y521 HydrophobicContact CB-CD1 3.9Å; C499-Y521 HydrophobicContact CB-CD2 4.5Å; C499-Y521 HydrophobicContact CB-CE1 3.69Å; C499-Y521 HydrophobicContact CB-CE2 4.31Å; C499-Y521 HydrophobicContact CB-CG 4.31Å; C499-F523 HydrophobicContact CB-CE1 3.92Å; C499-F523 HydrophobicContact CB-CZ 3.9Å
500	L	92.4	Very high	93.3	Very high	130 Å²	130	58.1 Å²	58.1	68%	0.681	33%	0.333	S	S	*	.	H	α-helix	trans	-58.4	-42	175.5	179.5	63.5	0	0	0	111.4	M496 R502 R503	M496-L500 WeakPolarHBondContact O-CB 3.49Å; M496-L500 PolarHBondContact O-N 3.48Å; L500-R502 PolarHBondContact O-N 3.38Å; L500-R503 PolarHBondContact O-N 2.79Å; L500-R503 VanDerWaalsContact O-N 3.09Å
501	S	90.6	Very high	93.2	Very high	56 Å²	56	58.3 Å²	58.3	39%	0.392	31%	0.314	S	S	.	.	H	α-helix	trans	-58.9	-34.2	177.5	85.5	0	0	0	0	112.5	S497 L498 C499 R503 R581	S497-S501 WeakPolarHBondContact O-CB 3.37Å; S497-S501 PolarHBondContact O-N 3.43Å; L498-S501 WeakPolarHBondContact O-CB 3.38Å; L498-S501 PolarHBondContact O-N 3.01Å; L498-S501 PolarHBondContact O-OG 3.49Å; C499-S501 VanDerWaalsContact C-N 3.3Å; C499-S501 PolarHBondContact O-N 3.09Å; S501-R503 VanDerWaalsContact C-N 3.29Å; S501-R503 PolarHBondContact O-N 2.71Å; S501-R581 PolarHBondContact O-NH2 2.99Å
502	R	90.8	Very high	92.8	Very high	26 Å²	26	56.5 Å²	56.5	10%	0.098	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	22.8	179.2	-63.6	-58.1	-174.9	126.1	-1.5	113.3	L498 C499 L500 G504 F523 E527 V530 D531 F532 L535	L498-R502 PolarHBondContact O-N 3.28Å; C499-R502 CarbonylContact O-C 3.55Å; C499-R502 PolarHBondContact O-N 3.32Å; C499-R502 VanDerWaalsContact O-N 3.08Å; L500-R502 PolarHBondContact O-N 3.38Å; R502-G504 PolarHBondContact O-N 3.06Å; R502-F523 HydrophobicContact CB-CD1 4.49Å; R502-F523 HydrophobicContact CB-CE1 4.49Å; R502-E527 HydrophobicContact CB-CB 4.08Å; R502-E527 WeakPolarHBondContact CD-O 3.4Å; R502-E527 PolarHBondContact NH1-O 3.02Å; R502-E527 WeakPolarHBondContact O-CB 3.45Å; R502-V530 PolarHBondContact NH1-O 2.86Å; R502-V530 PolarHBondContact NH2-O 3.28Å; R502-D531 IonicContact NH2-OD2 2.59Å; R502-F532 HydrophobicContact CG-CD2 3.9Å; R502-F532 HydrophobicContact CG-CE2 4.26Å; R502-L535 VanDerWaalsContact NH2-CD1 3.33Å
503	R	92.4	Very high	92.5	Very high	48 Å²	48	57.2 Å²	57.2	18%	0.181	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.7	23.5	-179.2	-53.9	-170.7	-71.8	127.2	1.4	113.8	E478 L500 S501 P524 E527	E478-R503 IonicContact OE1-CZ 2.72Å; E478-R503 IonicContact OE1-NH1 3.13Å; E478-R503 PolarHBondContact OE1-NH1 2.95Å; E478-R503 IonicContact OE1-NH2 2.78Å; E478-R503 PolarHBondContact OE1-NH2 3.47Å; E478-R503 IonicContact OE2-CZ 3.34Å; E478-R503 IonicContact OE2-NH1 3.66Å; E478-R503 IonicContact OE2-NH2 3.86Å; E478-R503 PolarHBondContact OE2-NH2 3.32Å; L500-R503 PolarHBondContact O-N 2.79Å; L500-R503 VanDerWaalsContact O-N 3.09Å; S501-R503 VanDerWaalsContact C-N 3.29Å; S501-R503 PolarHBondContact O-N 2.71Å; R503-P524 HydrophobicContact CB-CG 4.17Å; R503-E527 IonicContact CZ-OE1 3.82Å; R503-E527 IonicContact NE-OE1 2.62Å; R503-E527 PolarHBondContact NE-OE1 3.02Å; R503-E527 IonicContact NH2-OE1 2.79Å; R503-E527 PolarHBondContact NH2-OE1 3.36Å; R503-E527 VanDerWaalsContact NH2-OE1 3.12Å
504	G	93.5	Very high	92.1	Very high	8 Å²	8	63.7 Å²	63.7	8%	0.082	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-73.1	125.7	179.6	0	0	0	0	0	112.8	C499 R502 L522 F523	C499-G504 WeakPolarHBondContact O-CA 3.42Å; C499-G504 PolarHBondContact O-N 3.07Å; R502-G504 PolarHBondContact O-N 3.06Å; G504-L522 WeakPolarHBondContact CA-O 3.39Å; G504-F523 VanDerWaalsContact CA-CD1 3.44Å
505	V	94.4	Very high	91.8	Very high	78 Å²	78	64.6 Å²	64.6	47%	0.473	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	117	176	-179.5	0	0	0	0	109.4	Y521 L522	V505-Y521 CarbonylContact O-C 3.42Å; V505-Y521 WeakPolarHBondContact O-CA 3.33Å; V505-L522 PolarHBondContact N-O 2.81Å; V505-L522 PolarHBondContact O-N 3.41Å
506	Q	95.6	Very high	91.6	Very high	77 Å²	77	66.5 Å²	66.5	36%	0.36	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	138	179.3	-164.8	172.2	4.1	0	0	111.1	Y521	Q506-Y521 HydrophobicContact CB-CD1 4.06Å; Q506-Y521 HydrophobicContact CB-CE1 3.57Å; Q506-Y521 HydrophobicContact CB-CE2 4.39Å; Q506-Y521 HydrophobicContact CG-CE1 4.09Å; Q506-Y521 HydrophobicContact CG-CE2 4Å
507	K	95.6	Very high	91.5	Very high	125 Å²	125	63.6 Å²	63.6	54%	0.543	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	-41.8	178.8	-63.7	-62.8	-174.1	175.2	0	112.3	L482 K520 L522	L482-K507 HydrophobicContact CD1-CG 4.17Å; K507-K520 HydrophobicContact CB-CB 4.41Å; K507-K520 PolarHBondContact N-O 3.05Å; K507-L522 HydrophobicContact CD-CB 4.47Å; K507-L522 VanDerWaalsContact CE-CB 3.48Å; K507-L522 HydrophobicContact CG-CB 4.18Å
508	S	94.4	Very high	91.5	Very high	44 Å²	44	60.6 Å²	60.6	31%	0.308	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	164.5	173.1	70	0	0	0	0	112.6	K520	S508-K520 PolarHBondContact N-O 2.88Å; S508-K520 PolarHBondContact O-N 3.43Å; S508-K520 WeakPolarHBondContact OG-CB 3.39Å
509	M	93.7	Very high	91.5	Very high	74 Å²	74	60 Å²	60	37%	0.365	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	120.2	175	173.9	163.3	174.4	0	0	107.7	T492 Y511 V517 M518 L519	T492-M509 HydrophobicContact CG2-CE 4.14Å; M509-Y511 HydrophobicContact CE-CE2 3.87Å; M509-Y511 WeakPolarHBondContact CE-OH 3.34Å; M509-V517 HydrophobicContact CE-CG2 4.02Å; M509-V517 HydrophobicContact CG-CG2 3.64Å; M509-V517 HydrophobicContact SD-CG2 4.47Å; M509-M518 CarbonylContact C-O 3.54Å; M509-M518 WeakPolarHBondContact CA-O 3.24Å; M509-L519 HydrophobicContact CB-CD2 3.91Å; M509-L519 HydrophobicContact CG-CD2 3.74Å; M509-L519 HydrophobicContact SD-CD2 3.84Å
510	V	92.2	Very high	91.6	Very high	79 Å²	79	62 Å²	62	48%	0.479	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	129.2	-174.4	-177.3	0	0	0	0	109.4	I512 M518	V510-I512 PolarHBondContact O-N 2.88Å; V510-M518 PolarHBondContact N-O 2.85Å; V510-M518 PolarHBondContact O-N 3.33Å
511	Y	90.7	Very high	91.7	Very high	99 Å²	99	56.1 Å²	56.1	39%	0.388	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	114.4	176.4	-77.5	-83.5	0	0	0	110.8	K219 D489 M509 R516 V517	K219-Y511 WeakPolarHBondContact CE-O 3.17Å; K219-Y511 PolarHBondContact NZ-O 2.69Å; D489-Y511 HydrophobicContact CB-CE1 4.08Å; D489-Y511 WeakPolarHBondContact OD1-CE1 3.43Å; D489-Y511 PolarHBondContact OD1-OH 2.65Å; M509-Y511 HydrophobicContact CE-CE2 3.87Å; M509-Y511 WeakPolarHBondContact CE-OH 3.34Å; Y511-R516 WeakPolarHBondContact CA-O 3.38Å; Y511-V517 HydrophobicContact CD1-CB 4.29Å; Y511-V517 HydrophobicContact CE1-CB 4.1Å; Y511-V517 HydrophobicContact CE1-CG2 4.44Å
512	I	85.4	Confident	92	Very high	4 Å²	4	54.5 Å²	54.5	2%	0.021	26%	0.263	C	S	.	.	S	Bend	trans	-70.1	-48.7	177.4	-70.7	171.4	0	0	0	109.4	Q216 K219 V220 L486 V510 R516 M518	Q216-I512 HydrophobicContact CB-CG2 4.2Å; Q216-I512 HydrophobicContact CG-CG2 3.85Å; K219-I512 VanDerWaalsContact CD-O 3.32Å; K219-I512 WeakPolarHBondContact CD-O 3.42Å; K219-I512 VanDerWaalsContact CE-O 3.31Å; K219-I512 WeakPolarHBondContact CE-O 3.35Å; K219-I512 PolarHBondContact NZ-O 3.03Å; V220-I512 HydrophobicContact CG2-CB 4.32Å; V220-I512 HydrophobicContact CG2-CG1 4Å; V220-I512 HydrophobicContact CG2-CG2 3.81Å; L486-I512 HydrophobicContact CD2-CD1 3.33Å; L486-I512 HydrophobicContact CG-CD1 3.66Å; V510-I512 PolarHBondContact O-N 2.88Å; I512-R516 HydrophobicContact CB-CB 4.44Å; I512-R516 PolarHBondContact N-O 2.89Å; I512-M518 HydrophobicContact CD1-CB 4.06Å; I512-M518 HydrophobicContact CD1-CE 3.97Å; I512-M518 HydrophobicContact CG1-CB 4.22Å; I512-M518 HydrophobicContact CG1-CE 4.23Å
513	D	84.7	Confident	92.2	Very high	25 Å²	25	53.2 Å²	53.2	13%	0.134	26%	0.258	C	S	.	.	S	Bend	trans	-138.3	-171.1	172.9	59.1	41.2	0	0	0	109.1	Q216 Q515 R516	Q216-D513 PolarHBondContact NE2-OD2 2.53Å; D513-Q515 PolarHBondContact O-N 3.15Å; D513-Q515 WeakPolarHBondContact OD1-CA 3.19Å; D513-Q515 PolarHBondContact OD1-N 3.15Å; D513-R516 WeakPolarHBondContact OD1-CB 3.34Å; D513-R516 WeakPolarHBondContact OD1-CG 3.46Å; D513-R516 PolarHBondContact OD1-N 2.72Å
514	E	85	Confident	92.2	Very high	193 Å²	193	51 Å²	51	90%	0.902	25%	0.25	S	S	*	.	S	Bend	trans	-65.6	-16.2	179.4	-58.8	-176.7	162.6	0	0	113.9
515	Q	86.1	Confident	92.1	Very high	135 Å²	135	50.7 Å²	50.7	63%	0.631	25%	0.247	S	C	*	.	S	Bend	trans	-117.5	-11.9	-171.2	-59.4	-176	9.6	0	0	113.2	P488 D489 D513	P488-Q515 CarbonylContact C-O 3.44Å; P488-Q515 WeakPolarHBondContact CA-O 3.27Å; D489-Q515 PolarHBondContact N-O 3.49Å; D513-Q515 PolarHBondContact O-N 3.15Å; D513-Q515 WeakPolarHBondContact OD1-CA 3.19Å; D513-Q515 PolarHBondContact OD1-N 3.15Å
516	R	89.1	Confident	91.8	Very high	42 Å²	42	49 Å²	49	16%	0.158	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	138.2	-171.6	-63.6	-176.4	-179.1	-153	1	114.1	Q176 I178 A487 Y511 I512 D513	Q176-R516 PolarHBondContact O-NH1 3.16Å; Q176-R516 PolarHBondContact O-NH2 3.13Å; I178-R516 PolarHBondContact O-NH1 3.26Å; I178-R516 VanDerWaalsContact O-NH1 3.17Å; A487-R516 WeakPolarHBondContact O-CA 3.25Å; Y511-R516 WeakPolarHBondContact CA-O 3.38Å; I512-R516 HydrophobicContact CB-CB 4.44Å; I512-R516 PolarHBondContact N-O 2.89Å; D513-R516 WeakPolarHBondContact OD1-CB 3.34Å; D513-R516 WeakPolarHBondContact OD1-CG 3.46Å; D513-R516 PolarHBondContact OD1-N 2.72Å
517	V	93.3	Very high	91.5	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	139	175.8	68.6	0	0	0	0	111.5	L486 A487 T492 M509 Y511 L519	L486-V517 WeakPolarHBondContact CA-O 3.46Å; A487-V517 PolarHBondContact N-O 2.96Å; A487-V517 VanDerWaalsContact N-O 3.11Å; A487-V517 PolarHBondContact O-N 3.28Å; T492-V517 WeakPolarHBondContact OG1-CG1 3.44Å; M509-V517 HydrophobicContact CE-CG2 4.02Å; M509-V517 HydrophobicContact CG-CG2 3.64Å; M509-V517 HydrophobicContact SD-CG2 4.47Å; Y511-V517 HydrophobicContact CD1-CB 4.29Å; Y511-V517 HydrophobicContact CE1-CB 4.1Å; Y511-V517 HydrophobicContact CE1-CG2 4.44Å; V517-L519 HydrophobicContact CG1-CD1 4.28Å; V517-L519 HydrophobicContact CG1-CG 4.13Å; V517-L519 HydrophobicContact CG2-CD2 4.03Å; V517-L519 HydrophobicContact CG2-CG 4.18Å
518	M	93.4	Very high	91.1	Very high	18 Å²	18	40.4 Å²	40.4	9%	0.089	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	122.8	161.9	-175.3	-175.1	-54	0	0	108.5	V183 V220 T484 I485 L486 M509 V510 I512	V183-M518 HydrophobicContact CG1-CE 4.19Å; V183-M518 HydrophobicContact CG2-CE 4Å; V220-M518 HydrophobicContact CG1-CE 4.2Å; T484-M518 HydrophobicContact CG2-CG 3.98Å; T484-M518 HydrophobicContact CG2-SD 4.29Å; I485-M518 WeakPolarHBondContact O-CA 3.49Å; L486-M518 HydrophobicContact CD1-CB 4.19Å; L486-M518 HydrophobicContact CD1-CE 4.34Å; L486-M518 HydrophobicContact CD1-CG 3.76Å; L486-M518 HydrophobicContact CG-CB 4.41Å; L486-M518 HydrophobicContact CG-CG 4.5Å; M509-M518 CarbonylContact C-O 3.54Å; M509-M518 WeakPolarHBondContact CA-O 3.24Å; V510-M518 PolarHBondContact N-O 2.85Å; V510-M518 PolarHBondContact O-N 3.33Å; I512-M518 HydrophobicContact CD1-CB 4.06Å; I512-M518 HydrophobicContact CD1-CE 3.97Å; I512-M518 HydrophobicContact CG1-CB 4.22Å; I512-M518 HydrophobicContact CG1-CE 4.23Å
519	L	94.4	Very high	90.5	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	124	177.1	-66.2	168	0	0	0	108.8	I485 I495 M509 V517 Y521	I485-L519 HydrophobicContact CB-CB 4.35Å; I485-L519 PolarHBondContact N-O 2.98Å; I485-L519 PolarHBondContact O-N 3.5Å; I495-L519 HydrophobicContact CG2-CD1 4.07Å; M509-L519 HydrophobicContact CB-CD2 3.91Å; M509-L519 HydrophobicContact CG-CD2 3.74Å; M509-L519 HydrophobicContact SD-CD2 3.84Å; V517-L519 HydrophobicContact CG1-CD1 4.28Å; V517-L519 HydrophobicContact CG1-CG 4.13Å; V517-L519 HydrophobicContact CG2-CD2 4.03Å; V517-L519 HydrophobicContact CG2-CG 4.18Å; L519-Y521 HydrophobicContact CB-CD2 4.08Å; L519-Y521 HydrophobicContact CB-CE2 3.97Å; L519-Y521 HydrophobicContact CD1-CE2 4.4Å; L519-Y521 HydrophobicContact CD2-CE2 4.4Å; L519-Y521 HydrophobicContact CG-CE2 4.49Å
520	K	94.8	Very high	89.7	Confident	40 Å²	40	37.6 Å²	37.6	17%	0.174	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	129.2	168.5	-62.4	-160.2	173.4	-163.2	0	110.3	L482 G483 T484 K507 S508	L482-K520 HydrophobicContact CD1-CB 4.28Å; G483-K520 WeakPolarHBondContact O-CA 3.42Å; T484-K520 HydrophobicContact CG2-CG 4.42Å; T484-K520 WeakPolarHBondContact OG1-CE 3.36Å; K507-K520 HydrophobicContact CB-CB 4.41Å; K507-K520 PolarHBondContact N-O 3.05Å; S508-K520 PolarHBondContact N-O 2.88Å; S508-K520 PolarHBondContact O-N 3.43Å; S508-K520 WeakPolarHBondContact OG-CB 3.39Å
521	Y	96.1	Very high	89	Confident	8 Å²	8	36.6 Å²	36.6	3%	0.031	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	137.7	-177.8	-86.6	-95	0	0	0	110.4	L482 G483 M496 C499 V505 Q506 L519 F523	L482-Y521 CarbonylContact C-O 3.59Å; G483-Y521 PolarHBondContact N-O 2.75Å; G483-Y521 PolarHBondContact O-N 2.75Å; M496-Y521 WeakPolarHBondContact CG-OH 3.36Å; C499-Y521 HydrophobicContact CB-CD1 3.9Å; C499-Y521 HydrophobicContact CB-CD2 4.5Å; C499-Y521 HydrophobicContact CB-CE1 3.69Å; C499-Y521 HydrophobicContact CB-CE2 4.31Å; C499-Y521 HydrophobicContact CB-CG 4.31Å; V505-Y521 CarbonylContact O-C 3.42Å; V505-Y521 WeakPolarHBondContact O-CA 3.33Å; Q506-Y521 HydrophobicContact CB-CD1 4.06Å; Q506-Y521 HydrophobicContact CB-CE1 3.57Å; Q506-Y521 HydrophobicContact CB-CE2 4.39Å; Q506-Y521 HydrophobicContact CG-CE1 4.09Å; Q506-Y521 HydrophobicContact CG-CE2 4Å; L519-Y521 HydrophobicContact CB-CD2 4.08Å; L519-Y521 HydrophobicContact CB-CE2 3.97Å; L519-Y521 HydrophobicContact CD1-CE2 4.4Å; L519-Y521 HydrophobicContact CD2-CE2 4.4Å; L519-Y521 HydrophobicContact CG-CE2 4.49Å; Y521-F523 HydrophobicContact CD1-CZ 4.38Å; Y521-F523 HydrophobicContact CG-CE2 4.29Å; Y521-F523 HydrophobicContact CG-CZ 4Å
522	L	95.9	Very high	88.8	Confident	21 Å²	21	32 Å²	32	11%	0.11	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	119.7	168.8	-175.3	71.8	0	0	0	108.8	M480 V481 G504 V505 K507 A551	M480-L522 HydrophobicContact CB-CD1 4.02Å; M480-L522 HydrophobicContact CB-CG 4.47Å; M480-L522 HydrophobicContact CE-CD2 4.12Å; M480-L522 HydrophobicContact CE-CG 3.84Å; V481-L522 WeakPolarHBondContact O-CA 3.19Å; G504-L522 WeakPolarHBondContact CA-O 3.39Å; V505-L522 PolarHBondContact N-O 2.81Å; V505-L522 PolarHBondContact O-N 3.41Å; K507-L522 HydrophobicContact CD-CB 4.47Å; K507-L522 VanDerWaalsContact CE-CB 3.48Å; K507-L522 HydrophobicContact CG-CB 4.18Å; L522-A551 HydrophobicContact CD1-CB 3.44Å; L522-A551 VanDerWaalsContact CD1-CB 3.44Å
523	F	94.4	Very high	88.6	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	147.5	-179	-66.6	-77	0	0	0	111.7	M480 V481 I485 C499 R502 G504 Y521 L525 I528 F532 F546	M480-F523 CarbonylContact C-O 3.54Å; M480-F523 VanDerWaalsContact CA-O 3.3Å; M480-F523 WeakPolarHBondContact CA-O 3.33Å; M480-F523 VanDerWaalsContact CE-C 3.49Å; V481-F523 HydrophobicContact CG2-CB 4.13Å; V481-F523 PolarHBondContact N-O 2.97Å; V481-F523 PolarHBondContact O-N 3.41Å; I485-F523 HydrophobicContact CD1-CZ 4.45Å; C499-F523 HydrophobicContact CB-CE1 3.92Å; C499-F523 HydrophobicContact CB-CZ 3.9Å; R502-F523 HydrophobicContact CB-CD1 4.49Å; R502-F523 HydrophobicContact CB-CE1 4.49Å; G504-F523 VanDerWaalsContact CA-CD1 3.44Å; Y521-F523 HydrophobicContact CD1-CZ 4.38Å; Y521-F523 HydrophobicContact CG-CE2 4.29Å; Y521-F523 HydrophobicContact CG-CZ 4Å; F523-L525 PolarHBondContact O-N 2.96Å; F523-I528 HydrophobicContact CB-CG2 3.66Å; F523-I528 HydrophobicContact CD1-CG2 3.81Å; F523-I528 HydrophobicContact CD2-CG2 3.98Å; F523-I528 HydrophobicContact CE1-CG2 4.41Å; F523-I528 HydrophobicContact CG-CG2 3.56Å; F523-F532 HydrophobicContact CE1-CE2 4.31Å; F523-F532 HydrophobicContact CE1-CZ 4.17Å; F523-F532 HydrophobicContact CE2-CZ 4.19Å; F523-F532 HydrophobicContact CZ-CE1 4.44Å; F523-F532 HydrophobicContact CZ-CE2 4.27Å; F523-F532 AromaticContact CZ-CZ 3.69Å; F523-F532 HydrophobicContact CZ-CZ 3.69Å; F523-F546 HydrophobicContact CE2-CE2 4.27Å
524	P	93.9	Very high	88.5	Confident	2 Å²	2	38.2 Å²	38.2	1%	0.013	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	127.4	158	-13.9	29.1	0	0	0	109.8	E478 M480 R503 N526 E527	E478-P524 HydrophobicContact CG-CB 4.22Å; E478-P524 WeakPolarHBondContact OE2-CB 3.47Å; M480-P524 HydrophobicContact CE-CB 4.48Å; M480-P524 HydrophobicContact CE-CG 3.98Å; M480-P524 VanDerWaalsContact SD-CA 3.59Å; M480-P524 HydrophobicContact SD-CB 3.96Å; M480-P524 HydrophobicContact SD-CG 4.01Å; R503-P524 HydrophobicContact CB-CG 4.17Å; P524-N526 VanDerWaalsContact C-N 3.25Å; P524-N526 PolarHBondContact O-N 2.98Å; P524-E527 HydrophobicContact CB-CG 3.96Å; P524-E527 HydrophobicContact CG-CG 4.08Å; P524-E527 WeakPolarHBondContact O-CB 3.32Å; P524-E527 PolarHBondContact O-N 2.85Å
525	L	90.8	Very high	88.6	Confident	1 Å²	1	32.1 Å²	32.1	1%	0.005	16%	0.159	C	C	.	.	H	α-helix	trans	-55.6	-40.9	-174.8	178.4	64.8	0	0	0	112.1	M363 V439 P479 V481 F523 E527 I528 V529 Y548	M363-L525 HydrophobicContact CB-CD2 3.94Å; M363-L525 WeakPolarHBondContact O-CD2 3.48Å; V439-L525 HydrophobicContact CB-CD2 4.11Å; V439-L525 HydrophobicContact CG1-CB 4.11Å; V439-L525 HydrophobicContact CG1-CD2 3.67Å; V439-L525 HydrophobicContact CG1-CG 3.65Å; P479-L525 HydrophobicContact CB-CB 4.43Å; P479-L525 HydrophobicContact CB-CD2 4.43Å; P479-L525 HydrophobicContact CG-CB 4.16Å; P479-L525 HydrophobicContact CG-CD2 4.21Å; P479-L525 WeakPolarHBondContact O-CB 3.1Å; P479-L525 PolarHBondContact O-N 2.89Å; V481-L525 HydrophobicContact CG1-CB 4.3Å; V481-L525 HydrophobicContact CG1-CD1 3.92Å; V481-L525 HydrophobicContact CG2-CD1 4.36Å; F523-L525 PolarHBondContact O-N 2.96Å; L525-E527 PolarHBondContact O-N 3.21Å; L525-E527 VanDerWaalsContact O-N 3.11Å; L525-I528 HydrophobicContact CD1-CD1 4.27Å; L525-I528 HydrophobicContact CD1-CG1 4.22Å; L525-I528 WeakPolarHBondContact O-CG1 3.35Å; L525-I528 PolarHBondContact O-N 3.35Å; L525-V529 HydrophobicContact CD1-CG2 3.64Å; L525-V529 HydrophobicContact CG-CG2 3.73Å; L525-V529 VanDerWaalsContact O-CG2 3.29Å; L525-V529 WeakPolarHBondContact O-CG2 3.14Å; L525-V529 PolarHBondContact O-N 3.24Å; L525-Y548 HydrophobicContact CD1-CE2 4.25Å
526	N	88.8	Confident	88.8	Confident	43 Å²	43	25.7 Å²	25.7	23%	0.23	13%	0.129	C	C	.	.	H	α-helix	trans	-59.3	-25	178.7	-169	82	0	0	0	113.6	V439 Y441 P524	V439-N526 HydrophobicContact CG1-CB 4.11Å; V439-N526 HydrophobicContact CG2-CB 3.83Å; Y441-N526 WeakPolarHBondContact OH-CB 3.34Å; Y441-N526 PolarHBondContact OH-ND2 2.64Å; Y441-N526 PolarHBondContact OH-OD1 3.03Å; Y441-N526 VanDerWaalsContact OH-OD1 3.08Å; P524-N526 VanDerWaalsContact C-N 3.25Å; P524-N526 PolarHBondContact O-N 2.98Å
527	E	87.9	Confident	88.6	Confident	9 Å²	9	27.6 Å²	27.6	4%	0.042	14%	0.138	C	C	.	.	H	α-helix	trans	-84.2	-22.2	178.5	-59.4	-73.4	-173.2	0	0	112.6	R502 R503 P524 L525 R581	R502-E527 HydrophobicContact CB-CB 4.08Å; R502-E527 WeakPolarHBondContact CD-O 3.4Å; R502-E527 PolarHBondContact NH1-O 3.02Å; R502-E527 WeakPolarHBondContact O-CB 3.45Å; R503-E527 IonicContact CZ-OE1 3.82Å; R503-E527 IonicContact NE-OE1 2.62Å; R503-E527 PolarHBondContact NE-OE1 3.02Å; R503-E527 IonicContact NH2-OE1 2.79Å; R503-E527 PolarHBondContact NH2-OE1 3.36Å; R503-E527 VanDerWaalsContact NH2-OE1 3.12Å; P524-E527 HydrophobicContact CB-CG 3.96Å; P524-E527 HydrophobicContact CG-CG 4.08Å; P524-E527 WeakPolarHBondContact O-CB 3.32Å; P524-E527 PolarHBondContact O-N 2.85Å; L525-E527 PolarHBondContact O-N 3.21Å; L525-E527 VanDerWaalsContact O-N 3.11Å; E527-R581 WeakPolarHBondContact OE1-CD 3.4Å; E527-R581 IonicContact OE1-NE 3.66Å; E527-R581 IonicContact OE1-NH1 3.48Å; E527-R581 IonicContact OE2-CZ 3.91Å; E527-R581 VanDerWaalsContact OE2-CZ 3.25Å; E527-R581 IonicContact OE2-NE 2.79Å; E527-R581 IonicContact OE2-NH1 2.68Å; E527-R581 PolarHBondContact OE2-NH1 3.42Å
528	I	87.3	Confident	88.4	Confident	12 Å²	12	32.1 Å²	32.1	6%	0.062	17%	0.17	C	C	.	.	H	α-helix	trans	-101.4	-24.8	178.3	66.2	150.1	0	0	0	114.1	V481 F523 L525 V530 F532 F546 Y548	V481-I528 HydrophobicContact CG2-CD1 3.54Å; V481-I528 HydrophobicContact CG2-CG1 4.11Å; F523-I528 HydrophobicContact CB-CG2 3.66Å; F523-I528 HydrophobicContact CD1-CG2 3.81Å; F523-I528 HydrophobicContact CD2-CG2 3.98Å; F523-I528 HydrophobicContact CE1-CG2 4.41Å; F523-I528 HydrophobicContact CG-CG2 3.56Å; L525-I528 HydrophobicContact CD1-CD1 4.27Å; L525-I528 HydrophobicContact CD1-CG1 4.22Å; L525-I528 WeakPolarHBondContact O-CG1 3.35Å; L525-I528 PolarHBondContact O-N 3.35Å; I528-V530 PolarHBondContact O-N 2.8Å; I528-V530 VanDerWaalsContact O-N 3.15Å; I528-F532 HydrophobicContact CB-CB 4.15Å; I528-F532 HydrophobicContact CB-CD1 3.97Å; I528-F532 HydrophobicContact CB-CG 4.1Å; I528-F532 HydrophobicContact CG2-CD1 3.9Å; I528-F532 HydrophobicContact CG2-CD2 4.36Å; I528-F532 HydrophobicContact CG2-CE1 4.16Å; I528-F532 HydrophobicContact CG2-CG 4Å; I528-F532 HydrophobicContact CG2-CZ 4.48Å; I528-F532 VanDerWaalsContact O-CB 3.24Å; I528-F532 WeakPolarHBondContact O-CB 3.15Å; I528-F546 HydrophobicContact CD1-CE1 3.9Å; I528-F546 HydrophobicContact CD1-CZ 3.74Å; I528-Y548 HydrophobicContact CD1-CD1 4.28Å; I528-Y548 HydrophobicContact CD1-CD2 4.27Å; I528-Y548 HydrophobicContact CD1-CG 4.03Å
529	V	82.3	Confident	88.2	Confident	17 Å²	17	34.3 Å²	34.3	10%	0.103	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-32.5	-179.1	164.4	0	0	0	0	111.7	V364 L414 P437 V439 L525	V364-V529 HydrophobicContact CG1-CG1 4.37Å; V364-V529 HydrophobicContact CG2-CG1 4.04Å; V364-V529 HydrophobicContact CG2-CG2 3.81Å; L414-V529 HydrophobicContact CD1-CG1 4.48Å; L414-V529 WeakPolarHBondContact CD1-O 3.38Å; L414-V529 HydrophobicContact CD2-CG1 3.92Å; L414-V529 HydrophobicContact CG-CG1 4.06Å; P437-V529 HydrophobicContact CB-CG1 4.26Å; P437-V529 HydrophobicContact CG-CG1 4.34Å; V439-V529 HydrophobicContact CG1-CG2 4.2Å; L525-V529 HydrophobicContact CD1-CG2 3.64Å; L525-V529 HydrophobicContact CG-CG2 3.73Å; L525-V529 VanDerWaalsContact O-CG2 3.29Å; L525-V529 WeakPolarHBondContact O-CG2 3.14Å; L525-V529 PolarHBondContact O-N 3.24Å
530	V	76.3	Confident	87.9	Confident	42 Å²	42	34.3 Å²	34.3	26%	0.255	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.3	122	-173.6	-169.4	0	0	0	0	112.7	P437 R502 I528 F532	P437-V530 HydrophobicContact CG-CG2 4.12Å; R502-V530 PolarHBondContact NH1-O 2.86Å; R502-V530 PolarHBondContact NH2-O 3.28Å; I528-V530 PolarHBondContact O-N 2.8Å; I528-V530 VanDerWaalsContact O-N 3.15Å; V530-F532 PolarHBondContact O-N 2.91Å; V530-F532 VanDerWaalsContact O-N 3.09Å
531	D	78.6	Confident	87.4	Confident	58 Å²	58	36.3 Å²	36.3	31%	0.31	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	62	-7.8	-179.3	-32.5	-55	0	0	0	117.4	R502 Y533 D534 L535 R672	R502-D531 IonicContact NH2-OD2 2.59Å; D531-Y533 PolarHBondContact O-N 2.83Å; D531-D534 PolarHBondContact O-N 2.83Å; D531-L535 HydrophobicContact CB-CD1 3.9Å; D531-L535 HydrophobicContact CB-CG 4.23Å; D531-L535 WeakPolarHBondContact O-CB 3.29Å; D531-L535 WeakPolarHBondContact O-CD1 3.34Å; D531-L535 WeakPolarHBondContact O-CG 3.42Å; D531-L535 PolarHBondContact O-N 2.78Å; D531-R672 IonicContact OD1-CZ 2.72Å; D531-R672 IonicContact OD1-NH1 3.15Å; D531-R672 PolarHBondContact OD1-NH1 3.03Å; D531-R672 IonicContact OD2-CZ 3.83Å; D531-R672 IonicContact OD2-NH1 3.41Å; D531-R672 PolarHBondContact OD2-NH1 2.86Å; D531-R672 IonicContact OD2-NH2 2.65Å
532	F	86.2	Confident	86.8	Confident	1 Å²	1	38 Å²	38	0%	0.004	22%	0.22	C	C	.	.	H	α-helix	trans	-64.8	-43.2	-168.5	179.1	-106	0	0	0	112.9	I485 L498 R502 F523 I528 V530 L536 F546	I485-F532 HydrophobicContact CD1-CZ 4.18Å; L498-F532 HydrophobicContact CD2-CD2 4.14Å; L498-F532 HydrophobicContact CD2-CE2 3.95Å; L498-F532 HydrophobicContact CG-CD2 4.16Å; L498-F532 HydrophobicContact CG-CE2 3.89Å; R502-F532 HydrophobicContact CG-CD2 3.9Å; R502-F532 HydrophobicContact CG-CE2 4.26Å; F523-F532 HydrophobicContact CE1-CE2 4.31Å; F523-F532 HydrophobicContact CE1-CZ 4.17Å; F523-F532 HydrophobicContact CE2-CZ 4.19Å; F523-F532 HydrophobicContact CZ-CE1 4.44Å; F523-F532 HydrophobicContact CZ-CE2 4.27Å; F523-F532 AromaticContact CZ-CZ 3.69Å; F523-F532 HydrophobicContact CZ-CZ 3.69Å; I528-F532 HydrophobicContact CB-CB 4.15Å; I528-F532 HydrophobicContact CB-CD1 3.97Å; I528-F532 HydrophobicContact CB-CG 4.1Å; I528-F532 HydrophobicContact CG2-CD1 3.9Å; I528-F532 HydrophobicContact CG2-CD2 4.36Å; I528-F532 HydrophobicContact CG2-CE1 4.16Å; I528-F532 HydrophobicContact CG2-CG 4Å; I528-F532 HydrophobicContact CG2-CZ 4.48Å; I528-F532 VanDerWaalsContact O-CB 3.24Å; I528-F532 WeakPolarHBondContact O-CB 3.15Å; V530-F532 PolarHBondContact O-N 2.91Å; V530-F532 VanDerWaalsContact O-N 3.09Å; F532-L536 HydrophobicContact CE1-CD2 4.49Å; F532-L536 VanDerWaalsContact O-CB 3.23Å; F532-L536 WeakPolarHBondContact O-CB 3.39Å; F532-L536 PolarHBondContact O-N 2.86Å; F532-F546 HydrophobicContact CD1-CD1 4.24Å; F532-F546 AromaticContact CD1-CE1 3.89Å; F532-F546 HydrophobicContact CD1-CE1 3.89Å; F532-F546 HydrophobicContact CD1-CZ 4.05Å; F532-F546 HydrophobicContact CE1-CD1 4.19Å; F532-F546 HydrophobicContact CE1-CD2 4.09Å; F532-F546 AromaticContact CE1-CE1 3.9Å; F532-F546 HydrophobicContact CE1-CE1 3.9Å; F532-F546 AromaticContact CE1-CE2 3.76Å; F532-F546 HydrophobicContact CE1-CE2 3.76Å; F532-F546 HydrophobicContact CE1-CG 4.27Å; F532-F546 AromaticContact CE1-CZ 3.66Å; F532-F546 HydrophobicContact CE1-CZ 3.66Å
533	Y	82.1	Confident	86.2	Confident	55 Å²	55	44.1 Å²	44.1	22%	0.216	24%	0.243	C	C	.	.	H	α-helix	trans	-64.5	-42.2	179.8	-172.7	-109.1	0	0	0	112.2	D531 L536 K537 F546	D531-Y533 PolarHBondContact O-N 2.83Å; Y533-L536 PolarHBondContact O-N 2.95Å; Y533-K537 HydrophobicContact CD1-CD 4.18Å; Y533-K537 HydrophobicContact CE1-CD 3.73Å; Y533-K537 VanDerWaalsContact CE1-NZ 3.35Å; Y533-K537 WeakPolarHBondContact O-CB 3.33Å; Y533-K537 PolarHBondContact O-N 2.97Å; Y533-K537 WeakPolarHBondContact OH-CE 3.28Å; Y533-K537 PolarHBondContact OH-NZ 2.81Å; Y533-F546 HydrophobicContact CD2-CB 4.11Å; Y533-F546 HydrophobicContact CD2-CD1 4.26Å; Y533-F546 HydrophobicContact CE2-CB 4.28Å
534	D	81.4	Confident	85.9	Confident	105 Å²	105	44.2 Å²	44.2	56%	0.561	24%	0.243	S	C	*	.	H	α-helix	trans	-71.3	-40.1	-180	-47.3	-61.1	0	0	0	111.7	D531 S538	D531-D534 PolarHBondContact O-N 2.83Å; D534-S538 WeakPolarHBondContact O-CB 3.21Å; D534-S538 PolarHBondContact O-N 2.89Å
535	L	88	Confident	85.6	Confident	65 Å²	65	44.2 Å²	44.2	34%	0.34	24%	0.244	S	C	.	.	H	α-helix	trans	-63	-43.9	172.1	-71.9	169.3	0	0	0	111.1	L498 R502 D531 S538 M539	L498-L535 HydrophobicContact CD1-CB 4.19Å; L498-L535 HydrophobicContact CD1-CD1 4.22Å; L498-L535 HydrophobicContact CD2-CB 4.13Å; R502-L535 VanDerWaalsContact NH2-CD1 3.33Å; D531-L535 HydrophobicContact CB-CD1 3.9Å; D531-L535 HydrophobicContact CB-CG 4.23Å; D531-L535 WeakPolarHBondContact O-CB 3.29Å; D531-L535 WeakPolarHBondContact O-CD1 3.34Å; D531-L535 WeakPolarHBondContact O-CG 3.42Å; D531-L535 PolarHBondContact O-N 2.78Å; L535-S538 PolarHBondContact O-N 2.9Å; L535-M539 VanDerWaalsContact O-CB 3.29Å; L535-M539 WeakPolarHBondContact O-CB 3.24Å; L535-M539 WeakPolarHBondContact O-CG 3.25Å; L535-M539 PolarHBondContact O-N 3.5Å
536	L	88.8	Confident	85.6	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-60.2	-52.3	177.2	-179.6	65.6	0	0	0	110.9	I485 I495 L498 F532 Y533 S538 M539 S540 A544 F546	I485-L536 HydrophobicContact CG1-CD2 4.32Å; I485-L536 HydrophobicContact CG2-CD1 4.27Å; I485-L536 HydrophobicContact CG2-CD2 4.2Å; I495-L536 HydrophobicContact CB-CD1 4.41Å; I495-L536 HydrophobicContact CD1-CD1 4.06Å; I495-L536 HydrophobicContact CG1-CD1 3.82Å; I495-L536 HydrophobicContact CG2-CD1 3.88Å; L498-L536 HydrophobicContact CD2-CB 4.1Å; L498-L536 HydrophobicContact CD2-CD1 4.4Å; F532-L536 HydrophobicContact CE1-CD2 4.49Å; F532-L536 VanDerWaalsContact O-CB 3.23Å; F532-L536 WeakPolarHBondContact O-CB 3.39Å; F532-L536 PolarHBondContact O-N 2.86Å; Y533-L536 PolarHBondContact O-N 2.95Å; L536-S538 PolarHBondContact O-N 3.26Å; L536-M539 PolarHBondContact O-N 3.3Å; L536-S540 VanDerWaalsContact O-CB 3.3Å; L536-S540 WeakPolarHBondContact O-CB 3.44Å; L536-S540 PolarHBondContact O-N 3.47Å; L536-S540 PolarHBondContact O-OG 2.89Å; L536-A544 HydrophobicContact CD1-CB 4.07Å; L536-A544 HydrophobicContact CD2-CB 4.39Å; L536-A544 HydrophobicContact CG-CB 3.94Å; L536-F546 HydrophobicContact CD2-CB 3.69Å; L536-F546 HydrophobicContact CD2-CG 4.28Å
537	K	86.7	Confident	85.5	Confident	82 Å²	82	43.1 Å²	43.1	36%	0.357	24%	0.237	S	C	.	.	H	α-helix	trans	-58.1	-45.3	175.3	-84.4	-178.5	158.6	175.1	0	112.2	Y533 S540 S541 G542	Y533-K537 HydrophobicContact CD1-CD 4.18Å; Y533-K537 HydrophobicContact CE1-CD 3.73Å; Y533-K537 VanDerWaalsContact CE1-NZ 3.35Å; Y533-K537 WeakPolarHBondContact O-CB 3.33Å; Y533-K537 PolarHBondContact O-N 2.97Å; Y533-K537 WeakPolarHBondContact OH-CE 3.28Å; Y533-K537 PolarHBondContact OH-NZ 2.81Å; K537-S540 CarbonylContact O-C 3.52Å; K537-S540 PolarHBondContact O-N 2.95Å; K537-S540 PolarHBondContact O-OG 3.34Å; K537-S541 PolarHBondContact O-N 3.29Å; K537-S541 VanDerWaalsContact O-N 3.11Å; K537-G542 PolarHBondContact O-N 2.84Å
538	S	88.6	Confident	85.5	Confident	95 Å²	95	44.4 Å²	44.4	66%	0.664	24%	0.242	S	C	*	.	H	α-helix	trans	-62.1	-46.7	178.9	-174.2	0	0	0	0	111.8	D534 L535 L536 S540 S541	D534-S538 WeakPolarHBondContact O-CB 3.21Å; D534-S538 PolarHBondContact O-N 2.89Å; L535-S538 PolarHBondContact O-N 2.9Å; L536-S538 PolarHBondContact O-N 3.26Å; S538-S540 VanDerWaalsContact C-N 3.28Å; S538-S540 PolarHBondContact O-N 3.46Å; S538-S541 PolarHBondContact O-N 2.88Å
539	M	89.7	Confident	85.4	Confident	63 Å²	63	47.7 Å²	47.7	31%	0.31	26%	0.257	S	S	.	.	H	α-helix	trans	-68.8	-26	179.9	-68.6	173.7	81.2	0	0	113.1	Y491 K494 L498 L535 L536	Y491-M539 VanDerWaalsContact CD1-O 3.25Å; Y491-M539 WeakPolarHBondContact CD1-O 3.44Å; K494-M539 HydrophobicContact CB-CE 4.12Å; L498-M539 HydrophobicContact CB-CE 4.28Å; L498-M539 HydrophobicContact CB-SD 4.08Å; L498-M539 HydrophobicContact CD1-SD 4.22Å; L498-M539 HydrophobicContact CD2-SD 3.95Å; L498-M539 HydrophobicContact CG-SD 4.3Å; L535-M539 VanDerWaalsContact O-CB 3.29Å; L535-M539 WeakPolarHBondContact O-CB 3.24Å; L535-M539 WeakPolarHBondContact O-CG 3.25Å; L535-M539 PolarHBondContact O-N 3.5Å; L536-M539 PolarHBondContact O-N 3.3Å
540	S	87.6	Confident	85.6	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	7.8	178.5	81	0	0	0	0	114.8	L536 K537 S538 G542 Y543 A544	L536-S540 VanDerWaalsContact O-CB 3.3Å; L536-S540 WeakPolarHBondContact O-CB 3.44Å; L536-S540 PolarHBondContact O-N 3.47Å; L536-S540 PolarHBondContact O-OG 2.89Å; K537-S540 CarbonylContact O-C 3.52Å; K537-S540 PolarHBondContact O-N 2.95Å; K537-S540 PolarHBondContact O-OG 3.34Å; S538-S540 VanDerWaalsContact C-N 3.28Å; S538-S540 PolarHBondContact O-N 3.46Å; S540-G542 PolarHBondContact O-N 3.45Å; S540-G542 VanDerWaalsContact O-N 3.11Å; S540-G542 PolarHBondContact OG-N 2.97Å; S540-Y543 WeakPolarHBondContact O-CB 3.22Å; S540-Y543 VanDerWaalsContact O-CD2 3.31Å; S540-Y543 WeakPolarHBondContact O-CD2 3.34Å; S540-Y543 PolarHBondContact O-N 2.91Å; S540-Y543 PolarHBondContact OG-N 2.83Å; S540-A544 VanDerWaalsContact CB-CB 3.41Å; S540-A544 VanDerWaalsContact OG-CB 3.29Å; S540-A544 WeakPolarHBondContact OG-CB 3.48Å; S540-A544 PolarHBondContact OG-N 3.42Å
541	S	84.8	Confident	86.2	Confident	82 Å²	82	49.6 Å²	49.6	57%	0.573	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.7	27.3	-172.4	-49.6	0	0	0	0	114.6	Y491 K537 S538	Y491-S541 WeakPolarHBondContact OH-CB 3.38Å; Y491-S541 PolarHBondContact OH-OG 2.98Å; Y491-S541 VanDerWaalsContact OH-OG 3.1Å; K537-S541 PolarHBondContact O-N 3.29Å; K537-S541 VanDerWaalsContact O-N 3.11Å; S538-S541 PolarHBondContact O-N 2.88Å
542	G	82.3	Confident	86.8	Confident	45 Å²	45	51.8 Å²	51.8	46%	0.464	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	88	-9.1	-176.3	0	0	0	0	0	115.6	K537 S540 A544	K537-G542 PolarHBondContact O-N 2.84Å; S540-G542 PolarHBondContact O-N 3.45Å; S540-G542 VanDerWaalsContact O-N 3.11Å; S540-G542 PolarHBondContact OG-N 2.97Å; G542-A544 PolarHBondContact O-N 2.72Å
543	Y	84.3	Confident	87	Confident	148 Å²	148	55.4 Å²	55.4	58%	0.58	30%	0.296	S	S	*	.			trans	-78.3	-11.6	-175.3	-63.5	-65	0	0	0	116.3	P488 Y491 S540	P488-Y543 HydrophobicContact CG-CG 4.26Å; Y491-Y543 AromaticContact CE2-CD2 3.98Å; Y491-Y543 HydrophobicContact CE2-CD2 3.98Å; S540-Y543 WeakPolarHBondContact O-CB 3.22Å; S540-Y543 VanDerWaalsContact O-CD2 3.31Å; S540-Y543 WeakPolarHBondContact O-CD2 3.34Å; S540-Y543 PolarHBondContact O-N 2.91Å; S540-Y543 PolarHBondContact OG-N 2.83Å
544	A	88	Confident	87.6	Confident	2 Å²	2	57.2 Å²	57.2	2%	0.017	31%	0.307	C	S	.	.			trans	-91.8	130.5	177.7	0	0	0	0	0	110.9	L486 A487 I495 L536 S540 G542	L486-A544 CarbonylContact O-C 3.55Å; L486-A544 WeakPolarHBondContact O-CA 3.49Å; A487-A544 HydrophobicContact CB-CB 3.85Å; I495-A544 HydrophobicContact CD1-CB 4.2Å; L536-A544 HydrophobicContact CD1-CB 4.07Å; L536-A544 HydrophobicContact CD2-CB 4.39Å; L536-A544 HydrophobicContact CG-CB 3.94Å; S540-A544 VanDerWaalsContact CB-CB 3.41Å; S540-A544 VanDerWaalsContact OG-CB 3.29Å; S540-A544 WeakPolarHBondContact OG-CB 3.48Å; S540-A544 PolarHBondContact OG-N 3.42Å; G542-A544 PolarHBondContact O-N 2.72Å
545	S	87.5	Confident	88.1	Confident	3 Å²	3	54.6 Å²	54.6	2%	0.021	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	153.9	167.7	56.8	0	0	0	0	110.6	Q179 A180 I485 L486	Q179-S545 PolarHBondContact OE1-OG 3.42Å; A180-S545 PolarHBondContact N-OG 3.47Å; I485-S545 WeakPolarHBondContact CA-O 3.15Å; L486-S545 PolarHBondContact N-O 3.37Å; L486-S545 PolarHBondContact O-N 2.75Å
546	F	89.6	Confident	88.3	Confident	11 Å²	11	52.4 Å²	52.4	5%	0.048	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	138.6	-177.7	177.5	-120.5	0	0	0	109.7	T484 I485 F523 I528 F532 Y533 L536 Y548	T484-F546 WeakPolarHBondContact O-CA 3.32Å; I485-F546 HydrophobicContact CD1-CD2 4.47Å; I485-F546 HydrophobicContact CG1-CD2 3.54Å; I485-F546 HydrophobicContact CG1-CE2 4.08Å; F523-F546 HydrophobicContact CE2-CE2 4.27Å; I528-F546 HydrophobicContact CD1-CE1 3.9Å; I528-F546 HydrophobicContact CD1-CZ 3.74Å; F532-F546 HydrophobicContact CD1-CD1 4.24Å; F532-F546 AromaticContact CD1-CE1 3.89Å; F532-F546 HydrophobicContact CD1-CE1 3.89Å; F532-F546 HydrophobicContact CD1-CZ 4.05Å; F532-F546 HydrophobicContact CE1-CD1 4.19Å; F532-F546 HydrophobicContact CE1-CD2 4.09Å; F532-F546 AromaticContact CE1-CE1 3.9Å; F532-F546 HydrophobicContact CE1-CE1 3.9Å; F532-F546 AromaticContact CE1-CE2 3.76Å; F532-F546 HydrophobicContact CE1-CE2 3.76Å; F532-F546 HydrophobicContact CE1-CG 4.27Å; F532-F546 AromaticContact CE1-CZ 3.66Å; F532-F546 HydrophobicContact CE1-CZ 3.66Å; Y533-F546 HydrophobicContact CD2-CB 4.11Å; Y533-F546 HydrophobicContact CD2-CD1 4.26Å; Y533-F546 HydrophobicContact CE2-CB 4.28Å; L536-F546 HydrophobicContact CD2-CB 3.69Å; L536-F546 HydrophobicContact CD2-CG 4.28Å; F546-Y548 HydrophobicContact CD1-CD1 4.41Å; F546-Y548 AromaticContact CE1-CD1 3.78Å; F546-Y548 HydrophobicContact CE1-CD1 3.78Å; F546-Y548 HydrophobicContact CE1-CG 4.39Å; F546-Y548 HydrophobicContact CZ-CD1 4.26Å; F546-Y548 HydrophobicContact CZ-CG 4.44Å
547	D	87.6	Confident	88.4	Confident	9 Å²	9	54.4 Å²	54.4	5%	0.048	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	160.1	170.5	-157.7	94.8	0	0	0	108.6	V152 A180 Q181 A184 G483 T484	V152-D547 WeakPolarHBondContact CB-OD1 3.23Å; V152-D547 WeakPolarHBondContact CG2-OD2 3.39Å; A180-D547 HydrophobicContact CB-CB 3.76Å; Q181-D547 HydrophobicContact CG-CB 4.42Å; Q181-D547 WeakPolarHBondContact CG-OD1 3.5Å; A184-D547 HydrophobicContact CB-CB 4.46Å; G483-D547 CarbonylContact C-O 3.52Å; G483-D547 WeakPolarHBondContact CA-O 3.2Å; T484-D547 PolarHBondContact N-O 3.21Å; T484-D547 PolarHBondContact O-N 3Å
548	Y	88.4	Confident	88.6	Confident	37 Å²	37	50.6 Å²	50.6	15%	0.145	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	133.6	-178.5	66.6	-85	0	0	0	113.2	V152 D153 V481 L482 L525 I528 F546	V152-Y548 HydrophobicContact CB-CE1 4.47Å; V152-Y548 HydrophobicContact CG1-CD1 4.01Å; V152-Y548 HydrophobicContact CG1-CE1 3.47Å; V152-Y548 VanDerWaalsContact CG1-CE1 3.47Å; V152-Y548 HydrophobicContact CG2-CD1 4.22Å; V152-Y548 HydrophobicContact CG2-CE1 4.14Å; D153-Y548 PolarHBondContact OD1-OH 2.94Å; V481-Y548 HydrophobicContact CB-CD2 4.18Å; V481-Y548 HydrophobicContact CG1-CD2 4Å; V481-Y548 HydrophobicContact CG2-CD2 4.43Å; L482-Y548 WeakPolarHBondContact O-CA 3.48Å; L525-Y548 HydrophobicContact CD1-CE2 4.25Å; I528-Y548 HydrophobicContact CD1-CD1 4.28Å; I528-Y548 HydrophobicContact CD1-CD2 4.27Å; I528-Y548 HydrophobicContact CD1-CG 4.03Å; F546-Y548 HydrophobicContact CD1-CD1 4.41Å; F546-Y548 AromaticContact CE1-CD1 3.78Å; F546-Y548 HydrophobicContact CE1-CD1 3.78Å; F546-Y548 HydrophobicContact CE1-CG 4.39Å; F546-Y548 HydrophobicContact CZ-CD1 4.26Å; F546-Y548 HydrophobicContact CZ-CG 4.44Å
549	E	85.5	Confident	88.8	Confident	80 Å²	80	47 Å²	47	37%	0.374	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	152.5	177.7	-67	156.9	-154.1	0	0	110.4	V481 L482 A551	V481-E549 CarbonylContact C-O 3.52Å; V481-E549 WeakPolarHBondContact CA-O 3.32Å; V481-E549 VanDerWaalsContact CB-O 3.24Å; V481-E549 WeakPolarHBondContact CB-O 3.35Å; L482-E549 PolarHBondContact N-O 2.96Å; L482-E549 PolarHBondContact O-N 3.12Å; E549-A551 PolarHBondContact O-N 3.44Å
550	N	85.6	Confident	88.8	Confident	65 Å²	65	46.8 Å²	46.8	35%	0.348	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	126.7	175.4	175.6	65.6	0	0	0	111.5	M363 D552	M363-N550 HydrophobicContact CE-CB 3.83Å; N550-D552 PolarHBondContact ND2-OD1 2.94Å
551	A	89.1	Confident	89	Confident	35 Å²	35	46.8 Å²	46.8	29%	0.289	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	38.1	-177.7	0	0	0	0	0	112.4	M480 L482 L522 E549	M480-A551 HydrophobicContact CB-CB 4.42Å; M480-A551 CarbonylContact O-C 3.5Å; M480-A551 WeakPolarHBondContact O-CA 3.44Å; M480-A551 PolarHBondContact O-N 2.92Å; L482-A551 HydrophobicContact CB-CB 4.22Å; L522-A551 HydrophobicContact CD1-CB 3.44Å; L522-A551 VanDerWaalsContact CD1-CB 3.44Å; E549-A551 PolarHBondContact O-N 3.44Å
552	D	90.2	Very high	89.3	Confident	104 Å²	104	44 Å²	44	56%	0.556	23%	0.234	S	C	*	.	E	Extended strand (participates in β ladder)	trans	54.8	-151.4	178.7	-68.2	-39.7	0	0	0	114.6	M480 N550	M480-D552 PolarHBondContact N-O 3.47Å; N550-D552 PolarHBondContact ND2-OD1 2.94Å
553	Y	92.2	Very high	89.6	Confident	76 Å²	76	41.9 Å²	41.9	30%	0.298	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	138.8	-169.3	-80.1	-99.5	0	0	0	110.9	P440 K442 L477 E478 P479	P440-Y553 WeakPolarHBondContact O-CE1 3.49Å; P440-Y553 PolarHBondContact O-OH 3.37Å; K442-Y553 HydrophobicContact CB-CD1 4.27Å; K442-Y553 HydrophobicContact CB-CE1 4.26Å; K442-Y553 HydrophobicContact CD-CD1 3.88Å; K442-Y553 HydrophobicContact CD-CD2 4.29Å; K442-Y553 HydrophobicContact CD-CE1 3.92Å; K442-Y553 HydrophobicContact CD-CE2 4.34Å; K442-Y553 HydrophobicContact CD-CG 4.06Å; K442-Y553 HydrophobicContact CG-CD1 4.02Å; K442-Y553 HydrophobicContact CG-CE1 3.7Å; L477-Y553 HydrophobicContact CB-CD1 3.99Å; L477-Y553 HydrophobicContact CB-CG 4.47Å; E478-Y553 WeakPolarHBondContact O-CA 3.35Å; P479-Y553 HydrophobicContact CB-CD1 4.34Å; P479-Y553 HydrophobicContact CB-CE1 3.94Å; P479-Y553 HydrophobicContact CG-CE1 4.39Å
554	Q	93.6	Very high	89.9	Confident	94 Å²	94	36.2 Å²	36.2	44%	0.439	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	140.5	178.4	-175.9	178.8	-30.6	0	0	111.1	L477 E478 M480	L477-Q554 CarbonylContact C-O 3.52Å; L477-Q554 VanDerWaalsContact CA-O 3.27Å; L477-Q554 WeakPolarHBondContact CA-O 3.13Å; E478-Q554 PolarHBondContact N-O 3.24Å; E478-Q554 PolarHBondContact O-N 3.26Å; M480-Q554 HydrophobicContact CG-CB 3.47Å; M480-Q554 VanDerWaalsContact CG-CB 3.47Å; M480-Q554 HydrophobicContact SD-CB 4.02Å
555	A	93	Very high	89.9	Confident	49 Å²	49	36.8 Å²	36.8	41%	0.405	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	132.6	175.1	0	0	0	0	0	111.8	E475 Y476 L477	E475-A555 WeakPolarHBondContact OE2-CB 3.42Å; Y476-A555 WeakPolarHBondContact O-CA 3.45Å; L477-A555 HydrophobicContact CD2-CB 3.89Å
556	A	91.7	Very high	89.8	Confident	20 Å²	20	38.7 Å²	38.7	17%	0.165	20%	0.204	C	C	.	.			trans	-145.4	148.8	-173.4	0	0	0	0	0	112.6	Y476 E478 L558	Y476-A556 PolarHBondContact O-N 3.21Å; E478-A556 HydrophobicContact CB-CB 4.36Å; E478-A556 HydrophobicContact CG-CB 3.73Å; E478-A556 WeakPolarHBondContact OE1-CB 3.4Å; A556-L558 HydrophobicContact CB-CD2 4.1Å; A556-L558 HydrophobicContact CB-CG 4.02Å; A556-L558 PolarHBondContact O-N 3.11Å
557	D	91.1	Very high	89.5	Confident	43 Å²	43	40.4 Å²	40.4	23%	0.23	23%	0.225	C	C	.	.			trans	-83.5	66.9	-179.9	-170.9	41.1	0	0	0	111.8	R470 R579	R470-D557 IonicContact CZ-OD1 2.86Å; R470-D557 IonicContact NH1-OD1 2.82Å; R470-D557 PolarHBondContact NH1-OD1 3.39Å; R470-D557 IonicContact NH2-OD1 3.2Å; R470-D557 PolarHBondContact NH2-OD1 3.11Å; D557-R579 VanDerWaalsContact CG-NH2 3.3Å; D557-R579 PolarHBondContact O-N 3.47Å; D557-R579 IonicContact OD1-CZ 3.6Å; D557-R579 IonicContact OD1-NE 3.39Å; D557-R579 IonicContact OD1-NH2 3.65Å; D557-R579 PolarHBondContact OD1-NH2 3.44Å; D557-R579 WeakPolarHBondContact OD2-CB 3.3Å; D557-R579 WeakPolarHBondContact OD2-CD 3.35Å; D557-R579 IonicContact OD2-CZ 2.76Å; D557-R579 IonicContact OD2-NE 3.44Å; D557-R579 PolarHBondContact OD2-NE 3.38Å; D557-R579 IonicContact OD2-NH2 3.16Å; D557-R579 PolarHBondContact OD2-NH2 3.29Å
558	L	91.4	Very high	89.3	Confident	1 Å²	1	47.1 Å²	47.1	1%	0.005	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	149.1	179.5	-57	-179	0	0	0	112.1	Y441 F467 Y476 E478 A556 I576	Y441-L558 HydrophobicContact CD1-CD1 3.24Å; Y441-L558 HydrophobicContact CE1-CD1 3.48Å; Y441-L558 VanDerWaalsContact CE1-CD1 3.48Å; Y441-L558 HydrophobicContact CE1-CD2 4.12Å; Y441-L558 HydrophobicContact CE1-CG 4.46Å; Y441-L558 HydrophobicContact CG-CD1 4.14Å; F467-L558 HydrophobicContact CE2-CB 4.41Å; F467-L558 HydrophobicContact CZ-CB 4.16Å; Y476-L558 HydrophobicContact CG-CB 4.44Å; E478-L558 HydrophobicContact CB-CD1 4.25Å; A556-L558 HydrophobicContact CB-CD2 4.1Å; A556-L558 HydrophobicContact CB-CG 4.02Å; A556-L558 PolarHBondContact O-N 3.11Å; L558-I576 HydrophobicContact CB-CG2 4.15Å; L558-I576 HydrophobicContact CD1-CG2 4.17Å; L558-I576 HydrophobicContact CD2-CG2 4.45Å
559	I	91	Very high	89.2	Confident	21 Å²	21	49.1 Å²	49.1	11%	0.108	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	147.6	172.9	49.2	166	0	0	0	111.3	V577 R579 A582 I610	I559-V577 HydrophobicContact CD1-CG2 4.44Å; I559-V577 HydrophobicContact CG1-CG2 4.05Å; I559-V577 WeakPolarHBondContact CG1-O 3.36Å; I559-V577 PolarHBondContact N-O 3.44Å; I559-V577 PolarHBondContact O-N 2.86Å; I559-R579 HydrophobicContact CD1-CB 4.42Å; I559-R579 HydrophobicContact CD1-CG 4.36Å; I559-A582 HydrophobicContact CD1-CB 3.81Å; I559-I610 HydrophobicContact CB-CG2 4.34Å; I559-I610 HydrophobicContact CD1-CD1 3.44Å; I559-I610 VanDerWaalsContact CD1-CD1 3.44Å; I559-I610 HydrophobicContact CD1-CG1 3.9Å; I559-I610 HydrophobicContact CD1-CG2 4.09Å
560	K	91.1	Very high	89	Confident	57 Å²	57	46.4 Å²	46.4	25%	0.248	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	127.5	166.8	-169.9	178.8	-173.1	171	0	109.4	P464 A465 F467 D562 T574	P464-K560 WeakPolarHBondContact O-CE 3.43Å; A465-K560 PolarHBondContact O-NZ 2.73Å; F467-K560 HydrophobicContact CB-CD 4.3Å; F467-K560 HydrophobicContact CD1-CB 3.82Å; F467-K560 HydrophobicContact CE1-CB 4.33Å; F467-K560 HydrophobicContact CG-CB 4.38Å; K560-D562 WeakPolarHBondContact CE-OD1 3.28Å; K560-T574 HydrophobicContact CD-CG2 4.27Å; K560-T574 HydrophobicContact CG-CG2 3.68Å
561	M	91.3	Very high	88.6	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	114.3	172.4	-176.5	-177.4	66.6	0	0	109.3	T574 T575 V577 T585 G586 A608 A609 I615	M561-T574 WeakPolarHBondContact O-CA 3.48Å; M561-T575 VanDerWaalsContact CE-OG1 3.24Å; M561-T575 WeakPolarHBondContact CE-OG1 3.49Å; M561-T575 PolarHBondContact N-O 3.36Å; M561-T575 PolarHBondContact O-N 3.15Å; M561-V577 HydrophobicContact CB-CG2 3.94Å; M561-V577 HydrophobicContact CE-CG1 4.34Å; M561-T585 HydrophobicContact CE-CG2 3.97Å; M561-G586 WeakPolarHBondContact SD-CA 3.31Å; M561-A608 HydrophobicContact CG-CB 4.4Å; M561-A608 HydrophobicContact SD-CB 4.18Å; M561-A609 WeakPolarHBondContact CA-O 3.38Å; M561-I615 HydrophobicContact CG-CD1 4.25Å; M561-I615 HydrophobicContact SD-CD1 3.9Å
562	D	90.9	Very high	88.1	Confident	25 Å²	25	47.7 Å²	47.7	13%	0.134	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	141.7	-179.3	-60.7	-60.7	0	0	0	111	K560 L564 T574 A609	K560-D562 WeakPolarHBondContact CE-OD1 3.28Å; D562-L564 HydrophobicContact CB-CD2 4.34Å; D562-T574 WeakPolarHBondContact OD1-CG2 3.44Å; D562-T574 PolarHBondContact OD1-OG1 3.3Å; D562-A609 PolarHBondContact N-O 3.36Å; D562-A609 PolarHBondContact O-N 3.16Å
563	I	89.5	Confident	87.6	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	121.4	169.9	-61.5	-54.9	0	0	0	109.4	P569 V570 L573 M589 L593 Q607 A608	I563-P569 CarbonylContact O-C 3.58Å; I563-P569 WeakPolarHBondContact O-CA 3.36Å; I563-V570 PolarHBondContact O-N 3.26Å; I563-L573 HydrophobicContact CB-CB 3.96Å; I563-L573 HydrophobicContact CG1-CB 3.9Å; I563-L573 HydrophobicContact CG2-CD1 4.2Å; I563-M589 HydrophobicContact CD1-CB 4.44Å; I563-M589 HydrophobicContact CD1-CG 4.24Å; I563-M589 HydrophobicContact CD1-SD 3.69Å; I563-M589 HydrophobicContact CG1-CG 4.38Å; I563-M589 HydrophobicContact CG1-SD 3.46Å; I563-M589 WeakPolarHBondContact CG1-SD 3.46Å; I563-L593 HydrophobicContact CG2-CD1 3.72Å; I563-Q607 CarbonylContact C-O 3.58Å; I563-Q607 WeakPolarHBondContact CA-O 3.22Å; I563-A608 HydrophobicContact CD1-CB 3.84Å
564	L	89.9	Confident	87.3	Confident	29 Å²	29	39.9 Å²	39.9	15%	0.152	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	122.8	176.9	-41.2	177.1	0	0	0	110.8	D562 R568 P569 Q607 A609	D562-L564 HydrophobicContact CB-CD2 4.34Å; L564-R568 CarbonylContact C-O 3.52Å; L564-R568 WeakPolarHBondContact CA-O 3.48Å; L564-P569 HydrophobicContact CD2-CB 3.86Å; L564-Q607 HydrophobicContact CB-CB 4.23Å; L564-Q607 PolarHBondContact N-O 3.1Å; L564-Q607 PolarHBondContact O-N 2.72Å; L564-A609 HydrophobicContact CD1-CB 3.85Å; L564-A609 HydrophobicContact CG-CB 4.13Å
565	L	87.2	Confident	86.9	Confident	13 Å²	13	37 Å²	37	7%	0.068	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	116.1	168.5	-64.4	-176.2	0	0	0	109.7	G567 R568 V570 I597 I606 V661	L565-G567 PolarHBondContact O-N 3.31Å; L565-R568 PolarHBondContact N-O 3Å; L565-R568 PolarHBondContact O-N 3.31Å; L565-V570 HydrophobicContact CB-CG2 4.26Å; L565-V570 HydrophobicContact CD1-CG2 3.86Å; L565-V570 HydrophobicContact CG-CG2 3.82Å; L565-I597 HydrophobicContact CD1-CD1 4.2Å; L565-I597 HydrophobicContact CD2-CD1 3.94Å; L565-I606 HydrophobicContact CD2-CB 4.24Å; L565-I606 HydrophobicContact CD2-CG1 3.81Å; L565-I606 HydrophobicContact CD2-CG2 4.08Å; L565-V661 HydrophobicContact CD1-CG2 3.46Å; L565-V661 VanDerWaalsContact CD1-CG2 3.46Å
566	N	85.6	Confident	86.8	Confident	43 Å²	43	35.1 Å²	35.1	23%	0.23	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.1	21.7	-170.9	-87.9	-17.3	0	0	0	115.1	F602 A605 V659	N566-F602 WeakPolarHBondContact ND2-CE2 3.44Å; N566-A605 PolarHBondContact N-O 2.89Å; N566-A605 PolarHBondContact OD1-N 2.93Å; N566-V659 HydrophobicContact CB-CG2 4.37Å; N566-V659 VanDerWaalsContact ND2-CG2 3.31Å; N566-V659 WeakPolarHBondContact ND2-CG2 3.36Å
567	G	83.2	Confident	86.7	Confident	47 Å²	47	34.7 Å²	34.7	49%	0.485	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	96.5	3.6	-179.4	0	0	0	0	0	115.3	L565	L565-G567 PolarHBondContact O-N 3.31Å
568	R	84.4	Confident	86.7	Confident	151 Å²	151	34 Å²	34	57%	0.57	18%	0.18	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-100.1	133.8	167.9	-61	-171.4	-169.6	159.2	7.6	110.2	L564 L565 N658	L564-R568 CarbonylContact C-O 3.52Å; L564-R568 WeakPolarHBondContact CA-O 3.48Å; L565-R568 PolarHBondContact N-O 3Å; L565-R568 PolarHBondContact O-N 3.31Å; R568-N658 VanDerWaalsContact CZ-OD1 3.26Å; R568-N658 VanDerWaalsContact NH1-CG 3.34Å; R568-N658 PolarHBondContact NH1-OD1 3.5Å; R568-N658 PolarHBondContact NH2-OD1 2.88Å
569	P	84.9	Confident	86.7	Confident	79 Å²	79	40.4 Å²	40.4	51%	0.513	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	156.6	174.7	29.5	-35	0	0	0	112	I563 L564	I563-P569 CarbonylContact O-C 3.58Å; I563-P569 WeakPolarHBondContact O-CA 3.36Å; L564-P569 HydrophobicContact CD2-CB 3.86Å
570	V	82.4	Confident	86.6	Confident	22 Å²	22	46.5 Å²	46.5	13%	0.133	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	98.9	176.6	179.6	0	0	0	0	106.9	I563 L565 E572 L573 T574 F666	I563-V570 PolarHBondContact O-N 3.26Å; L565-V570 HydrophobicContact CB-CG2 4.26Å; L565-V570 HydrophobicContact CD1-CG2 3.86Å; L565-V570 HydrophobicContact CG-CG2 3.82Å; V570-E572 VanDerWaalsContact C-N 3.31Å; V570-E572 PolarHBondContact O-N 2.91Å; V570-L573 HydrophobicContact CB-CB 4.49Å; V570-L573 HydrophobicContact CB-CD1 4.34Å; V570-L573 HydrophobicContact CG1-CB 4.21Å; V570-L573 HydrophobicContact CG1-CD1 3.78Å; V570-L573 HydrophobicContact CG1-CG 3.84Å; V570-L573 PolarHBondContact O-N 2.92Å; V570-L573 VanDerWaalsContact O-N 3.1Å; V570-T574 PolarHBondContact O-N 3.4Å; V570-F666 HydrophobicContact CG1-CE2 3.62Å; V570-F666 HydrophobicContact CG1-CZ 3.81Å
571	E	78.1	Confident	86.4	Confident	93 Å²	93	47 Å²	47	44%	0.435	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	-32.4	-163.3	-61	-178.5	159.2	0	0	112.9	A465 L573 T574	A465-E571 HydrophobicContact CB-CB 4.44Å; E571-L573 PolarHBondContact O-N 3.45Å; E571-T574 WeakPolarHBondContact O-CB 3Å; E571-T574 PolarHBondContact O-N 3.15Å; E571-T574 VanDerWaalsContact O-N 3.16Å
572	E	76.8	Confident	86.4	Confident	35 Å²	35	47.1 Å²	47.1	16%	0.164	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	-6.7	-179.9	-41.6	81.7	169.1	0	0	113.1	S400 L401 A402 V570 F666	S400-E572 WeakPolarHBondContact CB-OE1 3.33Å; S400-E572 VanDerWaalsContact OG-CD 3.3Å; S400-E572 VanDerWaalsContact OG-CG 3.31Å; S400-E572 WeakPolarHBondContact OG-CG 3.46Å; S400-E572 PolarHBondContact OG-OE1 2.85Å; L401-E572 PolarHBondContact N-OE1 3.13Å; L401-E572 VanDerWaalsContact N-OE1 3.11Å; A402-E572 WeakPolarHBondContact CB-OE1 3.46Å; A402-E572 PolarHBondContact N-OE1 3.35Å; V570-E572 VanDerWaalsContact C-N 3.31Å; V570-E572 PolarHBondContact O-N 2.91Å; E572-F666 HydrophobicContact CB-CE1 3.83Å; E572-F666 HydrophobicContact CB-CZ 3.81Å; E572-F666 HydrophobicContact CG-CE1 4.28Å; E572-F666 HydrophobicContact CG-CZ 4.3Å
573	L	80.9	Confident	86.4	Confident	7 Å²	7	52.8 Å²	52.8	4%	0.037	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	-4	170.3	-60.5	179.4	0	0	0	112.5	I563 V570 E571 M589 L593 F666 V669 L670	I563-L573 HydrophobicContact CB-CB 3.96Å; I563-L573 HydrophobicContact CG1-CB 3.9Å; I563-L573 HydrophobicContact CG2-CD1 4.2Å; V570-L573 HydrophobicContact CB-CB 4.49Å; V570-L573 HydrophobicContact CB-CD1 4.34Å; V570-L573 HydrophobicContact CG1-CB 4.21Å; V570-L573 HydrophobicContact CG1-CD1 3.78Å; V570-L573 HydrophobicContact CG1-CG 3.84Å; V570-L573 PolarHBondContact O-N 2.92Å; V570-L573 VanDerWaalsContact O-N 3.1Å; E571-L573 PolarHBondContact O-N 3.45Å; L573-M589 HydrophobicContact CB-SD 4.44Å; L573-L593 HydrophobicContact CD1-CD1 4.13Å; L573-L593 HydrophobicContact CD1-CD2 3.85Å; L573-F666 HydrophobicContact CD1-CE2 4.04Å; L573-F666 HydrophobicContact CD2-CE2 4.5Å; L573-F666 HydrophobicContact CD2-CZ 4.47Å; L573-F666 HydrophobicContact CG-CE2 4.07Å; L573-F666 HydrophobicContact CG-CZ 4.12Å; L573-V669 HydrophobicContact CD2-CG1 4.07Å; L573-L670 HydrophobicContact CD2-CD2 4.14Å
574	T	85.1	Confident	86.4	Confident	8 Å²	8	56 Å²	56	5%	0.049	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	134	172.6	-70.3	0	0	0	0	109.9	P464 K560 M561 D562 V570 E571	P464-T574 HydrophobicContact CB-CG2 4.09Å; P464-T574 WeakPolarHBondContact CB-O 3.48Å; K560-T574 HydrophobicContact CD-CG2 4.27Å; K560-T574 HydrophobicContact CG-CG2 3.68Å; M561-T574 WeakPolarHBondContact O-CA 3.48Å; D562-T574 WeakPolarHBondContact OD1-CG2 3.44Å; D562-T574 PolarHBondContact OD1-OG1 3.3Å; V570-T574 PolarHBondContact O-N 3.4Å; E571-T574 WeakPolarHBondContact O-CB 3Å; E571-T574 PolarHBondContact O-N 3.15Å; E571-T574 VanDerWaalsContact O-N 3.16Å
575	T	85.9	Confident	86.3	Confident	33 Å²	33	57 Å²	57	20%	0.202	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	149.5	-176.7	42.5	0	0	0	0	111.4	M561 M589	M561-T575 VanDerWaalsContact CE-OG1 3.24Å; M561-T575 WeakPolarHBondContact CE-OG1 3.49Å; M561-T575 PolarHBondContact N-O 3.36Å; M561-T575 PolarHBondContact O-N 3.15Å; T575-M589 HydrophobicContact CG2-CE 4.13Å
576	I	89.7	Confident	86.5	Confident	10 Å²	10	56.3 Å²	56.3	5%	0.051	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	129.1	172.2	-60.6	161.9	0	0	0	107.3	Y441 I461 P464 F467 L558	Y441-I576 HydrophobicContact CD1-CG2 4.43Å; Y441-I576 HydrophobicContact CD2-CB 4.29Å; Y441-I576 HydrophobicContact CD2-CD1 3.42Å; Y441-I576 VanDerWaalsContact CD2-CD1 3.42Å; Y441-I576 HydrophobicContact CD2-CG1 4.45Å; Y441-I576 HydrophobicContact CD2-CG2 4.15Å; Y441-I576 HydrophobicContact CE1-CG2 4.06Å; Y441-I576 HydrophobicContact CE2-CB 3.73Å; Y441-I576 HydrophobicContact CE2-CD1 3.67Å; Y441-I576 HydrophobicContact CE2-CG1 4.31Å; Y441-I576 HydrophobicContact CE2-CG2 3.76Å; Y441-I576 HydrophobicContact CG-CD1 4.24Å; Y441-I576 HydrophobicContact CG-CG2 4.44Å; I461-I576 HydrophobicContact CG2-CD1 4.17Å; P464-I576 HydrophobicContact CB-CD1 4.32Å; P464-I576 HydrophobicContact CB-CG1 4.12Å; P464-I576 HydrophobicContact CG-CD1 4.33Å; P464-I576 HydrophobicContact CG-CG1 4.43Å; F467-I576 HydrophobicContact CB-CD1 4.43Å; F467-I576 HydrophobicContact CB-CG1 4.45Å; F467-I576 HydrophobicContact CD2-CD1 3.5Å; F467-I576 VanDerWaalsContact CD2-CD1 3.5Å; F467-I576 HydrophobicContact CD2-CG1 3.65Å; F467-I576 HydrophobicContact CD2-CG2 4.28Å; F467-I576 HydrophobicContact CE2-CD1 4.14Å; F467-I576 HydrophobicContact CE2-CG1 4.12Å; F467-I576 HydrophobicContact CE2-CG2 3.88Å; F467-I576 HydrophobicContact CG-CD1 4.34Å; F467-I576 HydrophobicContact CG-CG1 4.24Å; L558-I576 HydrophobicContact CB-CG2 4.15Å; L558-I576 HydrophobicContact CD1-CG2 4.17Å; L558-I576 HydrophobicContact CD2-CG2 4.45Å
577	V	89.8	Confident	86.8	Confident	12 Å²	12	58.6 Å²	58.6	7%	0.073	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	150.5	-176.4	-64.9	0	0	0	0	111.3	I559 M561 A582 T585	I559-V577 HydrophobicContact CD1-CG2 4.44Å; I559-V577 HydrophobicContact CG1-CG2 4.05Å; I559-V577 WeakPolarHBondContact CG1-O 3.36Å; I559-V577 PolarHBondContact N-O 3.44Å; I559-V577 PolarHBondContact O-N 2.86Å; M561-V577 HydrophobicContact CB-CG2 3.94Å; M561-V577 HydrophobicContact CE-CG1 4.34Å; V577-A582 HydrophobicContact CG2-CB 3.73Å; V577-T585 HydrophobicContact CG1-CG2 4.26Å
578	H	91.8	Very high	87.1	Confident	29 Å²	29	58.6 Å²	58.6	13%	0.134	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	139.4	167.2	-166	-116.5	0	0	0	110.1	E580 R581 A582	H578-E580 IonicContact CE1-OE2 3.24Å; H578-E580 PolarHBondContact CE1-OE2 3.05Å; H578-E580 IonicContact ND1-OE2 3.45Å; H578-E580 PolarHBondContact ND1-OE2 3.12Å; H578-E580 PolarHBondContact O-N 2.88Å; H578-E580 VanDerWaalsContact O-N 3.09Å; H578-R581 PolarHBondContact O-N 3.31Å; H578-A582 PolarHBondContact O-N 3.04Å
579	R	90.3	Very high	87.2	Confident	134 Å²	134	52.9 Å²	52.9	51%	0.506	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-49.3	-43.4	-172.4	-172.5	-175.9	-55.5	-158	12.1	113.7	D557 I559 R581 A582	D557-R579 VanDerWaalsContact CG-NH2 3.3Å; D557-R579 PolarHBondContact O-N 3.47Å; D557-R579 IonicContact OD1-CZ 3.6Å; D557-R579 IonicContact OD1-NE 3.39Å; D557-R579 IonicContact OD1-NH2 3.65Å; D557-R579 PolarHBondContact OD1-NH2 3.44Å; D557-R579 WeakPolarHBondContact OD2-CB 3.3Å; D557-R579 WeakPolarHBondContact OD2-CD 3.35Å; D557-R579 IonicContact OD2-CZ 2.76Å; D557-R579 IonicContact OD2-NE 3.44Å; D557-R579 PolarHBondContact OD2-NE 3.38Å; D557-R579 IonicContact OD2-NH2 3.16Å; D557-R579 PolarHBondContact OD2-NH2 3.29Å; I559-R579 HydrophobicContact CD1-CB 4.42Å; I559-R579 HydrophobicContact CD1-CG 4.36Å; R579-R581 VanDerWaalsContact C-N 3.34Å; R579-R581 PolarHBondContact O-N 3.09Å; R579-A582 WeakPolarHBondContact O-CB 3.4Å; R579-A582 PolarHBondContact O-N 3.02Å
580	E	89.8	Confident	87.5	Confident	150 Å²	150	49.1 Å²	49.1	70%	0.701	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	-63.7	-36.1	-177.4	-58.6	171.5	137.1	0	0	113.2	H578	H578-E580 IonicContact CE1-OE2 3.24Å; H578-E580 PolarHBondContact CE1-OE2 3.05Å; H578-E580 IonicContact ND1-OE2 3.45Å; H578-E580 PolarHBondContact ND1-OE2 3.12Å; H578-E580 PolarHBondContact O-N 2.88Å; H578-E580 VanDerWaalsContact O-N 3.09Å
581	R	87.6	Confident	87.9	Confident	66 Å²	66	51.5 Å²	51.5	25%	0.249	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-86.7	-8.2	-176.7	-75.6	176.7	147.3	-111.3	-14.9	113.1	S501 E527 H578 R579 Y583 S584 T585	S501-R581 PolarHBondContact O-NH2 2.99Å; E527-R581 WeakPolarHBondContact OE1-CD 3.4Å; E527-R581 IonicContact OE1-NE 3.66Å; E527-R581 IonicContact OE1-NH1 3.48Å; E527-R581 IonicContact OE2-CZ 3.91Å; E527-R581 VanDerWaalsContact OE2-CZ 3.25Å; E527-R581 IonicContact OE2-NE 2.79Å; E527-R581 IonicContact OE2-NH1 2.68Å; E527-R581 PolarHBondContact OE2-NH1 3.42Å; H578-R581 PolarHBondContact O-N 3.31Å; R579-R581 VanDerWaalsContact C-N 3.34Å; R579-R581 PolarHBondContact O-N 3.09Å; R581-Y583 PolarHBondContact O-N 3.45Å; R581-S584 PolarHBondContact O-N 2.78Å; R581-S584 PolarHBondContact O-OG 2.76Å; R581-S584 VanDerWaalsContact O-OG 3.05Å; R581-T585 WeakPolarHBondContact O-CB 3.42Å; R581-T585 PolarHBondContact O-N 3.07Å; R581-T585 PolarHBondContact O-OG1 3.38Å; R581-T585 VanDerWaalsContact O-OG1 3.07Å
582	A	90.1	Very high	88.2	Confident	3 Å²	3	50.7 Å²	50.7	3%	0.025	24%	0.242	C	C	.	.	H	α-helix	trans	-61	-41.3	-174.3	0	0	0	0	0	113.7	I559 V577 H578 R579 G586 I610 I615	I559-A582 HydrophobicContact CD1-CB 3.81Å; V577-A582 HydrophobicContact CG2-CB 3.73Å; H578-A582 PolarHBondContact O-N 3.04Å; R579-A582 WeakPolarHBondContact O-CB 3.4Å; R579-A582 PolarHBondContact O-N 3.02Å; A582-G586 WeakPolarHBondContact O-CA 3.42Å; A582-G586 PolarHBondContact O-N 3.41Å; A582-I610 HydrophobicContact CB-CD1 4.34Å; A582-I615 HydrophobicContact CB-CD1 4.06Å; A582-I615 WeakPolarHBondContact O-CD1 3.25Å
583	Y	91.6	Very high	88.7	Confident	145 Å²	145	49 Å²	49	57%	0.569	24%	0.235	S	C	*	.	H	α-helix	trans	-66.2	-44.6	-179.5	178	-101.7	0	0	0	112.8	R581 K587 I615	R581-Y583 PolarHBondContact O-N 3.45Å; Y583-K587 WeakPolarHBondContact O-CB 3.47Å; Y583-K587 PolarHBondContact O-N 2.91Å; Y583-I615 WeakPolarHBondContact CD2-O 3.2Å; Y583-I615 WeakPolarHBondContact CE2-O 3.43Å
584	S	90.4	Very high	89.1	Confident	68 Å²	68	52.8 Å²	52.8	48%	0.476	25%	0.251	S	S	.	.	H	α-helix	trans	-69.4	-46.3	-179.4	46.2	0	0	0	0	111.7	R581 K587 A588	R581-S584 PolarHBondContact O-N 2.78Å; R581-S584 PolarHBondContact O-OG 2.76Å; R581-S584 VanDerWaalsContact O-OG 3.05Å; S584-K587 PolarHBondContact O-N 3.11Å; S584-A588 WeakPolarHBondContact O-CB 3.41Å; S584-A588 PolarHBondContact O-N 2.88Å
585	T	87.6	Confident	89.2	Confident	48 Å²	48	60.5 Å²	60.5	29%	0.294	29%	0.286	S	S	.	.	H	α-helix	trans	-63.1	-46.6	176.3	-54.8	0	0	0	0	111.6	M561 V577 R581 K587 A588 M589	M561-T585 HydrophobicContact CE-CG2 3.97Å; V577-T585 HydrophobicContact CG1-CG2 4.26Å; R581-T585 WeakPolarHBondContact O-CB 3.42Å; R581-T585 PolarHBondContact O-N 3.07Å; R581-T585 PolarHBondContact O-OG1 3.38Å; R581-T585 VanDerWaalsContact O-OG1 3.07Å; T585-K587 PolarHBondContact O-N 2.99Å; T585-A588 PolarHBondContact O-N 3.48Å; T585-M589 WeakPolarHBondContact O-CB 2.84Å; T585-M589 PolarHBondContact O-N 3.07Å
586	G	90.9	Very high	89.1	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-62.9	-39.5	178.3	0	0	0	0	0	113.1	M561 A582 C590	M561-G586 WeakPolarHBondContact SD-CA 3.31Å; A582-G586 WeakPolarHBondContact O-CA 3.42Å; A582-G586 PolarHBondContact O-N 3.41Å; G586-C590 WeakPolarHBondContact O-CB 3.21Å; G586-C590 PolarHBondContact O-N 3.41Å; G586-C590 PolarHBondContact O-SG 2.91Å
587	K	92.1	Very high	88.8	Confident	91 Å²	91	60.1 Å²	60.1	40%	0.396	29%	0.285	S	S	.	.	H	α-helix	trans	-63.1	-52.3	173	-179.1	-175.7	165.6	-172.2	0	111.4	Y583 S584 T585 M589 C590 E591 A616	Y583-K587 WeakPolarHBondContact O-CB 3.47Å; Y583-K587 PolarHBondContact O-N 2.91Å; S584-K587 PolarHBondContact O-N 3.11Å; T585-K587 PolarHBondContact O-N 2.99Å; K587-M589 VanDerWaalsContact C-N 3.26Å; K587-M589 PolarHBondContact O-N 2.92Å; K587-C590 WeakPolarHBondContact O-CB 3.39Å; K587-C590 PolarHBondContact O-N 2.84Å; K587-C590 VanDerWaalsContact O-N 3.09Å; K587-E591 WeakPolarHBondContact CE-OE1 3.33Å; K587-E591 WeakPolarHBondContact CE-OE2 3.39Å; K587-E591 HydrophobicContact CG-CG 4.46Å; K587-E591 IonicContact NZ-OE1 3.45Å; K587-E591 PolarHBondContact NZ-OE1 2.86Å; K587-E591 PolarHBondContact O-N 2.99Å; K587-A616 HydrophobicContact CB-CB 4.17Å
588	A	88.6	Confident	88.5	Confident	47 Å²	47	62.4 Å²	62.4	39%	0.388	30%	0.3	S	S	.	.	H	α-helix	trans	-60.1	-36.6	-178.4	0	0	0	0	0	112.3	S584 T585 E591 R592	S584-A588 WeakPolarHBondContact O-CB 3.41Å; S584-A588 PolarHBondContact O-N 2.88Å; T585-A588 PolarHBondContact O-N 3.48Å; A588-E591 PolarHBondContact O-N 2.54Å; A588-R592 WeakPolarHBondContact O-CG 3.41Å; A588-R592 PolarHBondContact O-N 3.18Å
589	M	86.9	Confident	88.1	Confident	30 Å²	30	68.5 Å²	68.5	15%	0.148	32%	0.322	C	S	.	.	H	α-helix	trans	-68.5	-42.1	174.6	-164	176.6	-69.6	0	0	111.9	I563 L573 T575 T585 K587 E591 R592 L593	I563-M589 HydrophobicContact CD1-CB 4.44Å; I563-M589 HydrophobicContact CD1-CG 4.24Å; I563-M589 HydrophobicContact CD1-SD 3.69Å; I563-M589 HydrophobicContact CG1-CG 4.38Å; I563-M589 HydrophobicContact CG1-SD 3.46Å; I563-M589 WeakPolarHBondContact CG1-SD 3.46Å; L573-M589 HydrophobicContact CB-SD 4.44Å; T575-M589 HydrophobicContact CG2-CE 4.13Å; T585-M589 WeakPolarHBondContact O-CB 2.84Å; T585-M589 PolarHBondContact O-N 3.07Å; K587-M589 VanDerWaalsContact C-N 3.26Å; K587-M589 PolarHBondContact O-N 2.92Å; M589-E591 VanDerWaalsContact C-N 3.32Å; M589-E591 PolarHBondContact O-N 2.87Å; M589-R592 PolarHBondContact O-N 3.48Å; M589-L593 HydrophobicContact CG-CD1 4.11Å; M589-L593 WeakPolarHBondContact O-CB 3.45Å; M589-L593 WeakPolarHBondContact O-CD1 3.32Å; M589-L593 WeakPolarHBondContact O-CG 3.35Å; M589-L593 PolarHBondContact O-N 2.9Å
590	C	90.9	Very high	87.9	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.007	31%	0.308	C	S	.	.	H	α-helix	trans	-60.7	-38.5	173.7	-71.5	0	0	0	0	112.9	G586 K587 K594 I606 A608 E618	G586-C590 WeakPolarHBondContact O-CB 3.21Å; G586-C590 PolarHBondContact O-N 3.41Å; G586-C590 PolarHBondContact O-SG 2.91Å; K587-C590 WeakPolarHBondContact O-CB 3.39Å; K587-C590 PolarHBondContact O-N 2.84Å; K587-C590 VanDerWaalsContact O-N 3.09Å; C590-K594 WeakPolarHBondContact O-CB 3.48Å; C590-K594 PolarHBondContact O-N 2.77Å; C590-K594 VanDerWaalsContact O-N 3.12Å; C590-I606 HydrophobicContact CB-CG2 4.16Å; C590-A608 PolarHBondContact SG-N 3.14Å; C590-A608 VanDerWaalsContact SG-N 3.45Å; C590-E618 HydrophobicContact CB-CB 4.06Å; C590-E618 HydrophobicContact CB-CG 4.1Å
591	E	90.6	Very high	87.5	Confident	72 Å²	72	61.9 Å²	61.9	34%	0.336	30%	0.298	S	S	.	.	H	α-helix	trans	-67.8	-44.5	176.9	-73.2	173.5	147.1	0	0	111.6	K587 A588 M589 L593 K594 E595 E618	K587-E591 WeakPolarHBondContact CE-OE1 3.33Å; K587-E591 WeakPolarHBondContact CE-OE2 3.39Å; K587-E591 HydrophobicContact CG-CG 4.46Å; K587-E591 IonicContact NZ-OE1 3.45Å; K587-E591 PolarHBondContact NZ-OE1 2.86Å; K587-E591 PolarHBondContact O-N 2.99Å; A588-E591 PolarHBondContact O-N 2.54Å; M589-E591 VanDerWaalsContact C-N 3.32Å; M589-E591 PolarHBondContact O-N 2.87Å; E591-L593 PolarHBondContact O-N 2.98Å; E591-K594 WeakPolarHBondContact O-CB 3.33Å; E591-K594 PolarHBondContact O-N 2.81Å; E591-E595 PolarHBondContact O-N 3.49Å; E591-E618 HydrophobicContact CG-CG 4.33Å
592	R	85.8	Confident	87.4	Confident	75 Å²	75	59.4 Å²	59.4	28%	0.283	29%	0.289	S	S	.	.	H	α-helix	trans	-61.4	-44.7	174.7	-71.1	179.6	69.8	-143.2	-1.9	112.8	A588 M589 K594 E595 S596 S668 V669	A588-R592 WeakPolarHBondContact O-CG 3.41Å; A588-R592 PolarHBondContact O-N 3.18Å; M589-R592 PolarHBondContact O-N 3.48Å; R592-K594 VanDerWaalsContact C-N 3.27Å; R592-K594 PolarHBondContact O-N 3.12Å; R592-E595 PolarHBondContact O-N 3.34Å; R592-E595 VanDerWaalsContact O-N 3.14Å; R592-S596 PolarHBondContact O-N 2.78Å; R592-S596 VanDerWaalsContact O-N 3.1Å; R592-S668 PolarHBondContact NH2-O 2.91Å; R592-V669 PolarHBondContact NH1-O 3.02Å; R592-V669 PolarHBondContact NH2-O 3.47Å
593	L	86.6	Confident	87.2	Confident	1 Å²	1	62.7 Å²	62.7	1%	0.005	30%	0.304	C	S	.	.	H	α-helix	trans	-62.9	-32.2	177.4	-77.4	159.6	0	0	0	112.7	I563 L573 M589 E591 E595 I597 I606 V669	I563-L593 HydrophobicContact CG2-CD1 3.72Å; L573-L593 HydrophobicContact CD1-CD1 4.13Å; L573-L593 HydrophobicContact CD1-CD2 3.85Å; M589-L593 HydrophobicContact CG-CD1 4.11Å; M589-L593 WeakPolarHBondContact O-CB 3.45Å; M589-L593 WeakPolarHBondContact O-CD1 3.32Å; M589-L593 WeakPolarHBondContact O-CG 3.35Å; M589-L593 PolarHBondContact O-N 2.9Å; E591-L593 PolarHBondContact O-N 2.98Å; L593-E595 VanDerWaalsContact C-N 3.27Å; L593-E595 PolarHBondContact O-N 3.27Å; L593-I597 HydrophobicContact CB-CD1 4.2Å; L593-I597 HydrophobicContact CD2-CD1 4.05Å; L593-I597 VanDerWaalsContact O-CB 3.24Å; L593-I597 WeakPolarHBondContact O-CB 3.47Å; L593-I597 WeakPolarHBondContact O-CG1 3.39Å; L593-I597 PolarHBondContact O-N 2.96Å; L593-I606 HydrophobicContact CB-CD1 3.9Å; L593-I606 HydrophobicContact CB-CG2 3.91Å; L593-I606 HydrophobicContact CD1-CG2 3.83Å; L593-V669 HydrophobicContact CD2-CB 4.49Å; L593-V669 HydrophobicContact CD2-CG1 4.2Å; L593-V669 HydrophobicContact CD2-CG2 3.92Å; L593-V669 HydrophobicContact CG-CG1 4.31Å; L593-V669 HydrophobicContact CG-CG2 4.29Å
594	K	88.7	Confident	87	Confident	86 Å²	86	55.8 Å²	55.8	37%	0.374	28%	0.277	S	S	.	.	H	α-helix	trans	-69.8	-24.1	176.6	172.7	-160.9	-173.5	176	0	112.6	C590 E591 R592 I606 E618	C590-K594 WeakPolarHBondContact O-CB 3.48Å; C590-K594 PolarHBondContact O-N 2.77Å; C590-K594 VanDerWaalsContact O-N 3.12Å; E591-K594 WeakPolarHBondContact O-CB 3.33Å; E591-K594 PolarHBondContact O-N 2.81Å; R592-K594 VanDerWaalsContact C-N 3.27Å; R592-K594 PolarHBondContact O-N 3.12Å; K594-I606 HydrophobicContact CB-CD1 3.89Å; K594-E618 HydrophobicContact CB-CB 4.35Å; K594-E618 HydrophobicContact CD-CB 4.19Å; K594-E618 HydrophobicContact CD-CG 3.94Å; K594-E618 VanDerWaalsContact CD-OE2 3.28Å; K594-E618 WeakPolarHBondContact CD-OE2 3.43Å; K594-E618 WeakPolarHBondContact CE-OE2 3.23Å; K594-E618 IonicContact NZ-OE1 2.72Å; K594-E618 PolarHBondContact NZ-OE1 3.17Å; K594-E618 IonicContact NZ-OE2 2.86Å; K594-E618 PolarHBondContact NZ-OE2 3.03Å
595	E	86.6	Confident	87	Confident	170 Å²	170	52.6 Å²	52.6	79%	0.794	26%	0.255	S	S	*	.	H	α-helix	trans	-86.3	-37.8	174.6	-66.1	-176	168	0	0	112.5	E591 R592 L593	E591-E595 PolarHBondContact O-N 3.49Å; R592-E595 PolarHBondContact O-N 3.34Å; R592-E595 VanDerWaalsContact O-N 3.14Å; L593-E595 VanDerWaalsContact C-N 3.27Å; L593-E595 PolarHBondContact O-N 3.27Å
596	S	84.1	Confident	87.2	Confident	28 Å²	28	50.3 Å²	50.3	20%	0.196	24%	0.241	C	C	.	.	H	α-helix	trans	-81.1	-34.9	-179.8	73.9	0	0	0	0	114.3	R592 P598 A665 V669	R592-S596 PolarHBondContact O-N 2.78Å; R592-S596 VanDerWaalsContact O-N 3.1Å; S596-P598 WeakPolarHBondContact O-CD 3.43Å; S596-A665 WeakPolarHBondContact O-CB 3.42Å; S596-A665 PolarHBondContact OG-O 3.46Å; S596-A665 VanDerWaalsContact OG-O 3.04Å; S596-V669 VanDerWaalsContact OG-CG2 3.25Å; S596-V669 WeakPolarHBondContact OG-CG2 3.12Å
597	I	83.9	Confident	87.4	Confident	6 Å²	6	51.4 Å²	51.4	3%	0.031	25%	0.246	C	C	.	.	S	Bend	trans	-75	119.8	-175.6	-67.5	171.7	0	0	0	110.4	L565 L593 I604 I606 V620	L565-I597 HydrophobicContact CD1-CD1 4.2Å; L565-I597 HydrophobicContact CD2-CD1 3.94Å; L593-I597 HydrophobicContact CB-CD1 4.2Å; L593-I597 HydrophobicContact CD2-CD1 4.05Å; L593-I597 VanDerWaalsContact O-CB 3.24Å; L593-I597 WeakPolarHBondContact O-CB 3.47Å; L593-I597 WeakPolarHBondContact O-CG1 3.39Å; L593-I597 PolarHBondContact O-N 2.96Å; I597-I604 HydrophobicContact CG2-CD1 3.69Å; I597-I606 HydrophobicContact CD1-CD1 4.16Å; I597-I606 HydrophobicContact CD1-CG1 4.3Å; I597-V620 HydrophobicContact CB-CG2 4.42Å; I597-V620 HydrophobicContact CG2-CG2 4.41Å
598	P	83	Confident	87.5	Confident	61 Å²	61	47.1 Å²	47.1	40%	0.396	23%	0.227	S	C	.	.	P	Polyproline II helix	trans	-65.7	146.8	-179.9	27.4	-35	0	0	0	111.7	S596 P662	S596-P598 WeakPolarHBondContact O-CD 3.43Å; P598-P662 HydrophobicContact CG-CG 3.96Å
599	R	84.8	Confident	87.7	Confident	157 Å²	157	44.9 Å²	44.9	59%	0.592	21%	0.209	S	C	*	.	P	Polyproline II helix	trans	-63.1	139.7	176.8	-63.6	-178.7	-176.4	171	5.1	110.4	V620 K621 F623	R599-V620 HydrophobicContact CB-CG1 4.31Å; R599-V620 HydrophobicContact CG-CG1 3.73Å; R599-K621 WeakPolarHBondContact CD-O 3.2Å; R599-K621 WeakPolarHBondContact CG-O 3.46Å; R599-F623 HydrophobicContact CB-CD2 4.08Å; R599-F623 HydrophobicContact CB-CE1 4.38Å; R599-F623 HydrophobicContact CB-CE2 3.78Å; R599-F623 HydrophobicContact CB-CZ 3.93Å; R599-F623 WeakPolarHBondContact O-CE2 3.23Å
600	Q	84.3	Confident	87.9	Confident	43 Å²	43	45.9 Å²	45.9	20%	0.201	21%	0.214	C	C	.	.			trans	-118.3	179.4	176	-64.8	-171.5	11.3	0	0	111.2	F602 I604 A622 F623	Q600-F602 HydrophobicContact CB-CE1 4.41Å; Q600-F602 PolarHBondContact O-N 3.5Å; Q600-I604 HydrophobicContact CB-CD1 4.24Å; Q600-I604 HydrophobicContact CG-CD1 3.92Å; Q600-A622 CarbonylContact O-C 3.55Å; Q600-A622 VanDerWaalsContact O-CA 3.26Å; Q600-A622 WeakPolarHBondContact O-CA 3.4Å; Q600-F623 PolarHBondContact O-N 3.04Å
601	M	82.9	Confident	87.7	Confident	101 Å²	101	48.4 Å²	48.4	50%	0.498	24%	0.24	S	C	.	.	S	Bend	trans	-73	-16.6	-179.4	-72.8	-70.6	-83.2	0	0	113.5	F623 K650 M653	M601-F623 HydrophobicContact SD-CB 3.97Å; M601-K650 WeakPolarHBondContact O-CE 3.46Å; M601-K650 PolarHBondContact O-NZ 3.46Å; M601-M653 HydrophobicContact CB-CE 3.84Å; M601-M653 HydrophobicContact CB-SD 3.82Å
602	F	84.6	Confident	87.4	Confident	14 Å²	14	51.1 Å²	51.1	6%	0.061	27%	0.267	C	S	.	.	S	Bend	trans	-115.4	166.1	170.1	60	-90.2	0	0	0	111	N566 Q600 I604 A622 M653 R654 V659	N566-F602 WeakPolarHBondContact ND2-CE2 3.44Å; Q600-F602 HydrophobicContact CB-CE1 4.41Å; Q600-F602 PolarHBondContact O-N 3.5Å; F602-I604 HydrophobicContact CD2-CG1 4.44Å; F602-I604 HydrophobicContact CE2-CG1 4.07Å; F602-A622 WeakPolarHBondContact O-CB 3.45Å; F602-M653 HydrophobicContact CB-CB 4.33Å; F602-M653 HydrophobicContact CD1-CB 3.98Å; F602-R654 HydrophobicContact CB-CB 4.03Å; F602-R654 HydrophobicContact CD2-CB 4.33Å; F602-R654 HydrophobicContact CD2-CG 4.4Å; F602-R654 HydrophobicContact CG-CB 4.33Å; F602-V659 HydrophobicContact CE2-CG2 3.86Å; F602-V659 HydrophobicContact CZ-CG2 4.17Å
603	E	86.1	Confident	87.7	Confident	72 Å²	72	54.5 Å²	54.5	34%	0.336	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-86.3	127.3	-175.8	-63.9	177.6	164.5	0	0	108.7	T619 A622 R624	E603-T619 HydrophobicContact CB-CG2 4.27Å; E603-A622 HydrophobicContact CB-CB 4.39Å; E603-A622 HydrophobicContact CG-CB 3.44Å; E603-A622 VanDerWaalsContact CG-CB 3.44Å; E603-R624 IonicContact OE1-CZ 3.96Å; E603-R624 IonicContact OE1-NH2 2.94Å; E603-R624 PolarHBondContact OE1-NH2 3.32Å
604	I	88.3	Confident	88.1	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	119.5	-178.9	-57.8	167.6	0	0	0	108.2	I597 Q600 F602 I606 T619 V620 V659	I597-I604 HydrophobicContact CG2-CD1 3.69Å; Q600-I604 HydrophobicContact CB-CD1 4.24Å; Q600-I604 HydrophobicContact CG-CD1 3.92Å; F602-I604 HydrophobicContact CD2-CG1 4.44Å; F602-I604 HydrophobicContact CE2-CG1 4.07Å; I604-I606 HydrophobicContact CG2-CG1 4.45Å; I604-T619 CarbonylContact O-C 3.58Å; I604-T619 VanDerWaalsContact O-CA 3.29Å; I604-T619 WeakPolarHBondContact O-CA 3.45Å; I604-V620 HydrophobicContact CB-CB 4.16Å; I604-V620 PolarHBondContact N-O 2.86Å; I604-V620 PolarHBondContact O-N 2.97Å; I604-V659 HydrophobicContact CD1-CG1 3.95Å; I604-V659 HydrophobicContact CD1-CG2 4.39Å; I604-V659 HydrophobicContact CG1-CG1 4.43Å; I604-V659 HydrophobicContact CG1-CG2 4.01Å; I604-V659 HydrophobicContact CG2-CG1 4.18Å; I604-V659 HydrophobicContact CG2-CG2 4.01Å
605	A	90.1	Very high	88.3	Confident	2 Å²	2	55 Å²	55	2%	0.017	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	126	170.6	0	0	0	0	0	110	N566 Q607	N566-A605 PolarHBondContact N-O 2.89Å; N566-A605 PolarHBondContact OD1-N 2.93Å; A605-Q607 HydrophobicContact CB-CG 4.43Å
606	I	92	Very high	88.7	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	128.7	170.4	-56.5	160.7	0	0	0	106	L565 C590 L593 K594 I597 I604 R617 E618 V620	L565-I606 HydrophobicContact CD2-CB 4.24Å; L565-I606 HydrophobicContact CD2-CG1 3.81Å; L565-I606 HydrophobicContact CD2-CG2 4.08Å; C590-I606 HydrophobicContact CB-CG2 4.16Å; L593-I606 HydrophobicContact CB-CD1 3.9Å; L593-I606 HydrophobicContact CB-CG2 3.91Å; L593-I606 HydrophobicContact CD1-CG2 3.83Å; K594-I606 HydrophobicContact CB-CD1 3.89Å; I597-I606 HydrophobicContact CD1-CD1 4.16Å; I597-I606 HydrophobicContact CD1-CG1 4.3Å; I604-I606 HydrophobicContact CG2-CG1 4.45Å; I606-R617 CarbonylContact O-C 3.49Å; I606-R617 WeakPolarHBondContact O-CA 3.41Å; I606-E618 HydrophobicContact CB-CB 4.38Å; I606-E618 PolarHBondContact N-O 2.86Å; I606-E618 PolarHBondContact O-N 3Å; I606-E618 VanDerWaalsContact O-O 3.05Å; I606-V620 HydrophobicContact CD1-CG2 3.77Å
607	Q	93.7	Very high	89.2	Confident	23 Å²	23	52 Å²	52	11%	0.107	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	132	-172.1	-57.5	178.1	-135.5	0	0	110	I563 L564 A605 V614 A616 R617	I563-Q607 CarbonylContact C-O 3.58Å; I563-Q607 WeakPolarHBondContact CA-O 3.22Å; L564-Q607 HydrophobicContact CB-CB 4.23Å; L564-Q607 PolarHBondContact N-O 3.1Å; L564-Q607 PolarHBondContact O-N 2.72Å; A605-Q607 HydrophobicContact CB-CG 4.43Å; Q607-V614 HydrophobicContact CB-CG1 4.19Å; Q607-V614 VanDerWaalsContact NE2-CG2 3.26Å; Q607-A616 CarbonylContact C-O 3.58Å; Q607-A616 WeakPolarHBondContact CA-O 3.06Å; Q607-R617 HydrophobicContact CG-CB 4.45Å; Q607-R617 HydrophobicContact CG-CG 4.13Å
608	A	94.4	Very high	89.7	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	134.2	163.8	0	0	0	0	0	108.6	M561 I563 C590 I615 A616	M561-A608 HydrophobicContact CG-CB 4.4Å; M561-A608 HydrophobicContact SD-CB 4.18Å; I563-A608 HydrophobicContact CD1-CB 3.84Å; C590-A608 PolarHBondContact SG-N 3.14Å; C590-A608 VanDerWaalsContact SG-N 3.45Å; A608-I615 HydrophobicContact CB-CD1 4.31Å; A608-I615 HydrophobicContact CB-CG1 4Å; A608-I615 VanDerWaalsContact O-CG1 3.28Å; A608-I615 WeakPolarHBondContact O-CG1 3.35Å; A608-I615 PolarHBondContact O-N 3.45Å; A608-A616 HydrophobicContact CB-CB 4.19Å; A608-A616 PolarHBondContact N-O 3.03Å; A608-A616 PolarHBondContact O-N 3.35Å
609	A	93.8	Very high	90.1	Very high	0 Å²	0	53 Å²	53	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	155.2	-177	0	0	0	0	0	112	M561 D562 L564 K613	M561-A609 WeakPolarHBondContact CA-O 3.38Å; D562-A609 PolarHBondContact N-O 3.36Å; D562-A609 PolarHBondContact O-N 3.16Å; L564-A609 HydrophobicContact CD1-CB 3.85Å; L564-A609 HydrophobicContact CG-CB 4.13Å; A609-K613 CarbonylContact C-O 3.48Å; A609-K613 VanDerWaalsContact CA-O 3.28Å; A609-K613 WeakPolarHBondContact CA-O 3.34Å
610	I	90.9	Very high	90.4	Very high	52 Å²	52	45.9 Å²	45.9	27%	0.267	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	99.2	169.5	-53.4	165	0	0	0	105.3	I559 A582 S612 K613 I615	I559-I610 HydrophobicContact CB-CG2 4.34Å; I559-I610 HydrophobicContact CD1-CD1 3.44Å; I559-I610 VanDerWaalsContact CD1-CD1 3.44Å; I559-I610 HydrophobicContact CD1-CG1 3.9Å; I559-I610 HydrophobicContact CD1-CG2 4.09Å; A582-I610 HydrophobicContact CB-CD1 4.34Å; I610-S612 PolarHBondContact O-N 3.46Å; I610-K613 PolarHBondContact N-O 3.25Å; I610-K613 PolarHBondContact O-N 3.1Å; I610-I615 HydrophobicContact CD1-CD1 4.13Å; I610-I615 HydrophobicContact CD1-CG2 3.59Å; I610-I615 HydrophobicContact CG1-CD1 4.07Å; I610-I615 HydrophobicContact CG1-CG1 4.46Å; I610-I615 HydrophobicContact CG1-CG2 4.06Å
611	G	85.8	Confident	90.6	Very high	53 Å²	53	51.2 Å²	51.2	55%	0.546	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.9	-121.8	-165.7	0	0	0	0	0	111.3
612	S	85.8	Confident	90.8	Very high	130 Å²	130	46.8 Å²	46.8	91%	0.909	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-14.4	178.5	59.5	0	0	0	0	114.9	I610	I610-S612 PolarHBondContact O-N 3.46Å
613	K	91.6	Very high	90.8	Very high	145 Å²	145	51.4 Å²	51.4	63%	0.63	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.1	109.7	-174.2	-173.6	-179.1	179.5	-178.1	0	111.6	A609 I610 I615	A609-K613 CarbonylContact C-O 3.48Å; A609-K613 VanDerWaalsContact CA-O 3.28Å; A609-K613 WeakPolarHBondContact CA-O 3.34Å; I610-K613 PolarHBondContact N-O 3.25Å; I610-K613 PolarHBondContact O-N 3.1Å; K613-I615 PolarHBondContact O-N 3.2Å
614	V	93.9	Very high	90.5	Very high	63 Å²	63	56.6 Å²	56.6	38%	0.382	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	125.6	170.1	-178.3	0	0	0	0	109.7	Q607 A616 R617	Q607-V614 HydrophobicContact CB-CG1 4.19Å; Q607-V614 VanDerWaalsContact NE2-CG2 3.26Å; V614-A616 WeakPolarHBondContact CG1-O 3.28Å; V614-R617 HydrophobicContact CG1-CB 4.45Å
615	I	94.3	Very high	90.3	Very high	35 Å²	35	64.5 Å²	64.5	18%	0.179	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	-36	178.8	50.7	165.3	0	0	0	113.1	M561 A582 Y583 A608 I610 K613	M561-I615 HydrophobicContact CG-CD1 4.25Å; M561-I615 HydrophobicContact SD-CD1 3.9Å; A582-I615 HydrophobicContact CB-CD1 4.06Å; A582-I615 WeakPolarHBondContact O-CD1 3.25Å; Y583-I615 WeakPolarHBondContact CD2-O 3.2Å; Y583-I615 WeakPolarHBondContact CE2-O 3.43Å; A608-I615 HydrophobicContact CB-CD1 4.31Å; A608-I615 HydrophobicContact CB-CG1 4Å; A608-I615 VanDerWaalsContact O-CG1 3.28Å; A608-I615 WeakPolarHBondContact O-CG1 3.35Å; A608-I615 PolarHBondContact O-N 3.45Å; I610-I615 HydrophobicContact CD1-CD1 4.13Å; I610-I615 HydrophobicContact CD1-CG2 3.59Å; I610-I615 HydrophobicContact CG1-CD1 4.07Å; I610-I615 HydrophobicContact CG1-CG1 4.46Å; I610-I615 HydrophobicContact CG1-CG2 4.06Å; K613-I615 PolarHBondContact O-N 3.2Å
616	A	94.3	Very high	90	Very high	9 Å²	9	69.7 Å²	69.7	7%	0.074	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	150.5	176.7	0	0	0	0	0	109.8	K587 Q607 A608 V614	K587-A616 HydrophobicContact CB-CB 4.17Å; Q607-A616 CarbonylContact C-O 3.58Å; Q607-A616 WeakPolarHBondContact CA-O 3.06Å; A608-A616 HydrophobicContact CB-CB 4.19Å; A608-A616 PolarHBondContact N-O 3.03Å; A608-A616 PolarHBondContact O-N 3.35Å; V614-A616 WeakPolarHBondContact CG1-O 3.28Å
617	R	94.3	Very high	89.6	Confident	126 Å²	126	71.6 Å²	71.6	48%	0.475	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	128.2	-177.4	175.6	178.7	-178.4	92.8	17	111	I606 Q607 V614	I606-R617 CarbonylContact O-C 3.49Å; I606-R617 WeakPolarHBondContact O-CA 3.41Å; Q607-R617 HydrophobicContact CG-CB 4.45Å; Q607-R617 HydrophobicContact CG-CG 4.13Å; V614-R617 HydrophobicContact CG1-CB 4.45Å
618	E	94.5	Very high	89.1	Confident	45 Å²	45	73.2 Å²	73.2	21%	0.21	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	167.3	166.7	-87.7	-65.5	-179.2	0	0	112	C590 E591 K594 I606	C590-E618 HydrophobicContact CB-CB 4.06Å; C590-E618 HydrophobicContact CB-CG 4.1Å; E591-E618 HydrophobicContact CG-CG 4.33Å; K594-E618 HydrophobicContact CB-CB 4.35Å; K594-E618 HydrophobicContact CD-CB 4.19Å; K594-E618 HydrophobicContact CD-CG 3.94Å; K594-E618 VanDerWaalsContact CD-OE2 3.28Å; K594-E618 WeakPolarHBondContact CD-OE2 3.43Å; K594-E618 WeakPolarHBondContact CE-OE2 3.23Å; K594-E618 IonicContact NZ-OE1 2.72Å; K594-E618 PolarHBondContact NZ-OE1 3.17Å; K594-E618 IonicContact NZ-OE2 2.86Å; K594-E618 PolarHBondContact NZ-OE2 3.03Å; I606-E618 HydrophobicContact CB-CB 4.38Å; I606-E618 PolarHBondContact N-O 2.86Å; I606-E618 PolarHBondContact O-N 3Å; I606-E618 VanDerWaalsContact O-O 3.05Å
619	T	92.6	Very high	88.6	Confident	44 Å²	44	75.9 Å²	75.9	27%	0.27	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	119.7	179.6	-65.8	0	0	0	0	112.7	E603 I604 K621	E603-T619 HydrophobicContact CB-CG2 4.27Å; I604-T619 CarbonylContact O-C 3.58Å; I604-T619 VanDerWaalsContact O-CA 3.29Å; I604-T619 WeakPolarHBondContact O-CA 3.45Å; T619-K621 PolarHBondContact O-N 2.56Å
620	V	90.1	Very high	88	Confident	7 Å²	7	84.1 Å²	84.1	4%	0.042	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	116.6	173.1	-177	0	0	0	0	108.6	I597 R599 I604 I606 A622	I597-V620 HydrophobicContact CB-CG2 4.42Å; I597-V620 HydrophobicContact CG2-CG2 4.41Å; R599-V620 HydrophobicContact CB-CG1 4.31Å; R599-V620 HydrophobicContact CG-CG1 3.73Å; I604-V620 HydrophobicContact CB-CB 4.16Å; I604-V620 PolarHBondContact N-O 2.86Å; I604-V620 PolarHBondContact O-N 2.97Å; I606-V620 HydrophobicContact CD1-CG2 3.77Å; V620-A622 PolarHBondContact O-N 2.92Å
621	K	88.9	Confident	87.6	Confident	155 Å²	155	82.7 Å²	82.7	67%	0.674	42%	0.421	S	S	*	.	P	Polyproline II helix	trans	-66.9	125.1	-177.8	-67.8	-179.4	-178.8	175.2	0	110.8	R599 T619	R599-K621 WeakPolarHBondContact CD-O 3.2Å; R599-K621 WeakPolarHBondContact CG-O 3.46Å; T619-K621 PolarHBondContact O-N 2.56Å
622	A	87	Confident	86.9	Confident	7 Å²	7	90.1 Å²	90.1	6%	0.058	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-64.1	147.8	178.4	0	0	0	0	0	113.1	Q600 F602 E603 V620 R624	Q600-A622 CarbonylContact O-C 3.55Å; Q600-A622 VanDerWaalsContact O-CA 3.26Å; Q600-A622 WeakPolarHBondContact O-CA 3.4Å; F602-A622 WeakPolarHBondContact O-CB 3.45Å; E603-A622 HydrophobicContact CB-CB 4.39Å; E603-A622 HydrophobicContact CG-CB 3.44Å; E603-A622 VanDerWaalsContact CG-CB 3.44Å; V620-A622 PolarHBondContact O-N 2.92Å; A622-R624 PolarHBondContact O-N 3.37Å
623	F	85.3	Confident	86.5	Confident	112 Å²	112	86 Å²	86	49%	0.491	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-55.6	133.8	167.6	-76.8	-62.1	0	0	0	111.7	R599 Q600 M601 K650	R599-F623 HydrophobicContact CB-CD2 4.08Å; R599-F623 HydrophobicContact CB-CE1 4.38Å; R599-F623 HydrophobicContact CB-CE2 3.78Å; R599-F623 HydrophobicContact CB-CZ 3.93Å; R599-F623 WeakPolarHBondContact O-CE2 3.23Å; Q600-F623 PolarHBondContact O-N 3.04Å; M601-F623 HydrophobicContact SD-CB 3.97Å; F623-K650 WeakPolarHBondContact O-CE 3.42Å; F623-K650 PolarHBondContact O-NZ 2.89Å
624	R	79.9	Confident	85.8	Confident	181 Å²	181	82.3 Å²	82.3	68%	0.683	42%	0.416	S	S	*	.			trans	-122.4	96.1	-179.6	-68.1	-180	-175.6	-159.5	-3.3	109.5	E603 A622 N626	E603-R624 IonicContact OE1-CZ 3.96Å; E603-R624 IonicContact OE1-NH2 2.94Å; E603-R624 PolarHBondContact OE1-NH2 3.32Å; A622-R624 PolarHBondContact O-N 3.37Å; R624-N626 PolarHBondContact O-N 3.09Å
625	K	83.1	Confident	85.2	Confident	165 Å²	165	83 Å²	83	72%	0.717	42%	0.417	S	S	*	.			trans	-60.9	127	165.4	-177.4	170.8	-174.3	168.4	0	108.5	V627 Q646	K625-V627 PolarHBondContact O-N 3.15Å; K625-Q646 PolarHBondContact O-NE2 2.73Å
626	N	83.5	Confident	84.7	Confident	111 Å²	111	87 Å²	87	59%	0.594	44%	0.438	S	S	*	.			trans	-70.3	93.5	174.1	-175.9	-5	0	0	0	109.7	R624 L628 A629	R624-N626 PolarHBondContact O-N 3.09Å; N626-L628 PolarHBondContact O-N 2.86Å; N626-L628 WeakPolarHBondContact OD1-CA 3.29Å; N626-L628 PolarHBondContact OD1-N 3.08Å; N626-A629 HydrophobicContact CB-CB 4.29Å; N626-A629 PolarHBondContact O-N 3.41Å; N626-A629 PolarHBondContact OD1-N 2.8Å
627	V	83.8	Confident	84.2	Confident	40 Å²	40	91.6 Å²	91.6	24%	0.242	47%	0.465	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-14.7	178.1	-67	0	0	0	0	113.1	K625 L642 L643 Q646	K625-V627 PolarHBondContact O-N 3.15Å; V627-L642 HydrophobicContact CB-CB 4.34Å; V627-L642 HydrophobicContact CG2-CB 4.17Å; V627-L643 HydrophobicContact CG2-CD2 4.08Å; V627-Q646 HydrophobicContact CG1-CB 4.47Å; V627-Q646 HydrophobicContact CG1-CG 4.49Å
628	L	83.8	Confident	83.6	Confident	58 Å²	58	92.9 Å²	92.9	30%	0.304	47%	0.47	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-7.4	-179.1	-53.1	-174.1	0	0	0	113	N626 K630 C631 K639 L642 L643	N626-L628 PolarHBondContact O-N 2.86Å; N626-L628 WeakPolarHBondContact OD1-CA 3.29Å; N626-L628 PolarHBondContact OD1-N 3.08Å; L628-K630 PolarHBondContact O-N 2.94Å; L628-C631 VanDerWaalsContact O-CB 3.32Å; L628-C631 WeakPolarHBondContact O-CB 3.21Å; L628-C631 PolarHBondContact O-N 3.45Å; L628-K639 HydrophobicContact CD2-CB 3.91Å; L628-K639 HydrophobicContact CD2-CG 4.07Å; L628-L642 HydrophobicContact CD2-CB 4.49Å; L628-L643 HydrophobicContact CD1-CD1 4.45Å; L628-L643 HydrophobicContact CD2-CG 4.34Å
629	A	83.6	Confident	83.2	Confident	55 Å²	55	93.7 Å²	93.7	46%	0.455	47%	0.473	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-18.1	-175.8	0	0	0	0	0	115.3	N626 Y632	N626-A629 HydrophobicContact CB-CB 4.29Å; N626-A629 PolarHBondContact O-N 3.41Å; N626-A629 PolarHBondContact OD1-N 2.8Å; A629-Y632 PolarHBondContact O-OH 2.97Å
630	K	81.6	Confident	82.8	Confident	173 Å²	173	97.3 Å²	97.3	75%	0.752	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.9	18.4	173.5	-61.7	-164.7	175	-164.6	0	113.5	L628 Y632	L628-K630 PolarHBondContact O-N 2.94Å; K630-Y632 HydrophobicContact CB-CE2 4.49Å
631	C	81.5	Confident	82.7	Confident	23 Å²	23	104.8 Å²	104.8	16%	0.155	52%	0.52	C	S	.	.			trans	-109.6	69.6	-177.1	-63.6	0	0	0	0	111.6	L628 G633 K639 L642	L628-C631 VanDerWaalsContact O-CB 3.32Å; L628-C631 WeakPolarHBondContact O-CB 3.21Å; L628-C631 PolarHBondContact O-N 3.45Å; C631-G633 PolarHBondContact O-N 3.48Å; C631-G633 VanDerWaalsContact O-N 3.12Å; C631-K639 HydrophobicContact CB-CG 4.37Å; C631-L642 VanDerWaalsContact SG-CD1 3.53Å
632	Y	72.4	Confident	82.6	Confident	208 Å²	208	100.1 Å²	100.1	82%	0.816	50%	0.502	S	S	*	.			trans	-71.1	2.4	-175.3	-54.4	-80.5	0	0	0	115.8	A629 K630	A629-Y632 PolarHBondContact O-OH 2.97Å; K630-Y632 HydrophobicContact CB-CE2 4.49Å
633	G	75.6	Confident	82.6	Confident	45 Å²	45	103.4 Å²	103.4	46%	0.464	52%	0.518	S	S	.	.	S	Bend	trans	-113.6	170.9	-174.6	0	0	0	0	0	114.5	C631 D635 K639	C631-G633 PolarHBondContact O-N 3.48Å; C631-G633 VanDerWaalsContact O-N 3.12Å; G633-D635 PolarHBondContact O-N 2.68Å; G633-K639 WeakPolarHBondContact O-CE 3.42Å; G633-K639 PolarHBondContact O-NZ 2.94Å
634	G	77.9	Confident	82.7	Confident	67 Å²	67	104.5 Å²	104.5	69%	0.691	52%	0.523	S	S	*	.			trans	-67.1	-28.2	178.7	0	0	0	0	0	115	I636	G634-I636 PolarHBondContact O-N 2.83Å
635	D	81.9	Confident	83	Confident	77 Å²	77	105.3 Å²	105.3	41%	0.412	53%	0.526	S	S	.	.			trans	-46.6	106	-172.6	175.3	13.3	0	0	0	114.2	G633 T637 R638 K639	G633-D635 PolarHBondContact O-N 2.68Å; D635-T637 WeakPolarHBondContact OD1-CA 3.24Å; D635-T637 WeakPolarHBondContact OD1-CB 3.48Å; D635-T637 PolarHBondContact OD1-N 3.3Å; D635-T637 PolarHBondContact OD1-OG1 3.19Å; D635-R638 PolarHBondContact OD1-N 3.37Å; D635-R638 VanDerWaalsContact OD1-N 3.15Å; D635-R638 WeakPolarHBondContact OD2-CB 3.47Å; D635-K639 WeakPolarHBondContact O-CD 3.49Å; D635-K639 WeakPolarHBondContact O-CG 3.31Å
636	I	82.2	Confident	83.1	Confident	119 Å²	119	99.9 Å²	99.9	61%	0.61	50%	0.503	S	S	*	.	H	α-helix	trans	-72.1	-32.7	178.3	-59.2	175.4	0	0	0	110.6	G634 K639 M640	G634-I636 PolarHBondContact O-N 2.83Å; I636-K639 PolarHBondContact O-N 2.81Å; I636-M640 HydrophobicContact CG2-CG 4.08Å; I636-M640 WeakPolarHBondContact O-CB 3.42Å; I636-M640 WeakPolarHBondContact O-CG 3.47Å; I636-M640 PolarHBondContact O-N 3.3Å
637	T	84.3	Confident	83.1	Confident	106 Å²	106	97.5 Å²	97.5	65%	0.65	50%	0.499	S	S	*	.	H	α-helix	trans	-67.4	-42.7	-174.1	76.5	0	0	0	0	111.6	D635 M640 K641	D635-T637 WeakPolarHBondContact OD1-CA 3.24Å; D635-T637 WeakPolarHBondContact OD1-CB 3.48Å; D635-T637 PolarHBondContact OD1-N 3.3Å; D635-T637 PolarHBondContact OD1-OG1 3.19Å; T637-M640 PolarHBondContact O-N 3.11Å; T637-K641 WeakPolarHBondContact O-CB 3.42Å; T637-K641 PolarHBondContact O-N 3.39Å
638	R	83.2	Confident	83.2	Confident	152 Å²	152	100.6 Å²	100.6	57%	0.574	51%	0.511	S	S	*	.	H	α-helix	trans	-65.3	-39.3	174.1	179	174.3	-179	168.9	0.4	112.3	D635 K641 L642	D635-R638 PolarHBondContact OD1-N 3.37Å; D635-R638 VanDerWaalsContact OD1-N 3.15Å; D635-R638 WeakPolarHBondContact OD2-CB 3.47Å; R638-K641 PolarHBondContact O-N 3.25Å; R638-L642 HydrophobicContact CG-CD1 4.39Å; R638-L642 WeakPolarHBondContact O-CG 3.3Å; R638-L642 PolarHBondContact O-N 3.06Å; R638-L642 VanDerWaalsContact O-N 3.13Å
639	K	84.6	Confident	83.2	Confident	62 Å²	62	99.4 Å²	99.4	27%	0.27	51%	0.512	S	S	.	.	H	α-helix	trans	-62.5	-49.1	174.8	-64.7	171	-172.1	168.9	0	110.6	L628 C631 G633 D635 I636 K641 L642 L643	L628-K639 HydrophobicContact CD2-CB 3.91Å; L628-K639 HydrophobicContact CD2-CG 4.07Å; C631-K639 HydrophobicContact CB-CG 4.37Å; G633-K639 WeakPolarHBondContact O-CE 3.42Å; G633-K639 PolarHBondContact O-NZ 2.94Å; D635-K639 WeakPolarHBondContact O-CD 3.49Å; D635-K639 WeakPolarHBondContact O-CG 3.31Å; I636-K639 PolarHBondContact O-N 2.81Å; K639-K641 PolarHBondContact O-N 3.5Å; K639-L642 PolarHBondContact O-N 3.23Å; K639-L643 WeakPolarHBondContact O-CG 3.46Å; K639-L643 PolarHBondContact O-N 3.36Å
640	M	85.6	Confident	83.1	Confident	120 Å²	120	98.6 Å²	98.6	59%	0.591	50%	0.498	S	S	*	.	H	α-helix	trans	-59.2	-44.8	175.4	-75	-65.4	-160.7	0	0	112.7	I636 T637 L642 L643 K644	I636-M640 HydrophobicContact CG2-CG 4.08Å; I636-M640 WeakPolarHBondContact O-CB 3.42Å; I636-M640 WeakPolarHBondContact O-CG 3.47Å; I636-M640 PolarHBondContact O-N 3.3Å; T637-M640 PolarHBondContact O-N 3.11Å; M640-L642 VanDerWaalsContact C-N 3.32Å; M640-L642 PolarHBondContact O-N 3.38Å; M640-L643 PolarHBondContact O-N 3.25Å; M640-K644 WeakPolarHBondContact O-CB 3.43Å; M640-K644 PolarHBondContact O-N 2.78Å
641	K	86.8	Confident	83	Confident	165 Å²	165	97.3 Å²	97.3	72%	0.717	49%	0.492	S	S	*	.	H	α-helix	trans	-61.2	-38.3	179.4	-170.1	170.6	-176.5	172.3	0	112.3	T637 R638 K639 R645	T637-K641 WeakPolarHBondContact O-CB 3.42Å; T637-K641 PolarHBondContact O-N 3.39Å; R638-K641 PolarHBondContact O-N 3.25Å; K639-K641 PolarHBondContact O-N 3.5Å; K641-R645 WeakPolarHBondContact O-CB 3.36Å; K641-R645 PolarHBondContact O-N 3.2Å; K641-R645 VanDerWaalsContact O-N 3.15Å
642	L	87.1	Confident	82.9	Confident	57 Å²	57	103.3 Å²	103.3	30%	0.298	52%	0.516	S	S	.	.	H	α-helix	trans	-71.2	-42.8	175.9	-70.4	169.8	0	0	0	112.4	V627 L628 C631 R638 K639 M640 R645 Q646	V627-L642 HydrophobicContact CB-CB 4.34Å; V627-L642 HydrophobicContact CG2-CB 4.17Å; L628-L642 HydrophobicContact CD2-CB 4.49Å; C631-L642 VanDerWaalsContact SG-CD1 3.53Å; R638-L642 HydrophobicContact CG-CD1 4.39Å; R638-L642 WeakPolarHBondContact O-CG 3.3Å; R638-L642 PolarHBondContact O-N 3.06Å; R638-L642 VanDerWaalsContact O-N 3.13Å; K639-L642 PolarHBondContact O-N 3.23Å; M640-L642 VanDerWaalsContact C-N 3.32Å; M640-L642 PolarHBondContact O-N 3.38Å; L642-R645 PolarHBondContact O-N 3.16Å; L642-Q646 WeakPolarHBondContact O-CB 3.26Å; L642-Q646 PolarHBondContact O-N 2.85Å
643	L	86.7	Confident	83.2	Confident	75 Å²	75	96.8 Å²	96.8	39%	0.393	49%	0.494	S	S	.	.	H	α-helix	trans	-63.7	-44	175.8	-69.4	170.8	0	0	0	111.8	V627 L628 K639 M640 Q646 A647	V627-L643 HydrophobicContact CG2-CD2 4.08Å; L628-L643 HydrophobicContact CD1-CD1 4.45Å; L628-L643 HydrophobicContact CD2-CG 4.34Å; K639-L643 WeakPolarHBondContact O-CG 3.46Å; K639-L643 PolarHBondContact O-N 3.36Å; M640-L643 PolarHBondContact O-N 3.25Å; L643-Q646 PolarHBondContact O-N 3.25Å; L643-A647 PolarHBondContact O-N 3.27Å
644	K	88.1	Confident	83.1	Confident	135 Å²	135	100.9 Å²	100.9	59%	0.587	50%	0.495	S	S	*	.	H	α-helix	trans	-60	-48.3	176.6	-174.8	171.7	177.7	176.8	0	111.5	M640 Q646 A647 E648	M640-K644 WeakPolarHBondContact O-CB 3.43Å; M640-K644 PolarHBondContact O-N 2.78Å; K644-Q646 VanDerWaalsContact C-N 3.29Å; K644-Q646 PolarHBondContact O-N 3.32Å; K644-A647 PolarHBondContact O-N 2.86Å; K644-A647 VanDerWaalsContact O-N 3.16Å; K644-E648 WeakPolarHBondContact CE-OE1 3.48Å; K644-E648 HydrophobicContact CG-CG 4.47Å; K644-E648 WeakPolarHBondContact CG-OE1 3.38Å; K644-E648 WeakPolarHBondContact O-CB 3.12Å; K644-E648 WeakPolarHBondContact O-CG 3.08Å; K644-E648 PolarHBondContact O-N 2.89Å
645	R	86.8	Confident	82.6	Confident	199 Å²	199	107.1 Å²	107.1	75%	0.751	50%	0.498	S	S	*	.	H	α-helix	trans	-60.7	-36	175.7	-169.4	177.5	-176.8	-177.3	2	112.4	K641 L642 G649	K641-R645 WeakPolarHBondContact O-CB 3.36Å; K641-R645 PolarHBondContact O-N 3.2Å; K641-R645 VanDerWaalsContact O-N 3.15Å; L642-R645 PolarHBondContact O-N 3.16Å; R645-G649 PolarHBondContact O-N 2.9Å
646	Q	83.9	Confident	81.7	Confident	50 Å²	50	108.9 Å²	108.9	23%	0.234	51%	0.511	C	S	.	.	H	α-helix	trans	-68.3	-42.9	174.7	-171.9	175.7	46.7	0	0	112	K625 V627 L642 L643 K644 G649 K650	K625-Q646 PolarHBondContact O-NE2 2.73Å; V627-Q646 HydrophobicContact CG1-CB 4.47Å; V627-Q646 HydrophobicContact CG1-CG 4.49Å; L642-Q646 WeakPolarHBondContact O-CB 3.26Å; L642-Q646 PolarHBondContact O-N 2.85Å; L643-Q646 PolarHBondContact O-N 3.25Å; K644-Q646 VanDerWaalsContact C-N 3.29Å; K644-Q646 PolarHBondContact O-N 3.32Å; Q646-G649 PolarHBondContact O-N 3.35Å; Q646-K650 WeakPolarHBondContact O-CG 3.49Å; Q646-K650 PolarHBondContact O-N 3.28Å
647	A	84.6	Confident	80.6	Confident	61 Å²	61	104.4 Å²	104.4	50%	0.504	50%	0.495	S	S	.	.	H	α-helix	trans	-65.6	-43.6	177.7	0	0	0	0	0	112.2	L643 K644 K650 K651	L643-A647 PolarHBondContact O-N 3.27Å; K644-A647 PolarHBondContact O-N 2.86Å; K644-A647 VanDerWaalsContact O-N 3.16Å; A647-K650 PolarHBondContact O-N 3.4Å; A647-K651 WeakPolarHBondContact O-CB 2.96Å; A647-K651 PolarHBondContact O-N 3.41Å
648	E	85	Confident	79.6	Confident	106 Å²	106	104 Å²	104	50%	0.495	49%	0.489	S	S	.	.	H	α-helix	trans	-62.4	-44.8	175	-73	167.2	175.8	0	0	111.6	K644 K650 K651 K652	K644-E648 WeakPolarHBondContact CE-OE1 3.48Å; K644-E648 HydrophobicContact CG-CG 4.47Å; K644-E648 WeakPolarHBondContact CG-OE1 3.38Å; K644-E648 WeakPolarHBondContact O-CB 3.12Å; K644-E648 WeakPolarHBondContact O-CG 3.08Å; K644-E648 PolarHBondContact O-N 2.89Å; E648-K650 VanDerWaalsContact C-N 3.32Å; E648-K650 PolarHBondContact O-N 3.42Å; E648-K651 CarbonylContact O-C 3.54Å; E648-K651 PolarHBondContact O-N 2.89Å; E648-K651 VanDerWaalsContact O-N 3.16Å; E648-K652 PolarHBondContact O-N 3.27Å
649	G	83.7	Confident	78.8	Confident	32 Å²	32	98 Å²	98	33%	0.33	47%	0.469	S	S	.	.	H	α-helix	trans	-56.1	-45.5	173	0	0	0	0	0	112.1	R645 Q646 K652 M653	R645-G649 PolarHBondContact O-N 2.9Å; Q646-G649 PolarHBondContact O-N 3.35Å; G649-K652 PolarHBondContact O-N 3.01Å; G649-M653 WeakPolarHBondContact O-CG 3.4Å; G649-M653 PolarHBondContact O-N 3.2Å
650	K	81.1	Confident	77.7	Confident	38 Å²	38	101.3 Å²	101.3	17%	0.165	49%	0.489	C	S	.	.	H	α-helix	trans	-65.8	-37.6	174.8	-72.4	-170.1	174.1	-146.4	0	113.5	M601 F623 Q646 A647 E648 K652 M653 R654	M601-K650 WeakPolarHBondContact O-CE 3.46Å; M601-K650 PolarHBondContact O-NZ 3.46Å; F623-K650 WeakPolarHBondContact O-CE 3.42Å; F623-K650 PolarHBondContact O-NZ 2.89Å; Q646-K650 WeakPolarHBondContact O-CG 3.49Å; Q646-K650 PolarHBondContact O-N 3.28Å; A647-K650 PolarHBondContact O-N 3.4Å; E648-K650 VanDerWaalsContact C-N 3.32Å; E648-K650 PolarHBondContact O-N 3.42Å; K650-K652 VanDerWaalsContact C-N 3.29Å; K650-K652 PolarHBondContact O-N 3.48Å; K650-M653 HydrophobicContact CB-CE 4.42Å; K650-M653 HydrophobicContact CG-CE 3.83Å; K650-M653 PolarHBondContact O-N 2.88Å; K650-R654 WeakPolarHBondContact O-CB 3.38Å; K650-R654 PolarHBondContact O-N 3.37Å
651	K	80.9	Confident	76.7	Confident	146 Å²	146	97.1 Å²	97.1	64%	0.635	47%	0.47	S	S	*	.	H	α-helix	trans	-70.5	-22.2	175.4	-167.7	175.6	-178.6	179.3	0	112.8	A647 E648 R655	A647-K651 WeakPolarHBondContact O-CB 2.96Å; A647-K651 PolarHBondContact O-N 3.41Å; E648-K651 CarbonylContact O-C 3.54Å; E648-K651 PolarHBondContact O-N 2.89Å; E648-K651 VanDerWaalsContact O-N 3.16Å; K651-R655 PolarHBondContact O-NE 2.85Å
652	K	79.6	Confident	75.8	Confident	150 Å²	150	91.6 Å²	91.6	65%	0.652	45%	0.451	S	S	*	.	H	α-helix	trans	-77.4	-51.1	166.5	-170.2	173.3	-179.4	178.3	0	110.7	E648 G649 K650 R654 R655 V656	E648-K652 PolarHBondContact O-N 3.27Å; G649-K652 PolarHBondContact O-N 3.01Å; K650-K652 VanDerWaalsContact C-N 3.29Å; K650-K652 PolarHBondContact O-N 3.48Å; K652-R654 PolarHBondContact O-N 3.04Å; K652-R655 PolarHBondContact O-N 3.33Å; K652-V656 PolarHBondContact O-N 2.89Å
653	M	78.3	Confident	74.8	Confident	71 Å²	71	92.9 Å²	92.9	35%	0.35	46%	0.455	S	S	.	.	H	α-helix	trans	-57.3	-43.4	178.8	-70.5	-176.1	-64.7	0	0	112.7	M601 F602 G649 K650 R655 V656 G657	M601-M653 HydrophobicContact CB-CE 3.84Å; M601-M653 HydrophobicContact CB-SD 3.82Å; F602-M653 HydrophobicContact CB-CB 4.33Å; F602-M653 HydrophobicContact CD1-CB 3.98Å; G649-M653 WeakPolarHBondContact O-CG 3.4Å; G649-M653 PolarHBondContact O-N 3.2Å; K650-M653 HydrophobicContact CB-CE 4.42Å; K650-M653 HydrophobicContact CG-CE 3.83Å; K650-M653 PolarHBondContact O-N 2.88Å; M653-R655 PolarHBondContact O-N 3.16Å; M653-V656 PolarHBondContact O-N 3.15Å; M653-G657 WeakPolarHBondContact O-CA 3.45Å; M653-G657 PolarHBondContact O-N 3.38Å
654	R	72.2	Confident	73.9	Confident	130 Å²	130	95 Å²	95	49%	0.491	47%	0.466	S	S	.	.	H	α-helix	trans	-64.9	-21	177.3	-174.1	171.1	169	-152.2	-10.7	114.4	F602 K650 K652	F602-R654 HydrophobicContact CB-CB 4.03Å; F602-R654 HydrophobicContact CD2-CB 4.33Å; F602-R654 HydrophobicContact CD2-CG 4.4Å; F602-R654 HydrophobicContact CG-CB 4.33Å; K650-R654 WeakPolarHBondContact O-CB 3.38Å; K650-R654 PolarHBondContact O-N 3.37Å; K652-R654 PolarHBondContact O-N 3.04Å
655	R	68.2	Low	72.9	Confident	199 Å²	199	88.8 Å²	88.8	75%	0.751	44%	0.44	S	S	*	.	H	α-helix	trans	-91	-22	178.4	-80.6	-170.3	-71.9	169.1	-0.9	114	K651 K652 M653	K651-R655 PolarHBondContact O-NE 2.85Å; K652-R655 PolarHBondContact O-N 3.33Å; M653-R655 PolarHBondContact O-N 3.16Å
656	V	62.9	Low	72	Confident	113 Å²	113	79.8 Å²	79.8	69%	0.685	41%	0.407	S	S	*	.	H	α-helix	trans	-108.6	-29	-177.2	-177.1	0	0	0	0	111.7	K652 M653 N658	K652-V656 PolarHBondContact O-N 2.89Å; M653-V656 PolarHBondContact O-N 3.15Å; V656-N658 PolarHBondContact O-N 3.28Å
657	G	59.6	Low	71.2	Confident	26 Å²	26	78.4 Å²	78.4	27%	0.268	40%	0.401	S	S	.	.			trans	-72.4	107	178.6	0	0	0	0	0	111.7	M653	M653-G657 WeakPolarHBondContact O-CA 3.45Å; M653-G657 PolarHBondContact O-N 3.38Å
658	N	63.3	Low	70.3	Confident	98 Å²	98	78.4 Å²	78.4	52%	0.524	40%	0.397	S	S	.	.			trans	-54.9	138.4	150.4	-71.6	-3.2	0	0	0	108	R568 V656 D660	R568-N658 VanDerWaalsContact CZ-OD1 3.26Å; R568-N658 VanDerWaalsContact NH1-CG 3.34Å; R568-N658 PolarHBondContact NH1-OD1 3.5Å; R568-N658 PolarHBondContact NH2-OD1 2.88Å; V656-N658 PolarHBondContact O-N 3.28Å; N658-D660 VanDerWaalsContact C-N 3.29Å; N658-D660 PolarHBondContact O-N 3.02Å; N658-D660 VanDerWaalsContact O-N 3.11Å
659	V	65.2	Low	69.6	Low	26 Å²	26	73.6 Å²	73.6	16%	0.158	38%	0.375	C	S	.	.			trans	-80.1	91.4	164.4	179.8	0	0	0	0	105.7	N566 F602 I604 V661	N566-V659 HydrophobicContact CB-CG2 4.37Å; N566-V659 VanDerWaalsContact ND2-CG2 3.31Å; N566-V659 WeakPolarHBondContact ND2-CG2 3.36Å; F602-V659 HydrophobicContact CE2-CG2 3.86Å; F602-V659 HydrophobicContact CZ-CG2 4.17Å; I604-V659 HydrophobicContact CD1-CG1 3.95Å; I604-V659 HydrophobicContact CD1-CG2 4.39Å; I604-V659 HydrophobicContact CG1-CG1 4.43Å; I604-V659 HydrophobicContact CG1-CG2 4.01Å; I604-V659 HydrophobicContact CG2-CG1 4.18Å; I604-V659 HydrophobicContact CG2-CG2 4.01Å; V659-V661 HydrophobicContact CG1-CG2 4.07Å; V659-V661 PolarHBondContact O-N 3.04Å
660	D	61.6	Low	68.6	Low	131 Å²	131	72.7 Å²	72.7	70%	0.701	36%	0.363	S	S	*	.			trans	-66.1	117.7	165.6	-160.4	-2	0	0	0	107.4	N658	N658-D660 VanDerWaalsContact C-N 3.29Å; N658-D660 PolarHBondContact O-N 3.02Å; N658-D660 VanDerWaalsContact O-N 3.11Å
661	V	65.9	Low	67.4	Low	31 Å²	31	76.5 Å²	76.5	19%	0.188	38%	0.379	C	S	.	.			trans	-97.3	115	-179.6	-179.2	0	0	0	0	106.3	L565 V659 K663 A665 F666	L565-V661 HydrophobicContact CD1-CG2 3.46Å; L565-V661 VanDerWaalsContact CD1-CG2 3.46Å; V659-V661 HydrophobicContact CG1-CG2 4.07Å; V659-V661 PolarHBondContact O-N 3.04Å; V661-K663 PolarHBondContact O-N 2.87Å; V661-A665 HydrophobicContact CG1-CB 4.15Å; V661-F666 HydrophobicContact CG1-CD2 4.09Å
662	P	67.5	Low	66	Low	49 Å²	49	75.8 Å²	75.8	32%	0.318	37%	0.372	S	S	.	.			trans	-53.9	137.5	177.6	-24.5	32.8	0	0	0	110.4	P598 D664 A665 F666	P598-P662 HydrophobicContact CG-CG 3.96Å; P662-D664 PolarHBondContact O-N 2.94Å; P662-D664 VanDerWaalsContact O-N 3.08Å; P662-A665 HydrophobicContact CB-CB 4.16Å; P662-A665 HydrophobicContact CG-CB 4.32Å; P662-A665 WeakPolarHBondContact O-CA 3.5Å; P662-A665 WeakPolarHBondContact O-CB 3.36Å; P662-A665 PolarHBondContact O-N 3.01Å; P662-F666 PolarHBondContact O-N 3.34Å; P662-F666 VanDerWaalsContact O-N 3.15Å
663	K	66.1	Low	63.8	Low	85 Å²	85	78 Å²	78	37%	0.37	38%	0.382	S	S	.	.	H	α-helix	trans	-49	-40.2	176.2	-73.9	-171.1	172.4	-172.2	0	110.8	M371 V661 A665 F666 I667	M371-K663 PolarHBondContact O-NZ 3.33Å; M371-K663 VanDerWaalsContact O-NZ 3.17Å; V661-K663 PolarHBondContact O-N 2.87Å; K663-A665 PolarHBondContact O-N 3.22Å; K663-F666 WeakPolarHBondContact O-CA 3.35Å; K663-F666 VanDerWaalsContact O-CB 3.23Å; K663-F666 WeakPolarHBondContact O-CB 2.99Å; K663-F666 PolarHBondContact O-N 3.47Å; K663-F666 VanDerWaalsContact O-N 3.09Å; K663-I667 HydrophobicContact CB-CD1 4.29Å; K663-I667 WeakPolarHBondContact O-CB 3.44Å; K663-I667 WeakPolarHBondContact O-CD1 3.5Å; K663-I667 WeakPolarHBondContact O-CG1 3.37Å; K663-I667 PolarHBondContact O-N 3.13Å
664	D	67.1	Low	61.5	Low	118 Å²	118	83.7 Å²	83.7	63%	0.631	41%	0.408	S	S	*	.	H	α-helix	trans	-63.8	-35.6	177.6	-43.6	-52.9	0	0	0	113.8	P662 F666 S668	P662-D664 PolarHBondContact O-N 2.94Å; P662-D664 VanDerWaalsContact O-N 3.08Å; D664-F666 VanDerWaalsContact C-N 3.27Å; D664-F666 PolarHBondContact O-N 3.41Å; D664-S668 VanDerWaalsContact O-CB 3.3Å; D664-S668 WeakPolarHBondContact O-CB 3.34Å; D664-S668 PolarHBondContact O-N 2.68Å; D664-S668 PolarHBondContact O-OG 2.87Å
665	A	67	Low	59.4	Low	6 Å²	6	90.4 Å²	90.4	5%	0.05	44%	0.441	C	S	.	.	H	α-helix	trans	-72.8	-22.3	175.7	0	0	0	0	0	112.3	S596 V661 P662 K663 S668 V669	S596-A665 WeakPolarHBondContact O-CB 3.42Å; S596-A665 PolarHBondContact OG-O 3.46Å; S596-A665 VanDerWaalsContact OG-O 3.04Å; V661-A665 HydrophobicContact CG1-CB 4.15Å; P662-A665 HydrophobicContact CB-CB 4.16Å; P662-A665 HydrophobicContact CG-CB 4.32Å; P662-A665 WeakPolarHBondContact O-CA 3.5Å; P662-A665 WeakPolarHBondContact O-CB 3.36Å; P662-A665 PolarHBondContact O-N 3.01Å; K663-A665 PolarHBondContact O-N 3.22Å; A665-S668 WeakPolarHBondContact CA-OG 3.38Å; A665-S668 PolarHBondContact O-OG 3.48Å; A665-V669 WeakPolarHBondContact O-CG2 3.48Å
666	F	67.6	Low	58.9	Low	9 Å²	9	85 Å²	85	4%	0.039	43%	0.425	C	S	.	.	H	α-helix	trans	-80.1	-51.5	171.1	-145.9	-109.9	0	0	0	111.1	A402 L403 V570 E572 L573 V661 P662 K663 D664 S668 V669 L670	A402-F666 HydrophobicContact CB-CE1 4.19Å; A402-F666 HydrophobicContact CB-CZ 4.1Å; L403-F666 HydrophobicContact CD2-CD1 4.15Å; L403-F666 HydrophobicContact CG-CE1 4.46Å; V570-F666 HydrophobicContact CG1-CE2 3.62Å; V570-F666 HydrophobicContact CG1-CZ 3.81Å; E572-F666 HydrophobicContact CB-CE1 3.83Å; E572-F666 HydrophobicContact CB-CZ 3.81Å; E572-F666 HydrophobicContact CG-CE1 4.28Å; E572-F666 HydrophobicContact CG-CZ 4.3Å; L573-F666 HydrophobicContact CD1-CE2 4.04Å; L573-F666 HydrophobicContact CD2-CE2 4.5Å; L573-F666 HydrophobicContact CD2-CZ 4.47Å; L573-F666 HydrophobicContact CG-CE2 4.07Å; L573-F666 HydrophobicContact CG-CZ 4.12Å; V661-F666 HydrophobicContact CG1-CD2 4.09Å; P662-F666 PolarHBondContact O-N 3.34Å; P662-F666 VanDerWaalsContact O-N 3.15Å; K663-F666 WeakPolarHBondContact O-CA 3.35Å; K663-F666 VanDerWaalsContact O-CB 3.23Å; K663-F666 WeakPolarHBondContact O-CB 2.99Å; K663-F666 PolarHBondContact O-N 3.47Å; K663-F666 VanDerWaalsContact O-N 3.09Å; D664-F666 VanDerWaalsContact C-N 3.27Å; D664-F666 PolarHBondContact O-N 3.41Å; F666-S668 VanDerWaalsContact C-N 3.28Å; F666-S668 PolarHBondContact O-N 2.81Å; F666-V669 PolarHBondContact O-N 3.29Å; F666-L670 HydrophobicContact CD1-CD1 3.64Å; F666-L670 HydrophobicContact CD1-CG 4.42Å; F666-L670 HydrophobicContact CE1-CD1 3.91Å; F666-L670 PolarHBondContact O-N 2.74Å
667	I	67.1	Low	58.7	Low	21 Å²	21	83.5 Å²	83.5	11%	0.108	41%	0.411	C	S	.	.	H	α-helix	trans	-58.3	-39.5	178.7	-67.4	162	0	0	0	110.5	M371 I433 K663 V669 L670 K671	M371-I667 HydrophobicContact CE-CD1 4.23Å; M371-I667 HydrophobicContact SD-CD1 4.28Å; I433-I667 HydrophobicContact CD1-CD1 3.76Å; I433-I667 HydrophobicContact CD1-CG1 4.02Å; I433-I667 HydrophobicContact CG1-CD1 4.06Å; I433-I667 HydrophobicContact CG1-CG1 4.16Å; I433-I667 HydrophobicContact CG2-CG1 4.11Å; K663-I667 HydrophobicContact CB-CD1 4.29Å; K663-I667 WeakPolarHBondContact O-CB 3.44Å; K663-I667 WeakPolarHBondContact O-CD1 3.5Å; K663-I667 WeakPolarHBondContact O-CG1 3.37Å; K663-I667 PolarHBondContact O-N 3.13Å; I667-V669 VanDerWaalsContact C-N 3.26Å; I667-V669 PolarHBondContact O-N 3.15Å; I667-L670 PolarHBondContact O-N 3.12Å; I667-K671 HydrophobicContact CG2-CD 3.79Å; I667-K671 HydrophobicContact CG2-CG 4.02Å; I667-K671 WeakPolarHBondContact O-CA 3.34Å; I667-K671 WeakPolarHBondContact O-CB 3.32Å; I667-K671 PolarHBondContact O-N 3.01Å
668	S	66.6	Low	58.7	Low	62 Å²	62	86.7 Å²	86.7	43%	0.434	42%	0.419	S	S	.	.	H	α-helix	trans	-74.9	-6	176	54.8	0	0	0	0	115.5	R592 D664 A665 F666 K671	R592-S668 PolarHBondContact NH2-O 2.91Å; D664-S668 VanDerWaalsContact O-CB 3.3Å; D664-S668 WeakPolarHBondContact O-CB 3.34Å; D664-S668 PolarHBondContact O-N 2.68Å; D664-S668 PolarHBondContact O-OG 2.87Å; A665-S668 WeakPolarHBondContact CA-OG 3.38Å; A665-S668 PolarHBondContact O-OG 3.48Å; F666-S668 VanDerWaalsContact C-N 3.28Å; F666-S668 PolarHBondContact O-N 2.81Å; S668-K671 CarbonylContact C-O 3.58Å
669	V	69.9	Low	58.4	Low	5 Å²	5	86.1 Å²	86.1	3%	0.03	41%	0.413	C	S	.	.	H	α-helix	trans	-97.9	-37.5	170	173.2	0	0	0	0	110.8	L573 R592 L593 S596 A665 F666 I667	L573-V669 HydrophobicContact CD2-CG1 4.07Å; R592-V669 PolarHBondContact NH1-O 3.02Å; R592-V669 PolarHBondContact NH2-O 3.47Å; L593-V669 HydrophobicContact CD2-CB 4.49Å; L593-V669 HydrophobicContact CD2-CG1 4.2Å; L593-V669 HydrophobicContact CD2-CG2 3.92Å; L593-V669 HydrophobicContact CG-CG1 4.31Å; L593-V669 HydrophobicContact CG-CG2 4.29Å; S596-V669 VanDerWaalsContact OG-CG2 3.25Å; S596-V669 WeakPolarHBondContact OG-CG2 3.12Å; A665-V669 WeakPolarHBondContact O-CG2 3.48Å; F666-V669 PolarHBondContact O-N 3.29Å; I667-V669 VanDerWaalsContact C-N 3.26Å; I667-V669 PolarHBondContact O-N 3.15Å
670	L	63.9	Low	58	Low	13 Å²	13	89.8 Å²	89.8	7%	0.068	43%	0.429	C	S	.	.	H	α-helix	trans	-72.2	-57.9	174	-64.5	172.1	0	0	0	111.6	I433 T435 L573 F666 I667 R672	I433-L670 HydrophobicContact CG2-CD1 4.42Å; T435-L670 HydrophobicContact CG2-CD1 4.05Å; L573-L670 HydrophobicContact CD2-CD2 4.14Å; F666-L670 HydrophobicContact CD1-CD1 3.64Å; F666-L670 HydrophobicContact CD1-CG 4.42Å; F666-L670 HydrophobicContact CE1-CD1 3.91Å; F666-L670 PolarHBondContact O-N 2.74Å; I667-L670 PolarHBondContact O-N 3.12Å; L670-R672 PolarHBondContact O-N 2.87Å
671	K	54.6	Low	57.8	Low	118 Å²	118	87.1 Å²	87.1	51%	0.513	41%	0.411	S	S	.	.	S	Bend	trans	-65	108.5	165.6	-59.9	-169.5	177.9	-169.7	0	107.8	I667 S668	I667-K671 HydrophobicContact CG2-CD 3.79Å; I667-K671 HydrophobicContact CG2-CG 4.02Å; I667-K671 WeakPolarHBondContact O-CA 3.34Å; I667-K671 WeakPolarHBondContact O-CB 3.32Å; I667-K671 PolarHBondContact O-N 3.01Å; S668-K671 CarbonylContact C-O 3.58Å
672	R	51	Low	57.2	Low	131 Å²	131	91.1 Å²	91.1	49%	0.494	43%	0.427	S	S	.	.			trans	-66.7	152.8	165.4	-88.9	-179.8	164.7	-179	-2.7	109.4	D531 L670 E674	D531-R672 IonicContact OD1-CZ 2.72Å; D531-R672 IonicContact OD1-NH1 3.15Å; D531-R672 PolarHBondContact OD1-NH1 3.03Å; D531-R672 IonicContact OD2-CZ 3.83Å; D531-R672 IonicContact OD2-NH1 3.41Å; D531-R672 PolarHBondContact OD2-NH1 2.86Å; D531-R672 IonicContact OD2-NH2 2.65Å; L670-R672 PolarHBondContact O-N 2.87Å; R672-E674 PolarHBondContact O-N 3.48Å
673	K	34.3	Very low	56.4	Low	195 Å²	195	94.3 Å²	94.3	85%	0.848	44%	0.435	S	S	*	.			trans	-74.1	115.7	160.3	-73.5	-173.9	176.1	-177.9	0	107.7
674	E	30.4	Very low	55.6	Low	191 Å²	191	95.1 Å²	95.1	89%	0.893	44%	0.441	S	S	*	.			trans	-50.1	145.2	140.9	-68.4	163.9	-157.7	0	0	108.4	R672	R672-E674 PolarHBondContact O-N 3.48Å
675	K	27.3	Very low	54.5	Low	272 Å²	272	93 Å²	93	100%	1.183	42%	0.424	S	S	*	.			trans	-137.3	0	-159.2	-156.4	-154.2	178.7	-164.6	0	113.5

Retrieved 675 of 675 residues in 1001.9 ms (Link to these results)

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