A0A077Z6J6_TRITR Loading...

Eukaryotic translation initiation factor 5B

Plays a role in translation initiation. Ribosome-dependent GTPase that promotes the joining of the 60S ribosomal subunit to the pre-initiation complex to form the 80S initiation complex with the initiator methionine-tRNA in the P-site base paired to the start codon. Together with eIF1A (EIF1AX), actively orients the initiator methionine-tRNA in a conformation that allows 60S ribosomal subunit joining to form the 80S initiation complex. Is released after formation of the 80S initiation complex. Its GTPase activity is not essential for ribosomal subunits joining, but GTP hydrolysis is needed for eIF1A (EIF1AX) ejection quickly followed by EIF5B release to form elongation-competent ribosomes. In contrast to its procaryotic homolog, does not promote recruitment of Met-rRNA to the small ribosomal subunit.

AlphaFold DB , UniProt , Accession A0A077Z6J6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 680 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	L	31.9	Very low	31	Very low	229 Å²	229	159.4 Å²	159.4	100%	1.199	89%	0.889	S	S	*	*				0	106.9	0	-82.6	156.4	0	0	0	106.9
2	L	33.3	Very low	30.9	Very low	182 Å²	182	155.8 Å²	155.8	95%	0.953	87%	0.874	S	S	*	*			trans	64	79	-174.6	-62.5	167.3	0	0	0	116.6
3	A	29.8	Very low	30.8	Very low	98 Å²	98	153.2 Å²	153.2	81%	0.81	86%	0.864	S	S	*	*			trans	-86.2	127.7	156.2	0	0	0	0	0	108.6
4	K	33.6	Very low	30.8	Very low	210 Å²	210	150.4 Å²	150.4	91%	0.913	85%	0.845	S	S	*	*			trans	-95.9	113.3	162.9	-89	-178.6	172.4	-179.3	0	106.6
5	E	32.6	Very low	30.5	Very low	192 Å²	192	146.5 Å²	146.5	90%	0.897	83%	0.832	S	S	*	*			trans	-77.4	133.8	168.7	-77.2	174.9	152	0	0	109.8
6	E	28.4	Very low	30.9	Very low	196 Å²	196	148.3 Å²	148.3	92%	0.916	82%	0.821	S	S	*	*			trans	-71.1	131.3	165.9	-65.8	170.7	150.2	0	0	109.1
7	S	29.9	Very low	31	Very low	117 Å²	117	149.2 Å²	149.2	82%	0.818	83%	0.825	S	S	*	*			trans	-117.1	107	163.4	65.7	0	0	0	0	109.1	G9	S7-G9 PolarHBondContact O-N 3.04Å
8	S	30.2	Very low	31	Very low	113 Å²	113	150.8 Å²	150.8	79%	0.79	83%	0.825	S	S	*	*			trans	-52.4	123	166.3	48.3	0	0	0	0	111.6
9	G	28.7	Very low	31	Very low	76 Å²	76	149.7 Å²	149.7	78%	0.784	82%	0.817	S	S	*	*			trans	-86.5	115.1	163.8	0	0	0	0	0	109.5	S7	S7-G9 PolarHBondContact O-N 3.04Å
10	E	30.6	Very low	30.9	Very low	179 Å²	179	152.2 Å²	152.2	84%	0.836	82%	0.822	S	S	*	*			trans	-77	122.7	168	-73.1	179.4	150.8	0	0	109.6	V12	E10-V12 PolarHBondContact O-N 3.26Å
11	D	31.5	Very low	30.9	Very low	161 Å²	161	150.4 Å²	150.4	86%	0.861	82%	0.816	S	S	*	*			trans	-67.9	107	168.2	-73.8	-44	0	0	0	110	V13	D11-V13 PolarHBondContact O-N 3Å
12	V	30.7	Very low	30.5	Very low	117 Å²	117	144.6 Å²	144.6	71%	0.709	80%	0.795	S	S	*	*			trans	-88.8	104.2	169.2	-178.7	0	0	0	0	108.9	E10 D14	E10-V12 PolarHBondContact O-N 3.26Å; V12-D14 PolarHBondContact O-N 2.82Å
13	V	28.9	Very low	30.2	Very low	122 Å²	122	147.3 Å²	147.3	74%	0.739	79%	0.792	S	S	*	*			trans	-72	106.4	169.3	-179.5	0	0	0	0	108.9	D11	D11-V13 PolarHBondContact O-N 3Å
14	D	31.8	Very low	29.9	Very low	113 Å²	113	154.2 Å²	154.2	60%	0.604	80%	0.798	S	S	*	*			trans	-96.2	97.1	172.6	-102.9	-9.6	0	0	0	110.5	V12	V12-D14 PolarHBondContact O-N 2.82Å
15	S	25.7	Very low	29.8	Very low	92 Å²	92	150 Å²	150	64%	0.643	79%	0.794	S	S	*	*			trans	-111.4	112.5	164.4	161.4	0	0	0	0	107.6
16	W	37.1	Very low	29.5	Very low	176 Å²	176	147.3 Å²	147.3	67%	0.667	79%	0.791	S	S	*	*			trans	-134.1	18.7	179.1	-82.2	93.4	0	0	0	115	Q18 I19	W16-Q18 PolarHBondContact O-N 3.45Å; W16-I19 HydrophobicContact CE3-CD1 4.39Å; W16-I19 HydrophobicContact CZ3-CD1 3.91Å
17	D	32.3	Very low	29.6	Very low	164 Å²	164	142.7 Å²	142.7	88%	0.877	78%	0.78	S	S	*	*			trans	-93.3	46.9	175.3	-72.3	-21.7	0	0	0	113.1
18	Q	31.5	Very low	29.7	Very low	178 Å²	178	146 Å²	146	83%	0.832	78%	0.78	S	S	*	*			trans	-148.2	60.6	172.2	-68.2	-169.6	7.4	0	0	113.4	W16	W16-Q18 PolarHBondContact O-N 3.45Å
19	I	29.9	Very low	29.8	Very low	130 Å²	130	147.2 Å²	147.2	67%	0.667	78%	0.777	S	S	*	*			trans	-141.7	73.9	159.3	-51.7	178.7	0	0	0	109.1	W16 V21	W16-I19 HydrophobicContact CE3-CD1 4.39Å; W16-I19 HydrophobicContact CZ3-CD1 3.91Å; I19-V21 HydrophobicContact CG2-CG2 4.14Å
20	E	28.7	Very low	29.9	Very low	199 Å²	199	152.5 Å²	152.5	93%	0.93	78%	0.782	S	S	*	*			trans	-90.6	110.5	156.7	-93.3	-168.3	160.1	0	0	108.9	S22	E20-S22 PolarHBondContact O-N 3.14Å
21	V	30.9	Very low	30.1	Very low	114 Å²	114	149.7 Å²	149.7	69%	0.691	78%	0.779	S	S	*	*			trans	-71.9	117.5	176	174.9	0	0	0	0	109.1	I19 R23	I19-V21 HydrophobicContact CG2-CG2 4.14Å; V21-R23 PolarHBondContact O-N 3.31Å
22	S	23.5	Very low	30.1	Very low	108 Å²	108	146.1 Å²	146.1	76%	0.755	77%	0.772	S	S	*	*			trans	-43.6	113.9	165.3	53.4	0	0	0	0	112.8	E20	E20-S22 PolarHBondContact O-N 3.14Å
23	R	28.9	Very low	30.2	Very low	239 Å²	239	150.3 Å²	150.3	90%	0.902	78%	0.78	S	S	*	*			trans	-120.7	103.8	157	-83.2	-174.2	176.5	175.3	-0.1	109.3	V21	V21-R23 PolarHBondContact O-N 3.31Å
24	R	23	Very low	30.3	Very low	243 Å²	243	150.2 Å²	150.2	92%	0.917	78%	0.78	S	S	*	*			trans	-65.8	127.3	162.1	-76.5	174.8	170.9	167.3	-3.2	108.6
25	S	30.9	Very low	30.4	Very low	120 Å²	120	151 Å²	151	84%	0.839	79%	0.785	S	S	*	*			trans	-126.1	118	156.1	51	0	0	0	0	108.6
26	V	25.5	Very low	30.9	Very low	137 Å²	137	153.4 Å²	153.4	83%	0.83	79%	0.79	S	S	*	*			trans	-87.3	129.7	178.2	169.5	0	0	0	0	108.7
27	S	31.6	Very low	30.6	Very low	99 Å²	99	151 Å²	151	69%	0.692	79%	0.794	S	S	*	*			trans	-178.5	118.9	136.6	52.8	0	0	0	0	112.7
28	K	32.6	Very low	30.7	Very low	187 Å²	187	149 Å²	149	81%	0.813	79%	0.791	S	S	*	*			trans	50.8	143.4	134.4	-58.3	-174.7	176.9	-177.3	0	119.3
29	D	32.3	Very low	30.4	Very low	137 Å²	137	146.2 Å²	146.2	73%	0.733	79%	0.786	S	S	*	*			cis	-171.9	140	-9.8	-97.5	-38.8	0	0	0	103.1
30	E	31.1	Very low	30.6	Very low	188 Å²	188	148 Å²	148	88%	0.879	80%	0.795	S	S	*	*			trans	150.6	141.3	135.7	-82.8	-165.3	161.6	0	0	113.5
31	P	33.4	Very low	30.7	Very low	120 Å²	120	147.4 Å²	147.4	78%	0.779	79%	0.792	S	S	*	*			trans	-124.6	178.7	-148.7	33.6	-12.8	0	0	0	115.7
32	A	31	Very low	30.3	Very low	86 Å²	86	151.4 Å²	151.4	71%	0.711	80%	0.8	S	S	*	*			trans	91.2	110.3	155.2	0	0	0	0	0	118.4
33	K	34.1	Very low	30.6	Very low	204 Å²	204	151.6 Å²	151.6	89%	0.887	80%	0.802	S	S	*	*				-168.5	144.5	88.2	-92.7	172.3	-175.9	178	0	112.2
34	T	30.7	Very low	30.6	Very low	121 Å²	121	149.2 Å²	149.2	74%	0.742	80%	0.801	S	S	*	*			trans	-87.5	155.2	-167.8	46.2	0	0	0	0	113.2
35	N	34.7	Very low	30.9	Very low	129 Å²	129	142.8 Å²	142.8	69%	0.69	79%	0.793	S	S	*	*				169	118.9	113.3	-84	2.5	0	0	0	112.8
36	D	34.3	Very low	30.6	Very low	143 Å²	143	143.1 Å²	143.1	77%	0.765	79%	0.794	S	S	*	*				87.8	122	130	-52.6	-27.1	0	0	0	123.9
37	V	31.6	Very low	30.6	Very low	124 Å²	124	144.2 Å²	144.2	75%	0.752	80%	0.795	S	S	*	*			trans	-97.5	168.8	-178.9	-176.7	0	0	0	0	105.6
38	P	33.8	Very low	30.6	Very low	124 Å²	124	145.3 Å²	145.3	81%	0.805	80%	0.803	S	S	*	*			cis	-158.1	168.3	45.7	41.7	-15.9	0	0	0	123.1
39	T	25.4	Very low	30.3	Very low	118 Å²	118	145.1 Å²	145.1	72%	0.724	81%	0.805	S	S	*	*			trans	-57.6	150.2	171.2	-40.2	0	0	0	0	116.3
40	I	34	Very low	30.1	Very low	168 Å²	168	147.3 Å²	147.3	86%	0.862	81%	0.811	S	S	*	*			trans	-124	150.8	157.1	-65	-179	0	0	0	110.1
41	Q	31.3	Very low	29.9	Very low	186 Å²	186	144.1 Å²	144.1	87%	0.869	81%	0.809	S	S	*	*			trans	-92	166.9	-145.3	-68.4	159.6	-17.1	0	0	117.2
42	K	23.4	Very low	29.5	Very low	199 Å²	199	146.3 Å²	146.3	87%	0.865	81%	0.813	S	S	*	*			trans	-75.8	156.5	172.6	-69.4	174.2	170.6	177.4	0	114.4
43	S	29.7	Very low	29.3	Very low	112 Å²	112	151.3 Å²	151.3	78%	0.783	82%	0.818	S	S	*	*			trans	-157.7	113.7	139.1	40.7	0	0	0	0	107.2
44	Q	28.7	Very low	28.9	Very low	188 Å²	188	146.1 Å²	146.1	88%	0.879	81%	0.808	S	S	*	*				47	125.9	83.5	-74.1	-175.6	-16.3	0	0	112.3
45	S	28.2	Very low	28.6	Very low	108 Å²	108	144.9 Å²	144.9	76%	0.755	81%	0.81	S	S	*	*			cis	-174.7	152.5	27	47.2	0	0	0	0	110.3
46	C	25.9	Very low	28.3	Very low	128 Å²	128	145.3 Å²	145.3	87%	0.865	81%	0.812	S	S	*	*				171.4	126.8	125.9	-103.2	0	0	0	0	112.3
47	D	26	Very low	28.1	Very low	160 Å²	160	146.1 Å²	146.1	86%	0.856	81%	0.811	S	S	*	*			trans	-74.3	148.9	-178.5	-59.8	-57.2	0	0	0	114.1
48	S	31.1	Very low	27.8	Very low	122 Å²	122	144.4 Å²	144.4	85%	0.853	81%	0.805	S	S	*	*			trans	-166.5	130.1	130.9	31	0	0	0	0	110.4
49	E	25	Very low	27.6	Very low	183 Å²	183	142.9 Å²	142.9	86%	0.855	79%	0.793	S	S	*	*			trans	-65.3	142.4	-178.8	-59.3	168.8	144.7	0	0	112.2
50	Q	28.1	Very low	27.7	Very low	182 Å²	182	144.8 Å²	144.8	85%	0.85	80%	0.798	S	S	*	*				166.9	140.8	121.2	-89.4	171.4	11.9	0	0	112.4
51	S	26.9	Very low	27.4	Very low	121 Å²	121	142.4 Å²	142.4	85%	0.846	79%	0.791	S	S	*	*			trans	87.9	102.3	160.1	74.9	0	0	0	0	119.3
52	I	24.9	Very low	27.2	Very low	166 Å²	166	140.7 Å²	140.7	85%	0.851	79%	0.787	S	S	*	*			trans	-59.2	125.3	154.1	-64.7	154.6	0	0	0	108.8
53	K	26.8	Very low	27.3	Very low	191 Å²	191	138.7 Å²	138.7	83%	0.83	78%	0.779	S	S	*	*			trans	-174.9	133.2	148.7	-100.5	158.5	-169.8	-170.7	0	111.7
54	S	26.6	Very low	27.2	Very low	96 Å²	96	140 Å²	140	67%	0.671	78%	0.781	S	S	*	*			trans	57.3	85.2	158.7	57.8	0	0	0	0	118.8	D56	S54-D56 PolarHBondContact O-N 2.82Å
55	A	25	Very low	27	Very low	94 Å²	94	138.7 Å²	138.7	78%	0.777	77%	0.773	S	S	*	*	S	Bend	trans	-90.4	75.5	155.6	0	0	0	0	0	109.3
56	D	28.5	Very low	27	Very low	138 Å²	138	138.9 Å²	138.9	74%	0.738	77%	0.769	S	S	*	*			trans	-147.1	-2.7	169.2	-93	-33.5	0	0	0	114.6	S54	S54-D56 PolarHBondContact O-N 2.82Å
57	E	28.9	Very low	27.2	Very low	161 Å²	161	137.4 Å²	137.4	75%	0.752	75%	0.749	S	S	*	*	S	Bend	trans	-99.4	-5.4	-177.4	-75.4	-171.5	143.2	0	0	115.4
58	S	25.7	Very low	27.2	Very low	87 Å²	87	134.5 Å²	134.5	61%	0.608	74%	0.741	S	S	*	*	S	Bend	trans	-92	-2.8	-173.7	54.9	0	0	0	0	115.2
59	V	28.6	Very low	27	Very low	93 Å²	93	137.9 Å²	137.9	56%	0.564	74%	0.735	S	S	*	*	S	Bend	trans	-92.6	-20.4	178.4	-176	0	0	0	0	112.5
60	L	29	Very low	27.1	Very low	157 Å²	157	132 Å²	132	82%	0.822	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	-17.3	-178.8	-96.2	118.7	0	0	0	114.4
61	T	28.1	Very low	27.1	Very low	118 Å²	118	128.6 Å²	128.6	72%	0.724	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	-3.2	-170.8	10.3	0	0	0	0	114.8
62	L	26.3	Very low	27.1	Very low	151 Å²	151	125.6 Å²	125.6	79%	0.791	68%	0.677	S	S	*	*	S	Bend	trans	-125.2	7.4	-168.2	-92.8	154.4	0	0	0	116.7
63	K	25	Very low	27	Very low	157 Å²	157	122.9 Å²	122.9	68%	0.683	67%	0.67	S	S	*	*	S	Bend	trans	-125.9	11.4	-167.3	-81.1	179.9	177.7	172	0	119.1
64	V	28.9	Very low	27	Very low	138 Å²	138	119.4 Å²	119.4	84%	0.836	66%	0.659	S	S	*	*			trans	-125.9	44.8	177.4	-163.1	0	0	0	0	112.5	V66	V64-V66 VanDerWaalsContact C-N 3.34Å
65	F	24.3	Very low	26.9	Very low	162 Å²	162	119.4 Å²	119.4	71%	0.711	66%	0.658	S	S	*	*			trans	-90.4	10.7	177.4	-138.5	-93.5	0	0	0	113.8
66	V	28.2	Very low	26.9	Very low	111 Å²	111	123.9 Å²	123.9	67%	0.673	66%	0.663	S	S	*	*	S	Bend	trans	-97.8	-17.8	-164.3	-175.7	0	0	0	0	114.1	V64	V64-V66 VanDerWaalsContact C-N 3.34Å
67	F	29.1	Very low	26.7	Very low	98 Å²	98	123.1 Å²	123.1	43%	0.43	66%	0.659	S	S	.	*	S	Bend	trans	-112.9	-10.4	-174.4	-109.5	-87.6	0	0	0	117	R69 I70 S433	F67-R69 PolarHBondContact O-N 3.4Å; F67-I70 HydrophobicContact CD1-CD1 3.56Å; F67-I70 HydrophobicContact CD1-CG1 3.91Å; F67-I70 HydrophobicContact CE1-CD1 3.18Å; F67-I70 HydrophobicContact CE1-CG1 4.04Å; F67-I70 HydrophobicContact CE2-CD1 4.35Å; F67-I70 HydrophobicContact CG-CD1 4.3Å; F67-I70 HydrophobicContact CZ-CD1 3.63Å; F67-I70 PolarHBondContact O-N 2.82Å; F67-S433 WeakPolarHBondContact CE2-OG 3.44Å; F67-S433 WeakPolarHBondContact CZ-OG 3.05Å
68	S	27.1	Very low	26.5	Very low	98 Å²	98	120.6 Å²	120.6	69%	0.685	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	2.9	172.7	72.2	0	0	0	0	113.3
69	R	25.2	Very low	26.6	Very low	193 Å²	193	124.2 Å²	124.2	73%	0.728	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.1	5.7	179.9	-80.8	-171.5	175.2	-179.8	-0.3	114.7	F67 T71	F67-R69 PolarHBondContact O-N 3.4Å; R69-T71 PolarHBondContact O-N 3.38Å; R69-T71 VanDerWaalsContact O-O 3.14Å
70	I	29.1	Very low	26.4	Very low	61 Å²	61	128 Å²	128	31%	0.313	68%	0.676	S	S	.	*			trans	-83.9	50.8	163.1	-39.7	-169.8	0	0	0	109.7	F67 V72	F67-I70 HydrophobicContact CD1-CD1 3.56Å; F67-I70 HydrophobicContact CD1-CG1 3.91Å; F67-I70 HydrophobicContact CE1-CD1 3.18Å; F67-I70 HydrophobicContact CE1-CG1 4.04Å; F67-I70 HydrophobicContact CE2-CD1 4.35Å; F67-I70 HydrophobicContact CG-CD1 4.3Å; F67-I70 HydrophobicContact CZ-CD1 3.63Å; F67-I70 PolarHBondContact O-N 2.82Å; I70-V72 VanDerWaalsContact C-N 3.29Å; I70-V72 HydrophobicContact CG2-CG2 4.42Å; I70-V72 PolarHBondContact O-N 3.15Å
71	T	26.5	Very low	26.2	Very low	110 Å²	110	125.5 Å²	125.5	68%	0.675	67%	0.671	S	S	*	*				-65.3	106.4	126	29.8	0	0	0	0	104.4	R69 P73	R69-T71 PolarHBondContact O-N 3.38Å; R69-T71 VanDerWaalsContact O-O 3.14Å; T71-P73 VanDerWaalsContact O-N 3.13Å
72	V	27.2	Very low	26.1	Very low	58 Å²	58	126.4 Å²	126.4	35%	0.352	68%	0.677	S	S	.	*			trans	-42.4	127.3	152.6	-176.4	0	0	0	0	104.5	I70 I74	I70-V72 VanDerWaalsContact C-N 3.29Å; I70-V72 HydrophobicContact CG2-CG2 4.42Å; I70-V72 PolarHBondContact O-N 3.15Å; V72-I74 PolarHBondContact O-N 2.88Å
73	P	23.4	Very low	26.2	Very low	109 Å²	109	124.4 Å²	124.4	71%	0.708	68%	0.676	S	S	*	*			trans	-60.3	98.9	174.3	26.2	-29.9	0	0	0	104.5	T71 C75	T71-P73 VanDerWaalsContact O-N 3.13Å; P73-C75 PolarHBondContact O-N 3.16Å
74	I	27.2	Very low	26.6	Very low	118 Å²	118	121 Å²	121	61%	0.605	67%	0.668	S	S	*	*			trans	-60.8	102.6	164.9	-62.2	171.4	0	0	0	101.2	V72 Q76	V72-I74 PolarHBondContact O-N 2.88Å; I74-Q76 VanDerWaalsContact C-N 3.34Å; I74-Q76 PolarHBondContact O-N 3.29Å
75	C	24.4	Very low	26.6	Very low	95 Å²	95	122.6 Å²	122.6	64%	0.642	67%	0.672	S	S	*	*			trans	-51.9	108.9	172.7	-92	0	0	0	0	106	P73 N77	P73-C75 PolarHBondContact O-N 3.16Å; C75-N77 HydrophobicContact CB-CB 4.37Å; C75-N77 PolarHBondContact O-N 2.92Å
76	Q	24.6	Very low	27.7	Very low	189 Å²	189	119.1 Å²	119.1	88%	0.883	66%	0.66	S	S	*	*			trans	-71.2	58.1	166.5	-68.8	-178.2	-16.3	0	0	107.7	I74	I74-Q76 VanDerWaalsContact C-N 3.34Å; I74-Q76 PolarHBondContact O-N 3.29Å
77	N	24.6	Very low	28.6	Very low	121 Å²	121	118.4 Å²	118.4	65%	0.647	66%	0.66	S	S	*	*			trans	-102.8	96.5	176.9	-77.4	-4.5	0	0	0	108.2	C75	C75-N77 HydrophobicContact CB-CB 4.37Å; C75-N77 PolarHBondContact O-N 2.92Å
78	S	24.3	Very low	29.6	Very low	109 Å²	109	118.5 Å²	118.5	76%	0.762	66%	0.658	S	S	*	*			trans	36.1	91.2	147.4	58.7	0	0	0	0	117.2
79	F	27.2	Very low	31.1	Very low	162 Å²	162	120.5 Å²	120.5	71%	0.711	66%	0.656	S	S	*	*			trans	-111.6	90.1	153.7	-107.2	-89.5	0	0	0	109.2	S81 K411	F79-S81 PolarHBondContact O-N 2.83Å; F79-K411 HydrophobicContact CZ-CD 4.21Å; F79-K411 VanDerWaalsContact CZ-NZ 3.34Å
80	Q	24.9	Very low	32.7	Very low	173 Å²	173	119.4 Å²	119.4	81%	0.808	66%	0.66	S	S	*	*			trans	-65.4	111.9	158	-84.4	177.2	-20.6	0	0	108.1
81	S	25.5	Very low	34.4	Very low	104 Å²	104	118.7 Å²	118.7	73%	0.727	67%	0.668	S	S	*	*			trans	23.7	103.2	143.6	54.8	0	0	0	0	117.1	F79	F79-S81 PolarHBondContact O-N 2.83Å
82	T	26.1	Very low	36.8	Very low	137 Å²	137	114.5 Å²	114.5	84%	0.84	64%	0.643	S	S	*	*			trans	-162.9	119.2	142.4	5.3	0	0	0	0	112.9
83	S	27.3	Very low	39.2	Very low	110 Å²	110	115 Å²	115	77%	0.769	64%	0.643	S	S	*	*			trans	57.5	89.1	161.9	59.7	0	0	0	0	120
84	V	32.5	Very low	42.1	Very low	86 Å²	86	110.5 Å²	110.5	52%	0.521	61%	0.612	S	S	.	*			trans	-143.3	102.8	136	-172.9	0	0	0	0	110.2	L86 R343	V84-L86 HydrophobicContact CG1-CB 4.05Å; V84-L86 HydrophobicContact CG1-CD1 4.28Å; V84-L86 HydrophobicContact CG1-CG 4.47Å; V84-L86 PolarHBondContact O-N 2.88Å; V84-L86 VanDerWaalsContact O-N 3.12Å; V84-R343 VanDerWaalsContact CG2-NH2 3.28Å
85	D	30.5	Very low	44.8	Very low	171 Å²	171	105.4 Å²	105.4	91%	0.914	59%	0.587	S	S	*	*			trans	-69.7	93.3	158.3	-69.6	-44.3	0	0	0	109.3
86	L	47.7	Very low	47.7	Very low	89 Å²	89	100.9 Å²	100.9	47%	0.466	56%	0.556	S	S	.	*	S	Bend	trans	-158	94.4	161.1	-91.2	166.2	0	0	0	106.7	V84 Y88 V384	V84-L86 HydrophobicContact CG1-CB 4.05Å; V84-L86 HydrophobicContact CG1-CD1 4.28Å; V84-L86 HydrophobicContact CG1-CG 4.47Å; V84-L86 PolarHBondContact O-N 2.88Å; V84-L86 VanDerWaalsContact O-N 3.12Å; L86-Y88 VanDerWaalsContact C-N 3.35Å; L86-Y88 PolarHBondContact O-N 2.73Å; L86-V384 HydrophobicContact CD1-CG1 4.49Å
87	S	45.6	Very low	50.5	Low	96 Å²	96	91.9 Å²	91.9	67%	0.671	51%	0.514	S	S	*	.			trans	-2.7	72.8	-178.3	66	0	0	0	0	116.5	E89	S87-E89 PolarHBondContact O-N 2.87Å
88	Y	51.6	Low	53.4	Low	100 Å²	100	86.1 Å²	86.1	39%	0.392	48%	0.483	S	S	.	.			trans	-80.7	100.3	160.6	174.8	-107	0	0	0	106.5	L86 E90 F312	L86-Y88 VanDerWaalsContact C-N 3.35Å; L86-Y88 PolarHBondContact O-N 2.73Å; Y88-E90 HydrophobicContact CD1-CG 4.11Å; Y88-E90 HydrophobicContact CE1-CB 4.4Å; Y88-E90 HydrophobicContact CE1-CG 3.32Å; Y88-F312 HydrophobicContact CD2-CD1 4.06Å; Y88-F312 HydrophobicContact CD2-CE1 4.2Å; Y88-F312 HydrophobicContact CE2-CD1 4.07Å
89	E	56.9	Low	56.3	Low	139 Å²	139	80.9 Å²	80.9	65%	0.65	45%	0.447	S	S	*	.			trans	-88.9	113.8	166.5	-68.2	-179.9	-180	0	0	107.3	S87 G91 S92	S87-E89 PolarHBondContact O-N 2.87Å; E89-G91 PolarHBondContact O-N 3.1Å; E89-S92 VanDerWaalsContact O-CB 3.28Å; E89-S92 WeakPolarHBondContact O-CB 3.42Å; E89-S92 PolarHBondContact O-N 2.97Å; E89-S92 PolarHBondContact O-OG 3.41Å
90	E	58.9	Low	59.1	Low	170 Å²	170	73.3 Å²	73.3	79%	0.794	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.5	128.9	170.5	-76.8	-177.2	168	0	0	109.4	Y88	Y88-E90 HydrophobicContact CD1-CG 4.11Å; Y88-E90 HydrophobicContact CE1-CB 4.4Å; Y88-E90 HydrophobicContact CE1-CG 3.32Å
91	G	66.1	Low	62.1	Low	47 Å²	47	65.2 Å²	65.2	49%	0.485	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.7	3.1	-174.3	0	0	0	0	0	115.6	E89 L93	E89-G91 PolarHBondContact O-N 3.1Å; G91-L93 PolarHBondContact O-N 2.96Å
92	S	75.6	Confident	65	Low	22 Å²	22	60.3 Å²	60.3	15%	0.154	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-66.8	130.8	172.7	58.4	0	0	0	0	111.8	E89 F312 R386	E89-S92 VanDerWaalsContact O-CB 3.28Å; E89-S92 WeakPolarHBondContact O-CB 3.42Å; E89-S92 PolarHBondContact O-N 2.97Å; E89-S92 PolarHBondContact O-OG 3.41Å; S92-F312 WeakPolarHBondContact O-CB 3.23Å; S92-F312 PolarHBondContact O-N 3.24Å; S92-R386 PolarHBondContact OG-NH2 3.36Å
93	L	79.5	Confident	67.8	Low	67 Å²	67	55.5 Å²	55.5	35%	0.351	31%	0.31	S	S	.	.	B	Isolated β-bridge	trans	-86.5	135.8	178.3	-60.5	177.1	0	0	0	110.5	G91 F161 S307 L310	G91-L93 PolarHBondContact O-N 2.96Å; L93-F161 HydrophobicContact CD1-CD1 4.32Å; L93-F161 HydrophobicContact CD1-CE1 4.45Å; L93-S307 WeakPolarHBondContact CD2-O 3.45Å; L93-L310 CarbonylContact C-O 3.58Å; L93-L310 WeakPolarHBondContact CA-O 3.44Å; L93-L310 HydrophobicContact CD2-CB 4.45Å
94	R	83.8	Confident	70.4	Confident	15 Å²	15	53.3 Å²	53.3	6%	0.057	29%	0.292	C	S	.	.	P	Polyproline II helix	trans	-84.5	164	169.8	70.3	167.6	176.7	87.1	-0.6	111.2	D181 L310 F312 V338 N339 A388	R94-D181 IonicContact CZ-OD1 2.6Å; R94-D181 IonicContact CZ-OD2 3.98Å; R94-D181 IonicContact NH1-OD1 2.66Å; R94-D181 IonicContact NH1-OD2 3.45Å; R94-D181 PolarHBondContact NH1-OD2 3.48Å; R94-D181 VanDerWaalsContact NH2-CG 3.3Å; R94-D181 IonicContact NH2-OD1 2.66Å; R94-D181 PolarHBondContact NH2-OD1 3.45Å; R94-D181 IonicContact NH2-OD2 3.68Å; R94-D181 PolarHBondContact NH2-OD2 3.32Å; R94-D181 VanDerWaalsContact NH2-OD2 3.12Å; R94-L310 WeakPolarHBondContact CG-O 3.33Å; R94-L310 PolarHBondContact N-O 3.29Å; R94-F312 HydrophobicContact CB-CB 4.36Å; R94-F312 HydrophobicContact CB-CD2 4.22Å; R94-V338 WeakPolarHBondContact CD-O 3.42Å; R94-N339 WeakPolarHBondContact CD-OD1 3.39Å; R94-A388 HydrophobicContact CB-CB 3.96Å; R94-A388 HydrophobicContact CG-CB 4.33Å
95	S	83.1	Confident	72.9	Confident	11 Å²	11	54.7 Å²	54.7	8%	0.077	30%	0.296	C	S	.	.	P	Polyproline II helix	trans	-62.8	138.6	171	-38.9	0	0	0	0	110.5	P162 A388	S95-P162 WeakPolarHBondContact CA-O 3.35Å; S95-P162 WeakPolarHBondContact CB-O 3.34Å; S95-P162 PolarHBondContact OG-O 3.04Å; S95-A388 WeakPolarHBondContact O-CB 3.42Å
96	P	86	Confident	75.7	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-69.3	144	168.8	30.2	-35.6	0	0	0	110.2	I98 F161 V163 Y164 D181 L310	P96-I98 HydrophobicContact CB-CG1 4.32Å; P96-I98 HydrophobicContact CG-CD1 4.43Å; P96-F161 VanDerWaalsContact CD-CE2 3.45Å; P96-F161 HydrophobicContact CG-CD2 3.99Å; P96-F161 HydrophobicContact CG-CE2 3.65Å; P96-V163 HydrophobicContact CG-CG1 4.38Å; P96-V163 HydrophobicContact CG-CG2 4.03Å; P96-Y164 PolarHBondContact O-N 3.33Å; P96-Y164 VanDerWaalsContact O-N 3.13Å; P96-D181 HydrophobicContact CB-CB 4.48Å; P96-L310 HydrophobicContact CB-CD1 4.1Å; P96-L310 HydrophobicContact CB-CD2 3.78Å
97	V	83.1	Confident	77.6	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	117	171.6	169.7	0	0	0	0	107.6	F166 L179 C180 D181 L182 I336	V97-F166 HydrophobicContact CB-CE2 4.33Å; V97-F166 HydrophobicContact CG1-CD2 3.68Å; V97-F166 HydrophobicContact CG1-CE2 3.52Å; V97-F166 HydrophobicContact CG2-CE2 4.28Å; V97-L179 WeakPolarHBondContact CG1-O 3.5Å; V97-C180 HydrophobicContact CG1-CB 4.2Å; V97-C180 CarbonylContact O-C 3.59Å; V97-C180 WeakPolarHBondContact O-CA 3.41Å; V97-C180 WeakPolarHBondContact O-CB 3.05Å; V97-D181 PolarHBondContact N-OD2 2.93Å; V97-D181 PolarHBondContact O-N 3.29Å; V97-L182 PolarHBondContact O-N 3.09Å; V97-I336 HydrophobicContact CG1-CD1 3.67Å; V97-I336 HydrophobicContact CG2-CD1 4.1Å
98	I	85.4	Confident	79.6	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	127.4	-174.4	-53	-173.9	0	0	0	110.4	P96 V163 Y164 I165 F166 L182 V184 I298	P96-I98 HydrophobicContact CB-CG1 4.32Å; P96-I98 HydrophobicContact CG-CD1 4.43Å; I98-V163 HydrophobicContact CD1-CG1 3.37Å; I98-V163 HydrophobicContact CG1-CG1 4.07Å; I98-Y164 PolarHBondContact N-O 3.37Å; I98-I165 HydrophobicContact CB-CG2 4.48Å; I98-I165 CarbonylContact O-C 3.4Å; I98-I165 WeakPolarHBondContact O-CA 3.39Å; I98-F166 PolarHBondContact O-N 3.21Å; I98-L182 VanDerWaalsContact CA-O 3.28Å; I98-L182 WeakPolarHBondContact CA-O 3.44Å; I98-L182 HydrophobicContact CD1-CD2 4.32Å; I98-L182 HydrophobicContact CG1-CB 4.39Å; I98-V184 HydrophobicContact CG2-CG2 3.75Å; I98-I298 HydrophobicContact CD1-CG2 3.21Å
99	C	84.6	Confident	81.1	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	147.3	170.4	54.9	0	0	0	0	112	T168 C180 L182 A183 V184	C99-T168 HydrophobicContact CB-CG2 3.72Å; C99-C180 HydrophobicContact CB-CB 4.2Å; C99-C180 WeakPolarHBondContact CB-SG 3.36Å; C99-C180 PolarHBondContact N-SG 2.83Å; C99-C180 VanDerWaalsContact N-SG 3.44Å; C99-L182 PolarHBondContact N-O 3.33Å; C99-L182 VanDerWaalsContact N-O 3.16Å; C99-A183 CarbonylContact O-C 3.57Å; C99-A183 WeakPolarHBondContact O-CA 3.47Å; C99-A183 WeakPolarHBondContact SG-CB 3.26Å; C99-V184 PolarHBondContact O-N 3.38Å
100	V	87.6	Confident	82.6	Confident	3 Å²	3	32 Å²	32	2%	0.018	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	116.3	169.9	-173.7	0	0	0	0	109.5	K108 L112 I165 F166 T168 V184 V186	V100-K108 HydrophobicContact CG1-CB 3.94Å; V100-K108 HydrophobicContact CG1-CG 4.14Å; V100-L112 HydrophobicContact CG2-CD1 4.46Å; V100-L112 HydrophobicContact CG2-CD2 3.99Å; V100-L112 HydrophobicContact CG2-CG 4.41Å; V100-I165 HydrophobicContact CG2-CG2 3.62Å; V100-F166 PolarHBondContact N-O 3.48Å; V100-T168 PolarHBondContact O-OG1 3.22Å; V100-T168 VanDerWaalsContact O-OG1 3.07Å; V100-V184 CarbonylContact C-O 3.43Å; V100-V184 WeakPolarHBondContact CA-O 3.34Å; V100-V184 HydrophobicContact CG2-CB 4.39Å; V100-V186 HydrophobicContact CG1-CG2 3.45Å; V100-V186 VanDerWaalsContact CG1-CG2 3.45Å
101	L	86.9	Confident	84.1	Confident	2 Å²	2	24 Å²	24	1%	0.01	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	165.3	-177.4	-61.7	172.8	0	0	0	111	T168 R173 A183 V184 L185 V186 L204	L101-T168 VanDerWaalsContact CD2-OG1 3.25Å; L101-T168 WeakPolarHBondContact CD2-OG1 3.47Å; L101-R173 HydrophobicContact CD2-CG 4.06Å; L101-A183 HydrophobicContact CD1-CB 4.19Å; L101-V184 PolarHBondContact N-O 3Å; L101-L185 HydrophobicContact CB-CD1 3.98Å; L101-V186 PolarHBondContact O-N 2.82Å; L101-L204 HydrophobicContact CD1-CD1 3.98Å; L101-L204 HydrophobicContact CD1-CD2 3.75Å; L101-L204 HydrophobicContact CD1-CG 3.89Å
102	G	86	Confident	85.2	Confident	1 Å²	1	21.9 Å²	21.9	1%	0.01	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	145.7	170	178.7	0	0	0	0	0	113.7	K108 R173	G102-K108 PolarHBondContact O-NZ 2.97Å; G102-R173 PolarHBondContact O-NH2 3.03Å
103	H	86.3	Confident	85.7	Confident	37 Å²	37	20.9 Å²	20.9	17%	0.171	11%	0.112	C	C	.	.	S	Bend	trans	-67.6	164.9	177	-169.5	77.2	0	0	0	113.3	T106 K108 E194 Q196 T197	H103-T106 HydrophobicContact CB-CG2 3.66Å; H103-T106 PolarHBondContact O-N 3.37Å; H103-T106 PolarHBondContact O-OG1 3.33Å; H103-T106 VanDerWaalsContact O-OG1 3.07Å; H103-K108 PolarHBondContact O-NZ 3.28Å; H103-E194 HydrophobicContact CB-CB 3.89Å; H103-E194 WeakPolarHBondContact CB-OE2 3.26Å; H103-E194 IonicContact CD2-OE1 2.68Å; H103-E194 PolarHBondContact CD2-OE1 2.9Å; H103-E194 IonicContact CD2-OE2 2.68Å; H103-E194 PolarHBondContact CD2-OE2 3.49Å; H103-E194 IonicContact CG-OE2 3.52Å; H103-E194 VanDerWaalsContact CG-OE2 3.22Å; H103-E194 IonicContact NE2-OE1 2.87Å; H103-E194 IonicContact NE2-OE2 3.81Å; H103-Q196 HydrophobicContact CB-CB 4.22Å; H103-Q196 VanDerWaalsContact ND1-CB 3.33Å; H103-Q196 WeakPolarHBondContact ND1-CB 3.36Å; H103-Q196 WeakPolarHBondContact ND1-CG 3.14Å; H103-T197 WeakPolarHBondContact CB-OG1 3.31Å; H103-T197 PolarHBondContact N-OG1 3.49Å
104	V	81.1	Confident	86.2	Confident	64 Å²	64	21.4 Å²	21.4	39%	0.388	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	141.7	173.1	-172.3	0	0	0	0	108.8	T106	V104-T106 PolarHBondContact O-N 2.94Å
105	D	84.3	Confident	86.3	Confident	115 Å²	115	21 Å²	21	62%	0.615	11%	0.111	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.2	8.8	178.7	-59.8	-22.4	0	0	0	118.1	G107 K217	D105-G107 PolarHBondContact O-N 2.62Å; D105-G107 VanDerWaalsContact O-N 3.16Å; D105-K217 WeakPolarHBondContact O-CE 3.46Å; D105-K217 PolarHBondContact O-NZ 3.05Å
106	T	90.1	Very high	86.3	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.108	C	C	.	.	S	Bend	trans	-68.2	-12.7	171.1	63.5	0	0	0	0	112.8	H103 V104 V186 D188 N216	H103-T106 HydrophobicContact CB-CG2 3.66Å; H103-T106 PolarHBondContact O-N 3.37Å; H103-T106 PolarHBondContact O-OG1 3.33Å; H103-T106 VanDerWaalsContact O-OG1 3.07Å; V104-T106 PolarHBondContact O-N 2.94Å; T106-V186 WeakPolarHBondContact O-CG1 3.33Å; T106-V186 PolarHBondContact OG1-O 3.19Å; T106-D188 HydrophobicContact CG2-CB 4.26Å; T106-N216 PolarHBondContact O-ND2 2.99Å
107	G	86.8	Confident	86.2	Confident	16 Å²	16	30.1 Å²	30.1	17%	0.165	14%	0.144	C	C	.	.	S	Bend	trans	100.9	18.9	172.9	0	0	0	0	0	115.6	D105 T109 K110 I111	D105-G107 PolarHBondContact O-N 2.62Å; D105-G107 VanDerWaalsContact O-N 3.16Å; G107-T109 VanDerWaalsContact C-N 3.33Å; G107-T109 PolarHBondContact O-N 2.94Å; G107-K110 PolarHBondContact O-N 2.83Å; G107-K110 VanDerWaalsContact O-N 3.1Å; G107-I111 WeakPolarHBondContact O-CG1 3.45Å; G107-I111 PolarHBondContact O-N 2.77Å
108	K	87.5	Confident	85.8	Confident	40 Å²	40	32.3 Å²	32.3	17%	0.174	16%	0.157	C	C	.	.	H	α-helix	trans	-45.8	-52.1	177.7	-57.6	-178.1	-68.5	-90.6	0	113.4	V100 G102 H103 I111 L112 V186	V100-K108 HydrophobicContact CG1-CB 3.94Å; V100-K108 HydrophobicContact CG1-CG 4.14Å; G102-K108 PolarHBondContact O-NZ 2.97Å; H103-K108 PolarHBondContact O-NZ 3.28Å; K108-I111 PolarHBondContact O-N 2.83Å; K108-L112 PolarHBondContact O-N 3.26Å; K108-V186 HydrophobicContact CG-CB 4.12Å; K108-V186 HydrophobicContact CG-CG2 4.11Å
109	T	84.3	Confident	85.5	Confident	14 Å²	14	36.9 Å²	36.9	9%	0.086	18%	0.181	C	C	.	.	H	α-helix	trans	-69.4	-38.9	-178	-46.8	0	0	0	0	111.2	G107 I111 L112 D113 Q121 T129	G107-T109 VanDerWaalsContact C-N 3.33Å; G107-T109 PolarHBondContact O-N 2.94Å; T109-I111 VanDerWaalsContact C-N 3.35Å; T109-I111 PolarHBondContact O-N 3.46Å; T109-L112 PolarHBondContact O-N 2.84Å; T109-D113 WeakPolarHBondContact O-CB 3.33Å; T109-D113 PolarHBondContact O-N 3.03Å; T109-Q121 HydrophobicContact CG2-CB 4.11Å; T109-T129 PolarHBondContact OG1-OG1 2.94Å
110	K	88.6	Confident	84.9	Confident	48 Å²	48	37.5 Å²	37.5	21%	0.209	19%	0.185	C	C	.	.	H	α-helix	trans	-65.8	-35.9	177.7	-161.1	64.2	168.6	-178	0	112.6	G107 D113 K114 N119 A285	G107-K110 PolarHBondContact O-N 2.83Å; G107-K110 VanDerWaalsContact O-N 3.1Å; K110-D113 WeakPolarHBondContact O-CB 3.46Å; K110-D113 PolarHBondContact O-N 2.84Å; K110-K114 WeakPolarHBondContact O-CB 3.4Å; K110-K114 PolarHBondContact O-N 3.19Å; K110-N119 PolarHBondContact NZ-OD1 3Å; K110-A285 HydrophobicContact CB-CB 3.84Å; K110-A285 HydrophobicContact CG-CB 3.85Å
111	I	90	Very high	84.2	Confident	2 Å²	2	39.6 Å²	39.6	1%	0.01	20%	0.195	C	C	.	.	H	α-helix	trans	-59.4	-48.4	172.9	-74.1	177.5	0	0	0	109.8	G107 K108 T109 K114 I115 V186 A214 N216 A285 M291 L294	G107-I111 WeakPolarHBondContact O-CG1 3.45Å; G107-I111 PolarHBondContact O-N 2.77Å; K108-I111 PolarHBondContact O-N 2.83Å; T109-I111 VanDerWaalsContact C-N 3.35Å; T109-I111 PolarHBondContact O-N 3.46Å; I111-K114 PolarHBondContact O-N 2.76Å; I111-I115 HydrophobicContact CG2-CD1 4.14Å; I111-I115 WeakPolarHBondContact O-CG1 3.47Å; I111-I115 PolarHBondContact O-N 3.08Å; I111-V186 HydrophobicContact CD1-CB 4.31Å; I111-V186 HydrophobicContact CD1-CG1 3.58Å; I111-V186 HydrophobicContact CD1-CG2 3.69Å; I111-A214 HydrophobicContact CD1-CB 4.31Å; I111-N216 HydrophobicContact CD1-CB 4.33Å; I111-A285 HydrophobicContact CB-CB 4.48Å; I111-A285 HydrophobicContact CG1-CB 3.6Å; I111-M291 HydrophobicContact CB-CE 4.26Å; I111-M291 HydrophobicContact CG1-SD 4.49Å; I111-M291 HydrophobicContact CG2-CE 3.54Å; I111-M291 HydrophobicContact CG2-SD 4.36Å; I111-L294 HydrophobicContact CG2-CD2 4.42Å
112	L	87.9	Confident	83.7	Confident	2 Å²	2	45 Å²	45	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-65.5	-41.5	178.9	-65.3	174.9	0	0	0	112.2	V100 K108 T109 K114 I115 R116 I165 S167	V100-L112 HydrophobicContact CG2-CD1 4.46Å; V100-L112 HydrophobicContact CG2-CD2 3.99Å; V100-L112 HydrophobicContact CG2-CG 4.41Å; K108-L112 PolarHBondContact O-N 3.26Å; T109-L112 PolarHBondContact O-N 2.84Å; L112-K114 VanDerWaalsContact C-N 3.29Å; L112-K114 PolarHBondContact O-N 3.28Å; L112-I115 PolarHBondContact O-N 3.15Å; L112-R116 WeakPolarHBondContact O-CB 3.46Å; L112-R116 VanDerWaalsContact O-CG 3.31Å; L112-R116 WeakPolarHBondContact O-CG 3.17Å; L112-R116 PolarHBondContact O-N 3.28Å; L112-I165 HydrophobicContact CD2-CB 4.07Å; L112-I165 HydrophobicContact CD2-CD1 4.49Å; L112-I165 HydrophobicContact CD2-CG2 3.44Å; L112-I165 VanDerWaalsContact CD2-CG2 3.44Å; L112-S167 VanDerWaalsContact CD1-CB 3.5Å
113	D	87.2	Confident	83.1	Confident	2 Å²	2	50 Å²	50	1%	0.011	26%	0.258	C	S	.	.	H	α-helix	trans	-56.5	-43.1	172.5	-89.8	-12.2	0	0	0	112.3	T109 K110 I115 R116 R117 T118 V120 Q121	T109-D113 WeakPolarHBondContact O-CB 3.33Å; T109-D113 PolarHBondContact O-N 3.03Å; K110-D113 WeakPolarHBondContact O-CB 3.46Å; K110-D113 PolarHBondContact O-N 2.84Å; D113-I115 PolarHBondContact O-N 3.41Å; D113-R116 CarbonylContact O-C 3.14Å; D113-R116 PolarHBondContact O-N 3.49Å; D113-R116 IonicContact OD1-CZ 2.86Å; D113-R116 IonicContact OD1-NE 3.55Å; D113-R116 IonicContact OD1-NH2 2.85Å; D113-R116 PolarHBondContact OD1-NH2 2.89Å; D113-R117 WeakPolarHBondContact O-CA 3.1Å; D113-R117 PolarHBondContact O-N 3.24Å; D113-T118 CarbonylContact C-O 3.59Å; D113-T118 WeakPolarHBondContact CA-O 3.25Å; D113-T118 WeakPolarHBondContact CB-O 3.3Å; D113-T118 VanDerWaalsContact CG-O 3.28Å; D113-T118 PolarHBondContact O-N 2.87Å; D113-T118 VanDerWaalsContact O-O 3.11Å; D113-T118 PolarHBondContact OD1-OG1 2.77Å; D113-V120 VanDerWaalsContact OD1-CB 3.3Å; D113-V120 WeakPolarHBondContact OD1-CB 3.46Å; D113-V120 WeakPolarHBondContact OD1-CG2 3.45Å; D113-V120 PolarHBondContact OD1-N 2.92Å; D113-V120 PolarHBondContact OD2-N 2.84Å; D113-Q121 PolarHBondContact OD2-N 2.84Å
114	K	89.5	Confident	82.2	Confident	78 Å²	78	49.6 Å²	49.6	34%	0.339	26%	0.256	S	S	.	.	H	α-helix	trans	-65.4	-39.3	176.7	-164.3	66.4	174.3	-160.3	0	112.5	K110 I111 L112 R117 H286 T287 M291	K110-K114 WeakPolarHBondContact O-CB 3.4Å; K110-K114 PolarHBondContact O-N 3.19Å; I111-K114 PolarHBondContact O-N 2.76Å; L112-K114 VanDerWaalsContact C-N 3.29Å; L112-K114 PolarHBondContact O-N 3.28Å; K114-R117 PolarHBondContact O-N 2.86Å; K114-H286 PolarHBondContact NZ-O 3.01Å; K114-T287 WeakPolarHBondContact CE-O 3.3Å; K114-T287 PolarHBondContact NZ-O 2.78Å; K114-M291 HydrophobicContact CB-CE 4.48Å; K114-M291 HydrophobicContact CG-CG 4.26Å
115	I	85.9	Confident	80.9	Confident	6 Å²	6	49.9 Å²	49.9	3%	0.031	27%	0.266	C	S	.	.	H	α-helix	trans	-65.1	-43	175.3	-66.1	165.8	0	0	0	110.6	I111 L112 D113 R117 V137 Q145 I165 M291 M295	I111-I115 HydrophobicContact CG2-CD1 4.14Å; I111-I115 WeakPolarHBondContact O-CG1 3.47Å; I111-I115 PolarHBondContact O-N 3.08Å; L112-I115 PolarHBondContact O-N 3.15Å; D113-I115 PolarHBondContact O-N 3.41Å; I115-R117 VanDerWaalsContact C-N 3.32Å; I115-V137 HydrophobicContact CG2-CG1 4.2Å; I115-V137 HydrophobicContact CG2-CG2 3.76Å; I115-Q145 PolarHBondContact O-NE2 2.86Å; I115-I165 HydrophobicContact CD1-CD1 4.01Å; I115-M291 HydrophobicContact CD1-CE 3.83Å; I115-M291 HydrophobicContact CG1-CE 3.53Å; I115-M295 HydrophobicContact CD1-SD 3.73Å; I115-M295 HydrophobicContact CG1-SD 4.3Å
116	R	83.3	Confident	79.8	Confident	7 Å²	7	48.2 Å²	48.2	3%	0.026	28%	0.275	C	S	.	.	H	α-helix	trans	-71.8	-23.4	178.4	-72.4	-174.3	-67.3	-121.6	8.2	113.9	L112 D113 T118 T135 L370 E372	L112-R116 WeakPolarHBondContact O-CB 3.46Å; L112-R116 VanDerWaalsContact O-CG 3.31Å; L112-R116 WeakPolarHBondContact O-CG 3.17Å; L112-R116 PolarHBondContact O-N 3.28Å; D113-R116 CarbonylContact O-C 3.14Å; D113-R116 PolarHBondContact O-N 3.49Å; D113-R116 IonicContact OD1-CZ 2.86Å; D113-R116 IonicContact OD1-NE 3.55Å; D113-R116 IonicContact OD1-NH2 2.85Å; D113-R116 PolarHBondContact OD1-NH2 2.89Å; R116-T118 VanDerWaalsContact C-N 3.28Å; R116-T118 HydrophobicContact CB-CG2 3.99Å; R116-T118 VanDerWaalsContact CB-OG1 3.27Å; R116-T118 WeakPolarHBondContact CB-OG1 3.4Å; R116-T118 PolarHBondContact NE-OG1 2.66Å; R116-T135 HydrophobicContact CG-CG2 3.45Å; R116-T135 VanDerWaalsContact CG-CG2 3.45Å; R116-T135 PolarHBondContact NH1-OG1 3.3Å; R116-L370 WeakPolarHBondContact CB-O 3.44Å; R116-L370 VanDerWaalsContact CD-O 3.29Å; R116-L370 WeakPolarHBondContact CD-O 3.06Å; R116-L370 VanDerWaalsContact CG-O 3.24Å; R116-L370 WeakPolarHBondContact CG-O 3.42Å; R116-E372 IonicContact NH1-OE1 3.02Å; R116-E372 PolarHBondContact NH1-OE1 3.29Å
117	R	83.2	Confident	78.6	Confident	196 Å²	196	49.2 Å²	49.2	74%	0.74	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	39	-163.8	-53.1	178.1	176.4	176.7	-0.9	112	D113 K114 I115	D113-R117 WeakPolarHBondContact O-CA 3.1Å; D113-R117 PolarHBondContact O-N 3.24Å; K114-R117 PolarHBondContact O-N 2.86Å; I115-R117 VanDerWaalsContact C-N 3.32Å
118	T	75.8	Confident	77.5	Confident	45 Å²	45	52.9 Å²	52.9	28%	0.276	30%	0.301	S	S	.	.			trans	-124.6	167.8	176.3	62.2	0	0	0	0	110.2	D113 R116	D113-T118 CarbonylContact C-O 3.59Å; D113-T118 WeakPolarHBondContact CA-O 3.25Å; D113-T118 WeakPolarHBondContact CB-O 3.3Å; D113-T118 VanDerWaalsContact CG-O 3.28Å; D113-T118 PolarHBondContact O-N 2.87Å; D113-T118 VanDerWaalsContact O-O 3.11Å; D113-T118 PolarHBondContact OD1-OG1 2.77Å; R116-T118 VanDerWaalsContact C-N 3.28Å; R116-T118 HydrophobicContact CB-CG2 3.99Å; R116-T118 VanDerWaalsContact CB-OG1 3.27Å; R116-T118 WeakPolarHBondContact CB-OG1 3.4Å; R116-T118 PolarHBondContact NE-OG1 2.66Å
119	N	77.8	Confident	76.3	Confident	96 Å²	96	52.4 Å²	52.4	51%	0.513	30%	0.301	S	S	.	.			trans	-122.6	73.6	171.4	-76.2	-18.8	0	0	0	109.2	K110 Q121 D122	K110-N119 PolarHBondContact NZ-OD1 3Å; N119-Q121 VanDerWaalsContact C-N 3.34Å; N119-D122 WeakPolarHBondContact CB-OD2 3.3Å
120	V	73	Confident	75.2	Confident	14 Å²	14	57.8 Å²	57.8	9%	0.085	33%	0.326	C	S	.	.			trans	-72	-33.2	178.2	-178.2	0	0	0	0	110.7	D113 D122 S123 V375	D113-V120 VanDerWaalsContact OD1-CB 3.3Å; D113-V120 WeakPolarHBondContact OD1-CB 3.46Å; D113-V120 WeakPolarHBondContact OD1-CG2 3.45Å; D113-V120 PolarHBondContact OD1-N 2.92Å; D113-V120 PolarHBondContact OD2-N 2.84Å; V120-D122 PolarHBondContact O-N 3.23Å; V120-S123 WeakPolarHBondContact O-CB 3.31Å; V120-S123 PolarHBondContact O-N 2.93Å; V120-V375 HydrophobicContact CG1-CG2 4.1Å; V120-V375 HydrophobicContact CG2-CG2 4.18Å
121	Q	72.9	Confident	73.9	Confident	47 Å²	47	59.9 Å²	59.9	22%	0.22	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-54.6	-38.3	-179.2	-172.4	178.8	1.3	0	0	112.9	T109 D113 N119 S123 E124 G127	T109-Q121 HydrophobicContact CG2-CB 4.11Å; D113-Q121 PolarHBondContact OD2-N 2.84Å; N119-Q121 VanDerWaalsContact C-N 3.34Å; Q121-S123 PolarHBondContact O-N 3.06Å; Q121-E124 PolarHBondContact O-N 2.89Å; Q121-E124 VanDerWaalsContact O-N 3.09Å; Q121-G127 PolarHBondContact NE2-O 2.76Å
122	D	76.7	Confident	72.9	Confident	114 Å²	114	60.7 Å²	60.7	61%	0.61	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-67.7	-18.4	-178.2	-58.7	-16.5	0	0	0	112.7	N119 V120	N119-D122 WeakPolarHBondContact CB-OD2 3.3Å; V120-D122 PolarHBondContact O-N 3.23Å
123	S	73	Confident	71.9	Confident	106 Å²	106	60.6 Å²	60.6	74%	0.741	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-90.2	-10.2	176.5	-57.4	0	0	0	0	113.1	V120 Q121	V120-S123 WeakPolarHBondContact O-CB 3.31Å; V120-S123 PolarHBondContact O-N 2.93Å; Q121-S123 PolarHBondContact O-N 3.06Å
124	E	66.7	Low	71.3	Confident	29 Å²	29	60.9 Å²	60.9	14%	0.136	34%	0.342	C	S	.	.	S	Bend	trans	-85.2	139.5	177.8	-64.2	-176.7	148.7	0	0	110.5	Q121 G126 G127 I128 T129 R374	Q121-E124 PolarHBondContact O-N 2.89Å; Q121-E124 VanDerWaalsContact O-N 3.09Å; E124-G126 PolarHBondContact O-N 3.01Å; E124-G126 VanDerWaalsContact O-N 3.14Å; E124-G127 PolarHBondContact O-N 2.85Å; E124-I128 WeakPolarHBondContact CB-O 3.26Å; E124-T129 VanDerWaalsContact CD-CA 3.46Å; E124-T129 WeakPolarHBondContact OE1-CA 3.24Å; E124-T129 WeakPolarHBondContact OE1-CG2 3.11Å; E124-T129 PolarHBondContact OE1-OG1 3.48Å; E124-T129 WeakPolarHBondContact OE2-CA 3.44Å; E124-T129 WeakPolarHBondContact OE2-CB 3.49Å; E124-T129 PolarHBondContact OE2-N 2.82Å; E124-T129 VanDerWaalsContact OE2-N 3.1Å; E124-T129 PolarHBondContact OE2-OG1 3.01Å; E124-R374 IonicContact OE1-CZ 2.64Å; E124-R374 IonicContact OE1-NH1 3.98Å; E124-R374 PolarHBondContact OE1-NH1 3.28Å; E124-R374 IonicContact OE1-NH2 2.72Å; E124-R374 PolarHBondContact OE1-NH2 2.82Å
125	A	54.5	Low	70.8	Confident	71 Å²	71	57.2 Å²	57.2	59%	0.587	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-60.2	119.7	-179.8	0	0	0	0	0	110.4	G127 I128	A125-G127 PolarHBondContact O-N 3.01Å; A125-I128 PolarHBondContact O-N 3.12Å
126	G	61.7	Low	70.6	Confident	79 Å²	79	58.9 Å²	58.9	81%	0.814	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	70	9.2	-175.8	0	0	0	0	0	114.9	E124 I128	E124-G126 PolarHBondContact O-N 3.01Å; E124-G126 VanDerWaalsContact O-N 3.14Å; G126-I128 PolarHBondContact O-N 3.25Å
127	G	65.3	Low	70.6	Confident	22 Å²	22	58.6 Å²	58.6	23%	0.227	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	71.3	17	-174.6	0	0	0	0	0	114.1	Q121 E124 A125	Q121-G127 PolarHBondContact NE2-O 2.76Å; E124-G127 PolarHBondContact O-N 2.85Å; A125-G127 PolarHBondContact O-N 3.01Å
128	I	63.2	Low	70.5	Confident	93 Å²	93	50 Å²	50	48%	0.477	30%	0.302	S	S	.	.			trans	-104.8	126.7	-176.5	-55.4	169.1	0	0	0	109.7	E124 A125 G126 Q130	E124-I128 WeakPolarHBondContact CB-O 3.26Å; A125-I128 PolarHBondContact O-N 3.12Å; G126-I128 PolarHBondContact O-N 3.25Å; I128-Q130 PolarHBondContact O-N 3.06Å
129	T	62.7	Low	70.6	Confident	29 Å²	29	50.5 Å²	50.5	18%	0.178	30%	0.302	C	S	.	.			trans	-71.9	118	175.2	-53.2	0	0	0	0	109.8	T109 E124 L169 R374	T109-T129 PolarHBondContact OG1-OG1 2.94Å; E124-T129 VanDerWaalsContact CD-CA 3.46Å; E124-T129 WeakPolarHBondContact OE1-CA 3.24Å; E124-T129 WeakPolarHBondContact OE1-CG2 3.11Å; E124-T129 PolarHBondContact OE1-OG1 3.48Å; E124-T129 WeakPolarHBondContact OE2-CA 3.44Å; E124-T129 WeakPolarHBondContact OE2-CB 3.49Å; E124-T129 PolarHBondContact OE2-N 2.82Å; E124-T129 VanDerWaalsContact OE2-N 3.1Å; E124-T129 PolarHBondContact OE2-OG1 3.01Å; T129-L169 VanDerWaalsContact C-CD1 3.5Å; T129-L169 HydrophobicContact CG2-CD1 3.61Å; T129-L169 WeakPolarHBondContact O-CD1 3.47Å; T129-R374 VanDerWaalsContact CG2-NH1 3.27Å
130	Q	60.7	Low	70.7	Confident	128 Å²	128	52 Å²	52	60%	0.598	31%	0.305	S	S	*	.			trans	-111.8	-13.9	178.8	-65.6	-177.8	3.4	0	0	113.8	I128 L169	I128-Q130 PolarHBondContact O-N 3.06Å; Q130-L169 WeakPolarHBondContact O-CD2 3.47Å
131	Q	61.9	Low	71.1	Confident	92 Å²	92	52.6 Å²	52.6	43%	0.43	31%	0.309	S	S	.	.	S	Bend	trans	-123	152.3	-174.3	-68.1	-179.4	2.1	0	0	111	G133 R374	Q131-G133 PolarHBondContact O-N 2.96Å; Q131-R374 VanDerWaalsContact CB-CD 3.48Å; Q131-R374 HydrophobicContact CB-CG 4.44Å; Q131-R374 PolarHBondContact O-NH1 2.83Å
132	I	67.2	Low	71.4	Confident	18 Å²	18	50.5 Å²	50.5	9%	0.092	30%	0.299	C	S	.	.			trans	-76.3	128.5	176	-60.6	155	0	0	0	108.7	L169 L172 E322 R374	I132-L169 HydrophobicContact CG1-CB 4.42Å; I132-L172 HydrophobicContact CB-CD1 4.1Å; I132-L172 HydrophobicContact CD1-CB 4.4Å; I132-L172 HydrophobicContact CD1-CD1 3.25Å; I132-L172 HydrophobicContact CD1-CD2 4.34Å; I132-L172 HydrophobicContact CD1-CG 3.39Å; I132-L172 HydrophobicContact CG1-CD1 3.52Å; I132-L172 HydrophobicContact CG1-CG 4Å; I132-L172 HydrophobicContact CG2-CD1 3.47Å; I132-L172 VanDerWaalsContact CG2-CD1 3.47Å; I132-E322 HydrophobicContact CB-CG 4.39Å; I132-E322 WeakPolarHBondContact CB-OE1 3.46Å; I132-E322 HydrophobicContact CD1-CG 3.72Å; I132-E322 VanDerWaalsContact CD1-OE1 3.23Å; I132-E322 WeakPolarHBondContact CD1-OE1 3.38Å; I132-E322 VanDerWaalsContact CG1-OE1 3.31Å; I132-E322 WeakPolarHBondContact CG1-OE1 3.29Å; I132-E322 PolarHBondContact N-OE1 3.43Å; I132-R374 WeakPolarHBondContact O-CD 3.28Å
133	G	68.7	Low	71.5	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.01	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	145.2	-176.6	0	0	0	0	0	111	Q131 S167 E372	Q131-G133 PolarHBondContact O-N 2.96Å; G133-S167 WeakPolarHBondContact CA-OG 3.41Å; G133-S167 PolarHBondContact N-OG 3.01Å; G133-S167 PolarHBondContact O-N 3.48Å; G133-S167 PolarHBondContact O-OG 3.46Å; G133-E372 VanDerWaalsContact C-OE1 3.3Å; G133-E372 WeakPolarHBondContact CA-OE1 3.2Å
134	A	74	Confident	72	Confident	7 Å²	7	45.6 Å²	45.6	6%	0.058	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	141	-176.6	0	0	0	0	0	112	Y164 F166	A134-Y164 HydrophobicContact CB-CD1 4.43Å; A134-Y164 HydrophobicContact CB-CE1 3.39Å; A134-F166 HydrophobicContact CB-CD1 3.34Å; A134-F166 HydrophobicContact CB-CE1 3.33Å; A134-F166 HydrophobicContact CB-CG 4.15Å; A134-F166 HydrophobicContact CB-CZ 4.13Å
135	T	78.7	Confident	72.5	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.006	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	123.6	-168.2	-58.1	0	0	0	0	109.8	R116 V137 I165	R116-T135 HydrophobicContact CG-CG2 3.45Å; R116-T135 VanDerWaalsContact CG-CG2 3.45Å; R116-T135 PolarHBondContact NH1-OG1 3.3Å; T135-V137 HydrophobicContact CG2-CG2 4.16Å; T135-I165 PolarHBondContact N-O 3.18Å; T135-I165 PolarHBondContact O-N 2.83Å
136	F	81.3	Confident	73.6	Confident	42 Å²	42	42.2 Å²	42.2	18%	0.184	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	122.9	168.9	-178.9	-112.6	0	0	0	110.1	P138 P162 Y164 P369 L370	F136-P138 HydrophobicContact CD1-CG 4.17Å; F136-P138 HydrophobicContact CE1-CB 4.47Å; F136-P138 HydrophobicContact CE1-CG 4.04Å; F136-P162 HydrophobicContact CD2-CB 4.44Å; F136-P162 HydrophobicContact CE1-CB 4.42Å; F136-P162 HydrophobicContact CE2-CB 3.43Å; F136-P162 VanDerWaalsContact CE2-CB 3.43Å; F136-P162 HydrophobicContact CE2-CG 3.77Å; F136-P162 HydrophobicContact CZ-CB 3.41Å; F136-P162 VanDerWaalsContact CZ-CB 3.41Å; F136-P162 HydrophobicContact CZ-CG 3.74Å; F136-Y164 HydrophobicContact CB-CD2 3.91Å; F136-Y164 HydrophobicContact CB-CE2 3.8Å; F136-Y164 AromaticContact CD2-CD2 3.74Å; F136-Y164 HydrophobicContact CD2-CD2 3.74Å; F136-Y164 HydrophobicContact CD2-CE2 4.34Å; F136-Y164 HydrophobicContact CG-CD2 4.31Å; F136-P369 HydrophobicContact CD1-CB 4.31Å; F136-L370 PolarHBondContact O-N 2.92Å
137	V	83.2	Confident	74.5	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	108.2	176.4	-171.3	0	0	0	0	108.9	I115 T135 T141 L142 V163 I165 L370	I115-V137 HydrophobicContact CG2-CG1 4.2Å; I115-V137 HydrophobicContact CG2-CG2 3.76Å; T135-V137 HydrophobicContact CG2-CG2 4.16Å; V137-T141 HydrophobicContact CG1-CG2 4.19Å; V137-L142 HydrophobicContact CB-CD2 4.37Å; V137-L142 HydrophobicContact CG1-CD2 3.64Å; V137-L142 HydrophobicContact CG1-CG 3.9Å; V137-V163 PolarHBondContact N-O 2.94Å; V137-V163 PolarHBondContact O-N 3.1Å; V137-I165 HydrophobicContact CG2-CD1 3.93Å; V137-I165 HydrophobicContact CG2-CG1 4.28Å; V137-L370 HydrophobicContact CG1-CD2 4.16Å; V137-L370 HydrophobicContact CG2-CD2 4.49Å
138	P	81.2	Confident	75	Confident	17 Å²	17	46.3 Å²	46.3	11%	0.11	23%	0.233	C	C	.	.			trans	-63.3	154	178.6	-23.2	34.5	0	0	0	113	F136 E140 T141 L142 P369	F136-P138 HydrophobicContact CD1-CG 4.17Å; F136-P138 HydrophobicContact CE1-CB 4.47Å; F136-P138 HydrophobicContact CE1-CG 4.04Å; P138-E140 WeakPolarHBondContact CB-OE2 3.44Å; P138-E140 PolarHBondContact O-N 3.1Å; P138-T141 WeakPolarHBondContact O-CB 3.15Å; P138-T141 PolarHBondContact O-N 2.99Å; P138-T141 VanDerWaalsContact O-N 3.07Å; P138-L142 PolarHBondContact O-N 3.1Å; P138-L142 VanDerWaalsContact O-N 3.16Å; P138-P369 HydrophobicContact CG-CB 3.73Å
139	Q	78.9	Confident	75.6	Confident	55 Å²	55	42 Å²	42	26%	0.257	21%	0.21	S	C	.	.	H	α-helix	trans	-56.4	-38.5	-180	-171.6	-163.8	12.2	0	0	112.4	T141 L142 K143 A160	Q139-T141 VanDerWaalsContact C-N 3.28Å; Q139-T141 PolarHBondContact O-N 3.38Å; Q139-L142 WeakPolarHBondContact O-CB 3.41Å; Q139-L142 PolarHBondContact O-N 3.01Å; Q139-K143 HydrophobicContact CG-CD 4.42Å; Q139-K143 VanDerWaalsContact NE2-CE 3.28Å; Q139-K143 WeakPolarHBondContact O-CG 3.49Å; Q139-K143 PolarHBondContact O-N 3.22Å; Q139-A160 HydrophobicContact CG-CB 3.53Å; Q139-A160 VanDerWaalsContact CG-O 3.26Å; Q139-A160 WeakPolarHBondContact CG-O 3.31Å; Q139-A160 PolarHBondContact NE2-O 3.01Å
140	E	80	Confident	75.6	Confident	127 Å²	127	44.3 Å²	44.3	59%	0.593	23%	0.226	S	C	*	.	H	α-helix	trans	-63.8	-38.3	-179.5	-55.1	77.3	-167.4	0	0	110.9	P138 K143 A144	P138-E140 WeakPolarHBondContact CB-OE2 3.44Å; P138-E140 PolarHBondContact O-N 3.1Å; E140-K143 PolarHBondContact O-N 3.25Å; E140-A144 WeakPolarHBondContact O-CB 3.3Å; E140-A144 PolarHBondContact O-N 3.12Å
141	T	81.4	Confident	75.7	Confident	27 Å²	27	44.2 Å²	44.2	17%	0.166	23%	0.225	C	C	.	.	H	α-helix	trans	-69.7	-41.1	178.1	-56.4	0	0	0	0	110.7	V137 P138 Q139 A144 Q145 L370	V137-T141 HydrophobicContact CG1-CG2 4.19Å; P138-T141 WeakPolarHBondContact O-CB 3.15Å; P138-T141 PolarHBondContact O-N 2.99Å; P138-T141 VanDerWaalsContact O-N 3.07Å; Q139-T141 VanDerWaalsContact C-N 3.28Å; Q139-T141 PolarHBondContact O-N 3.38Å; T141-A144 PolarHBondContact O-N 3.18Å; T141-Q145 HydrophobicContact CG2-CG 4.45Å; T141-Q145 WeakPolarHBondContact O-CB 3.42Å; T141-Q145 WeakPolarHBondContact O-CG 3.45Å; T141-Q145 PolarHBondContact O-N 3.24Å; T141-L370 HydrophobicContact CG2-CD1 4.26Å; T141-L370 HydrophobicContact CG2-CD2 4.02Å
142	L	79.3	Confident	75.6	Confident	2 Å²	2	41 Å²	41	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-59.8	-47.6	174.6	-64.1	173.4	0	0	0	111.4	V137 P138 Q139 A144 Q145 A146 V163 M295 V299	V137-L142 HydrophobicContact CB-CD2 4.37Å; V137-L142 HydrophobicContact CG1-CD2 3.64Å; V137-L142 HydrophobicContact CG1-CG 3.9Å; P138-L142 PolarHBondContact O-N 3.1Å; P138-L142 VanDerWaalsContact O-N 3.16Å; Q139-L142 WeakPolarHBondContact O-CB 3.41Å; Q139-L142 PolarHBondContact O-N 3.01Å; L142-A144 VanDerWaalsContact C-N 3.34Å; L142-A144 PolarHBondContact O-N 2.98Å; L142-Q145 PolarHBondContact O-N 3.35Å; L142-A146 VanDerWaalsContact O-CB 3.29Å; L142-A146 WeakPolarHBondContact O-CB 3.24Å; L142-A146 PolarHBondContact O-N 3.16Å; L142-V163 HydrophobicContact CD1-CB 4.01Å; L142-V163 HydrophobicContact CD1-CG2 3.55Å; L142-V163 HydrophobicContact CD2-CG2 4.5Å; L142-M295 HydrophobicContact CD2-CB 4.39Å; L142-M295 HydrophobicContact CD2-CE 3.13Å; L142-M295 HydrophobicContact CD2-CG 4.48Å; L142-V299 HydrophobicContact CD1-CG2 4.4Å
143	K	78.8	Confident	75.1	Confident	59 Å²	59	42.9 Å²	42.9	26%	0.257	22%	0.22	S	C	.	.	H	α-helix	trans	-61.9	-41.4	177.2	-73.6	178.4	179.5	174.7	0	111.9	Q139 E140 A146 K147	Q139-K143 HydrophobicContact CG-CD 4.42Å; Q139-K143 VanDerWaalsContact NE2-CE 3.28Å; Q139-K143 WeakPolarHBondContact O-CG 3.49Å; Q139-K143 PolarHBondContact O-N 3.22Å; E140-K143 PolarHBondContact O-N 3.25Å; K143-A146 PolarHBondContact O-N 3.39Å; K143-K147 PolarHBondContact O-N 2.8Å; K143-K147 VanDerWaalsContact O-N 3.16Å
144	A	81.8	Confident	74.3	Confident	58 Å²	58	49.3 Å²	49.3	48%	0.479	25%	0.253	S	S	.	.	H	α-helix	trans	-64.6	-42.1	177.9	0	0	0	0	0	112	E140 T141 L142 K147	E140-A144 WeakPolarHBondContact O-CB 3.3Å; E140-A144 PolarHBondContact O-N 3.12Å; T141-A144 PolarHBondContact O-N 3.18Å; L142-A144 VanDerWaalsContact C-N 3.34Å; L142-A144 PolarHBondContact O-N 2.98Å; A144-K147 WeakPolarHBondContact O-CB 3.42Å
145	Q	78	Confident	73.4	Confident	28 Å²	28	52 Å²	52	13%	0.131	27%	0.269	C	S	.	.	H	α-helix	trans	-72.4	-34.1	178.6	-71.7	177.3	-6.6	0	0	112.6	I115 T141 L142 K147 G292	I115-Q145 PolarHBondContact O-NE2 2.86Å; T141-Q145 HydrophobicContact CG2-CG 4.45Å; T141-Q145 WeakPolarHBondContact O-CB 3.42Å; T141-Q145 WeakPolarHBondContact O-CG 3.45Å; T141-Q145 PolarHBondContact O-N 3.24Å; L142-Q145 PolarHBondContact O-N 3.35Å; Q145-K147 VanDerWaalsContact C-N 3.32Å; Q145-G292 WeakPolarHBondContact O-CA 3.4Å
146	A	78.5	Confident	72.4	Confident	1 Å²	1	52 Å²	52	1%	0.008	27%	0.269	C	S	.	.	H	α-helix	trans	-84.9	-1.7	179.6	0	0	0	0	0	113.9	L142 K143 M148 V149 L156 A296	L142-A146 VanDerWaalsContact O-CB 3.29Å; L142-A146 WeakPolarHBondContact O-CB 3.24Å; L142-A146 PolarHBondContact O-N 3.16Å; K143-A146 PolarHBondContact O-N 3.39Å; A146-M148 PolarHBondContact O-N 3.32Å; A146-M148 VanDerWaalsContact O-N 3.08Å; A146-V149 PolarHBondContact O-N 2.93Å; A146-L156 HydrophobicContact CB-CD1 3.38Å; A146-A296 HydrophobicContact CB-CB 4.39Å
147	K	78.9	Confident	71	Confident	154 Å²	154	55.1 Å²	55.1	67%	0.67	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-29.4	-176.5	-171.6	177.3	178.8	-178.8	0	113.5	K143 A144 Q145 V149 F153	K143-K147 PolarHBondContact O-N 2.8Å; K143-K147 VanDerWaalsContact O-N 3.16Å; A144-K147 WeakPolarHBondContact O-CB 3.42Å; Q145-K147 VanDerWaalsContact C-N 3.32Å; K147-V149 VanDerWaalsContact C-N 3.27Å; K147-V149 PolarHBondContact O-N 3.13Å; K147-F153 HydrophobicContact CB-CE2 4.21Å; K147-F153 HydrophobicContact CG-CE2 4.22Å; K147-F153 HydrophobicContact CG-CZ 4.49Å
148	M	77.1	Confident	69.4	Low	34 Å²	34	65.2 Å²	65.2	17%	0.167	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-12.9	178	64	-137.3	-89	0	0	114.5	A146 P150 P228 K230	A146-M148 PolarHBondContact O-N 3.32Å; A146-M148 VanDerWaalsContact O-N 3.08Å; M148-P150 WeakPolarHBondContact O-CD 3.42Å; M148-P228 WeakPolarHBondContact CE-O 3.47Å; M148-K230 WeakPolarHBondContact CE-O 3.3Å
149	V	74.3	Confident	68	Low	2 Å²	2	71 Å²	71	1%	0.012	35%	0.346	C	S	.	.			trans	-108.7	86.9	-177.1	-171	0	0	0	0	109.3	A146 K147 E151 V152 F153 N293	A146-V149 PolarHBondContact O-N 2.93Å; K147-V149 VanDerWaalsContact C-N 3.27Å; K147-V149 PolarHBondContact O-N 3.13Å; V149-E151 VanDerWaalsContact C-N 3.31Å; V149-E151 PolarHBondContact O-N 3.34Å; V149-V152 HydrophobicContact CG1-CB 4.07Å; V149-V152 HydrophobicContact CG1-CG2 3.8Å; V149-V152 PolarHBondContact O-N 3.41Å; V149-F153 WeakPolarHBondContact O-CB 3.38Å; V149-F153 PolarHBondContact O-N 3.48Å; V149-N293 WeakPolarHBondContact CG2-ND2 3.44Å
150	P	64.2	Low	66.9	Low	77 Å²	77	69 Å²	69	50%	0.5	34%	0.338	S	S	.	.	H	α-helix	trans	-61.7	-35.7	-170.7	20.5	-31.5	0	0	0	113.6	M148 V152 F153	M148-P150 WeakPolarHBondContact O-CD 3.42Å; P150-V152 VanDerWaalsContact C-N 3.33Å; P150-V152 PolarHBondContact O-N 3.14Å; P150-F153 PolarHBondContact O-N 3.12Å
151	E	62.6	Low	65.7	Low	126 Å²	126	63.6 Å²	63.6	59%	0.589	31%	0.313	S	S	*	.	H	α-helix	trans	-63	-37.6	-179.3	-71.1	170.7	168.5	0	0	112.5	V149 R233	V149-E151 VanDerWaalsContact C-N 3.31Å; V149-E151 PolarHBondContact O-N 3.34Å; E151-R233 IonicContact OE1-NH1 3.49Å; E151-R233 IonicContact OE2-CZ 2.73Å; E151-R233 VanDerWaalsContact OE2-CZ 3.24Å; E151-R233 IonicContact OE2-NH1 3.25Å; E151-R233 PolarHBondContact OE2-NH1 3.09Å; E151-R233 IonicContact OE2-NH2 3.88Å; E151-R233 PolarHBondContact OE2-NH2 3.21Å
152	V	58.7	Low	64.5	Low	26 Å²	26	64.2 Å²	64.2	16%	0.158	32%	0.317	C	S	.	.	H	α-helix	trans	-89.3	-27	179.9	-174.2	0	0	0	0	111.4	V149 P150 L154 T155 L156 A296	V149-V152 HydrophobicContact CG1-CB 4.07Å; V149-V152 HydrophobicContact CG1-CG2 3.8Å; V149-V152 PolarHBondContact O-N 3.41Å; P150-V152 VanDerWaalsContact C-N 3.33Å; P150-V152 PolarHBondContact O-N 3.14Å; V152-L154 VanDerWaalsContact C-N 3.26Å; V152-L154 PolarHBondContact O-N 3.27Å; V152-T155 PolarHBondContact O-N 2.78Å; V152-L156 HydrophobicContact CG1-CD1 4.17Å; V152-L156 HydrophobicContact CG1-CG 4.1Å; V152-L156 WeakPolarHBondContact O-CG 3.4Å; V152-L156 PolarHBondContact O-N 3.21Å; V152-A296 HydrophobicContact CB-CB 3.93Å; V152-A296 HydrophobicContact CG1-CB 3.72Å; V152-A296 HydrophobicContact CG2-CB 4.12Å
153	F	56.4	Low	63.5	Low	57 Å²	57	64.1 Å²	64.1	25%	0.25	32%	0.316	C	S	.	.	H	α-helix	trans	-56.9	-38.4	179.8	-168.3	-106.1	0	0	0	112.8	K147 V149 P150 T155 L156 H157	K147-F153 HydrophobicContact CB-CE2 4.21Å; K147-F153 HydrophobicContact CG-CE2 4.22Å; K147-F153 HydrophobicContact CG-CZ 4.49Å; V149-F153 WeakPolarHBondContact O-CB 3.38Å; V149-F153 PolarHBondContact O-N 3.48Å; P150-F153 PolarHBondContact O-N 3.12Å; F153-T155 PolarHBondContact O-N 3.36Å; F153-L156 PolarHBondContact O-N 2.82Å; F153-H157 AromaticContact CD1-CE1 3.52Å; F153-H157 AromaticContact CE1-CE1 3.1Å; F153-H157 WeakPolarHBondContact CE1-CE1 3.43Å; F153-H157 AromaticContact CE1-NE2 3.57Å; F153-H157 AromaticContact CE2-CE1 3.69Å; F153-H157 AromaticContact CZ-CE1 3.22Å; F153-H157 WeakPolarHBondContact CZ-CE1 3.44Å; F153-H157 AromaticContact CZ-NE2 3.8Å; F153-H157 PolarHBondContact O-N 2.81Å; F153-H157 PolarHBondContact O-ND1 3.46Å
154	L	52.1	Low	62.7	Low	135 Å²	135	61.4 Å²	61.4	71%	0.707	30%	0.304	S	S	*	.	H	α-helix	trans	-63.6	-40	176.5	-75.2	165	0	0	0	112.4	V152 H157	V152-L154 VanDerWaalsContact C-N 3.26Å; V152-L154 PolarHBondContact O-N 3.27Å; L154-H157 PolarHBondContact O-N 3.31Å
155	T	56.2	Low	61.6	Low	63 Å²	63	58.8 Å²	58.8	39%	0.387	28%	0.283	S	S	.	.	H	α-helix	trans	-70.9	-35.5	178	-41.3	0	0	0	0	111.4	V152 F153 H157 R158	V152-T155 PolarHBondContact O-N 2.78Å; F153-T155 PolarHBondContact O-N 3.36Å; T155-H157 PolarHBondContact O-N 3.15Å; T155-R158 PolarHBondContact O-N 3Å
156	L	56.7	Low	60.7	Low	1 Å²	1	57.8 Å²	57.8	1%	0.005	28%	0.278	C	S	.	.	H	α-helix	trans	-63.5	-23.4	176.1	-70.3	172	0	0	0	113.6	A146 V152 F153 R158 A160 V299	A146-L156 HydrophobicContact CB-CD1 3.38Å; V152-L156 HydrophobicContact CG1-CD1 4.17Å; V152-L156 HydrophobicContact CG1-CG 4.1Å; V152-L156 WeakPolarHBondContact O-CG 3.4Å; V152-L156 PolarHBondContact O-N 3.21Å; F153-L156 PolarHBondContact O-N 2.82Å; L156-R158 VanDerWaalsContact C-N 3.3Å; L156-R158 PolarHBondContact O-N 3.44Å; L156-A160 HydrophobicContact CD2-CB 4.27Å; L156-A160 WeakPolarHBondContact O-CB 3.3Å; L156-A160 PolarHBondContact O-N 3.29Å; L156-V299 HydrophobicContact CD2-CB 3.75Å; L156-V299 HydrophobicContact CD2-CG1 3.27Å; L156-V299 HydrophobicContact CD2-CG2 4.17Å
157	H	52.4	Low	59.4	Low	108 Å²	108	58.1 Å²	58.1	50%	0.5	28%	0.28	S	S	.	.	H	α-helix	trans	-71.8	-25.4	179.3	-79.2	46.1	0	0	0	113	F153 L154 T155	F153-H157 AromaticContact CD1-CE1 3.52Å; F153-H157 AromaticContact CE1-CE1 3.1Å; F153-H157 WeakPolarHBondContact CE1-CE1 3.43Å; F153-H157 AromaticContact CE1-NE2 3.57Å; F153-H157 AromaticContact CE2-CE1 3.69Å; F153-H157 AromaticContact CZ-CE1 3.22Å; F153-H157 WeakPolarHBondContact CZ-CE1 3.44Å; F153-H157 AromaticContact CZ-NE2 3.8Å; F153-H157 PolarHBondContact O-N 2.81Å; F153-H157 PolarHBondContact O-ND1 3.46Å; L154-H157 PolarHBondContact O-N 3.31Å; T155-H157 PolarHBondContact O-N 3.15Å
158	R	50.4	Low	58.1	Low	212 Å²	212	51.3 Å²	51.3	80%	0.8	25%	0.251	S	S	*	.	H	α-helix	trans	-86.3	-36.8	-177.1	-84.8	-175.7	147.5	126.3	-4.4	114	T155 L156	T155-R158 PolarHBondContact O-N 3Å; L156-R158 VanDerWaalsContact C-N 3.3Å; L156-R158 PolarHBondContact O-N 3.44Å
159	F	51.8	Low	56.8	Low	140 Å²	140	50.9 Å²	50.9	61%	0.614	25%	0.25	S	C	*	.	H	α-helix	trans	-152.7	43.9	-168.8	-72.2	-77	0	0	0	114.9	F161 Q303	F159-F161 PolarHBondContact O-N 2.89Å; F159-Q303 PolarHBondContact O-NE2 2.94Å
160	A	54.8	Low	55.3	Low	11 Å²	11	54 Å²	54	9%	0.091	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-78.7	116.7	174.2	0	0	0	0	0	110.7	Q139 L156	Q139-A160 HydrophobicContact CG-CB 3.53Å; Q139-A160 VanDerWaalsContact CG-O 3.26Å; Q139-A160 WeakPolarHBondContact CG-O 3.31Å; Q139-A160 PolarHBondContact NE2-O 3.01Å; L156-A160 HydrophobicContact CD2-CB 4.27Å; L156-A160 WeakPolarHBondContact O-CB 3.3Å; L156-A160 PolarHBondContact O-N 3.29Å
161	F	55.4	Low	54.3	Low	15 Å²	15	51.9 Å²	51.9	7%	0.066	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-90.8	157.3	164.7	36	-96.4	0	0	0	108.9	L93 P96 F159 V163 C302 Q303 L310	L93-F161 HydrophobicContact CD1-CD1 4.32Å; L93-F161 HydrophobicContact CD1-CE1 4.45Å; P96-F161 VanDerWaalsContact CD-CE2 3.45Å; P96-F161 HydrophobicContact CG-CD2 3.99Å; P96-F161 HydrophobicContact CG-CE2 3.65Å; F159-F161 PolarHBondContact O-N 2.89Å; F161-V163 HydrophobicContact CD2-CG2 4.47Å; F161-C302 HydrophobicContact CE2-CB 3.96Å; F161-C302 HydrophobicContact CZ-CB 3.61Å; F161-Q303 HydrophobicContact CE1-CG 3.77Å; F161-Q303 HydrophobicContact CZ-CG 3.93Å; F161-L310 HydrophobicContact CZ-CD1 4.25Å
162	P	56.2	Low	53.9	Low	39 Å²	39	46.3 Å²	46.3	25%	0.253	23%	0.23	S	C	.	.	P	Polyproline II helix	trans	-64.3	157.7	168.5	27.2	-30.2	0	0	0	110.3	S95 F136	S95-P162 WeakPolarHBondContact CA-O 3.35Å; S95-P162 WeakPolarHBondContact CB-O 3.34Å; S95-P162 PolarHBondContact OG-O 3.04Å; F136-P162 HydrophobicContact CD2-CB 4.44Å; F136-P162 HydrophobicContact CE1-CB 4.42Å; F136-P162 HydrophobicContact CE2-CB 3.43Å; F136-P162 VanDerWaalsContact CE2-CB 3.43Å; F136-P162 HydrophobicContact CE2-CG 3.77Å; F136-P162 HydrophobicContact CZ-CB 3.41Å; F136-P162 VanDerWaalsContact CZ-CB 3.41Å; F136-P162 HydrophobicContact CZ-CG 3.74Å
163	V	58	Low	53.8	Low	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	134.7	-177.4	172.4	0	0	0	0	109	P96 I98 V137 L142 F161 I165 V299	P96-V163 HydrophobicContact CG-CG1 4.38Å; P96-V163 HydrophobicContact CG-CG2 4.03Å; I98-V163 HydrophobicContact CD1-CG1 3.37Å; I98-V163 HydrophobicContact CG1-CG1 4.07Å; V137-V163 PolarHBondContact N-O 2.94Å; V137-V163 PolarHBondContact O-N 3.1Å; L142-V163 HydrophobicContact CD1-CB 4.01Å; L142-V163 HydrophobicContact CD1-CG2 3.55Å; L142-V163 HydrophobicContact CD2-CG2 4.5Å; F161-V163 HydrophobicContact CD2-CG2 4.47Å; V163-I165 HydrophobicContact CG1-CD1 4.32Å; V163-I165 HydrophobicContact CG1-CG1 3.7Å; V163-V299 HydrophobicContact CG2-CG2 4.34Å
164	Y	61.7	Low	53.3	Low	2 Å²	2	44 Å²	44	1%	0.008	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	114.1	175.8	-153.9	-76.4	0	0	0	109.2	P96 I98 A134 F136 F166 G390	P96-Y164 PolarHBondContact O-N 3.33Å; P96-Y164 VanDerWaalsContact O-N 3.13Å; I98-Y164 PolarHBondContact N-O 3.37Å; A134-Y164 HydrophobicContact CB-CD1 4.43Å; A134-Y164 HydrophobicContact CB-CE1 3.39Å; F136-Y164 HydrophobicContact CB-CD2 3.91Å; F136-Y164 HydrophobicContact CB-CE2 3.8Å; F136-Y164 AromaticContact CD2-CD2 3.74Å; F136-Y164 HydrophobicContact CD2-CD2 3.74Å; F136-Y164 HydrophobicContact CD2-CE2 4.34Å; F136-Y164 HydrophobicContact CG-CD2 4.31Å; Y164-F166 AromaticContact CD1-CD2 3.75Å; Y164-F166 HydrophobicContact CD1-CD2 3.75Å; Y164-F166 HydrophobicContact CD1-CE1 4.19Å; Y164-F166 AromaticContact CD1-CE2 3.09Å; Y164-F166 HydrophobicContact CD1-CE2 3.09Å; Y164-F166 HydrophobicContact CD1-CG 4.5Å; Y164-F166 AromaticContact CD1-CZ 3.35Å; Y164-F166 HydrophobicContact CD1-CZ 3.35Å; Y164-F166 HydrophobicContact CE1-CD1 4.34Å; Y164-F166 HydrophobicContact CE1-CD2 4.17Å; Y164-F166 AromaticContact CE1-CE1 3.66Å; Y164-F166 HydrophobicContact CE1-CE1 3.66Å; Y164-F166 AromaticContact CE1-CE2 3.46Å; Y164-F166 HydrophobicContact CE1-CE2 3.46Å; Y164-F166 VanDerWaalsContact CE1-CE2 3.46Å; Y164-F166 AromaticContact CE1-CZ 3.15Å; Y164-F166 HydrophobicContact CE1-CZ 3.15Å; Y164-F166 HydrophobicContact CG-CE2 4.17Å; Y164-G390 VanDerWaalsContact CE2-N 3.35Å; Y164-G390 WeakPolarHBondContact OH-CA 3.28Å; Y164-G390 PolarHBondContact OH-N 3.38Å; Y164-G390 VanDerWaalsContact OH-N 3.11Å
165	I	58.5	Low	53.4	Low	4 Å²	4	38.3 Å²	38.3	2%	0.021	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	127.7	-176.3	-45.3	176.9	0	0	0	109.7	I98 V100 L112 I115 T135 V137 V163 M295	I98-I165 HydrophobicContact CB-CG2 4.48Å; I98-I165 CarbonylContact O-C 3.4Å; I98-I165 WeakPolarHBondContact O-CA 3.39Å; V100-I165 HydrophobicContact CG2-CG2 3.62Å; L112-I165 HydrophobicContact CD2-CB 4.07Å; L112-I165 HydrophobicContact CD2-CD1 4.49Å; L112-I165 HydrophobicContact CD2-CG2 3.44Å; L112-I165 VanDerWaalsContact CD2-CG2 3.44Å; I115-I165 HydrophobicContact CD1-CD1 4.01Å; T135-I165 PolarHBondContact N-O 3.18Å; T135-I165 PolarHBondContact O-N 2.83Å; V137-I165 HydrophobicContact CG2-CD1 3.93Å; V137-I165 HydrophobicContact CG2-CG1 4.28Å; V163-I165 HydrophobicContact CG1-CD1 4.32Å; V163-I165 HydrophobicContact CG1-CG1 3.7Å; I165-M295 HydrophobicContact CD1-CE 3.91Å; I165-M295 HydrophobicContact CD1-SD 4.36Å
166	F	59.8	Low	53.3	Low	7 Å²	7	35.5 Å²	35.5	3%	0.031	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	131.1	176.4	-70.9	-91.3	0	0	0	110.4	V97 I98 V100 A134 Y164 T168 L321 I336	V97-F166 HydrophobicContact CB-CE2 4.33Å; V97-F166 HydrophobicContact CG1-CD2 3.68Å; V97-F166 HydrophobicContact CG1-CE2 3.52Å; V97-F166 HydrophobicContact CG2-CE2 4.28Å; I98-F166 PolarHBondContact O-N 3.21Å; V100-F166 PolarHBondContact N-O 3.48Å; A134-F166 HydrophobicContact CB-CD1 3.34Å; A134-F166 HydrophobicContact CB-CE1 3.33Å; A134-F166 HydrophobicContact CB-CG 4.15Å; A134-F166 HydrophobicContact CB-CZ 4.13Å; Y164-F166 AromaticContact CD1-CD2 3.75Å; Y164-F166 HydrophobicContact CD1-CD2 3.75Å; Y164-F166 HydrophobicContact CD1-CE1 4.19Å; Y164-F166 AromaticContact CD1-CE2 3.09Å; Y164-F166 HydrophobicContact CD1-CE2 3.09Å; Y164-F166 HydrophobicContact CD1-CG 4.5Å; Y164-F166 AromaticContact CD1-CZ 3.35Å; Y164-F166 HydrophobicContact CD1-CZ 3.35Å; Y164-F166 HydrophobicContact CE1-CD1 4.34Å; Y164-F166 HydrophobicContact CE1-CD2 4.17Å; Y164-F166 AromaticContact CE1-CE1 3.66Å; Y164-F166 HydrophobicContact CE1-CE1 3.66Å; Y164-F166 AromaticContact CE1-CE2 3.46Å; Y164-F166 HydrophobicContact CE1-CE2 3.46Å; Y164-F166 VanDerWaalsContact CE1-CE2 3.46Å; Y164-F166 AromaticContact CE1-CZ 3.15Å; Y164-F166 HydrophobicContact CE1-CZ 3.15Å; Y164-F166 HydrophobicContact CG-CE2 4.17Å; F166-T168 HydrophobicContact CB-CG2 4.49Å; F166-L321 HydrophobicContact CD1-CD1 4.44Å; F166-L321 HydrophobicContact CE1-CD1 3.89Å; F166-I336 HydrophobicContact CD2-CD1 4.37Å; F166-I336 HydrophobicContact CE1-CD1 3.93Å; F166-I336 HydrophobicContact CE1-CG1 4.35Å; F166-I336 HydrophobicContact CE2-CD1 3.44Å; F166-I336 VanDerWaalsContact CE2-CD1 3.44Å; F166-I336 HydrophobicContact CE2-CG1 4.25Å; F166-I336 HydrophobicContact CZ-CB 4.25Å; F166-I336 HydrophobicContact CZ-CD1 3.18Å; F166-I336 HydrophobicContact CZ-CG1 3.61Å
167	S	52.1	Low	53.2	Low	7 Å²	7	35.5 Å²	35.5	5%	0.049	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	115.5	157.7	61.3	0	0	0	0	107.9	L112 G133	L112-S167 VanDerWaalsContact CD1-CB 3.5Å; G133-S167 WeakPolarHBondContact CA-OG 3.41Å; G133-S167 PolarHBondContact N-OG 3.01Å; G133-S167 PolarHBondContact O-N 3.48Å; G133-S167 PolarHBondContact O-OG 3.46Å
168	T	50	Low	53.8	Low	12 Å²	12	33.9 Å²	33.9	7%	0.074	17%	0.173	C	C	.	.			trans	-98.7	122.7	175.4	49.2	0	0	0	0	109.4	C99 V100 L101 F166 L172	C99-T168 HydrophobicContact CB-CG2 3.72Å; V100-T168 PolarHBondContact O-OG1 3.22Å; V100-T168 VanDerWaalsContact O-OG1 3.07Å; L101-T168 VanDerWaalsContact CD2-OG1 3.25Å; L101-T168 WeakPolarHBondContact CD2-OG1 3.47Å; F166-T168 HydrophobicContact CB-CG2 4.49Å; T168-L172 HydrophobicContact CG2-CB 4.22Å; T168-L172 HydrophobicContact CG2-CD1 4.38Å
169	L	49.6	Very low	54.6	Low	25 Å²	25	25.6 Å²	25.6	13%	0.131	14%	0.144	C	C	.	.			trans	-69.3	166.7	165.4	-128	82.7	0	0	0	111.2	T129 Q130 I132 N171 L172 R173	T129-L169 VanDerWaalsContact C-CD1 3.5Å; T129-L169 HydrophobicContact CG2-CD1 3.61Å; T129-L169 WeakPolarHBondContact O-CD1 3.47Å; Q130-L169 WeakPolarHBondContact O-CD2 3.47Å; I132-L169 HydrophobicContact CG1-CB 4.42Å; L169-N171 PolarHBondContact O-N 2.98Å; L169-L172 PolarHBondContact O-N 3.21Å; L169-R173 PolarHBondContact O-N 3.19Å
170	S	42.9	Very low	55.9	Low	66 Å²	66	19.5 Å²	19.5	46%	0.462	12%	0.119	S	C	.	.	G	3₁₀ helix	trans	-41.9	-47.2	167.4	44	0	0	0	0	112.8	L172 R173	S170-L172 PolarHBondContact O-N 3.31Å; S170-L172 VanDerWaalsContact O-N 3.11Å; S170-R173 PolarHBondContact O-N 3.41Å
171	N	45.1	Very low	57.3	Low	33 Å²	33	19.8 Å²	19.8	18%	0.176	12%	0.119	C	C	.	.	G	3₁₀ helix	trans	-63	-17.3	-179.5	-71.5	-14.7	0	0	0	114.8	L169	L169-N171 PolarHBondContact O-N 2.98Å
172	L	52.4	Low	58.9	Low	10 Å²	10	19 Å²	19	5%	0.052	12%	0.116	C	C	.	.	G	3₁₀ helix	trans	-109.4	2.3	175.9	-92.2	-171.8	0	0	0	113.4	I132 T168 L169 S170 S174 R175 G176 L321	I132-L172 HydrophobicContact CB-CD1 4.1Å; I132-L172 HydrophobicContact CD1-CB 4.4Å; I132-L172 HydrophobicContact CD1-CD1 3.25Å; I132-L172 HydrophobicContact CD1-CD2 4.34Å; I132-L172 HydrophobicContact CD1-CG 3.39Å; I132-L172 HydrophobicContact CG1-CD1 3.52Å; I132-L172 HydrophobicContact CG1-CG 4Å; I132-L172 HydrophobicContact CG2-CD1 3.47Å; I132-L172 VanDerWaalsContact CG2-CD1 3.47Å; T168-L172 HydrophobicContact CG2-CB 4.22Å; T168-L172 HydrophobicContact CG2-CD1 4.38Å; L169-L172 PolarHBondContact O-N 3.21Å; S170-L172 PolarHBondContact O-N 3.31Å; S170-L172 VanDerWaalsContact O-N 3.11Å; L172-S174 CarbonylContact O-C 3.2Å; L172-S174 PolarHBondContact O-N 2.98Å; L172-R175 HydrophobicContact CD2-CB 3.52Å; L172-R175 PolarHBondContact O-N 3.1Å; L172-G176 VanDerWaalsContact O-CA 3.27Å; L172-G176 WeakPolarHBondContact O-CA 3.47Å; L172-G176 PolarHBondContact O-N 3.24Å; L172-L321 HydrophobicContact CD1-CD2 4.45Å
173	R	57	Low	60.4	Low	15 Å²	15	17.2 Å²	17.2	6%	0.057	10%	0.104	C	C	.	.	H	α-helix	trans	-58.6	-38	-179.1	-72.7	-172.2	-179.8	138.8	2.6	112.1	L101 G102 L169 S170 S177 E199 L203	L101-R173 HydrophobicContact CD2-CG 4.06Å; G102-R173 PolarHBondContact O-NH2 3.03Å; L169-R173 PolarHBondContact O-N 3.19Å; S170-R173 PolarHBondContact O-N 3.41Å; R173-S177 WeakPolarHBondContact O-CB 3.13Å; R173-S177 PolarHBondContact O-OG 2.71Å; R173-E199 WeakPolarHBondContact CD-OE1 3.42Å; R173-E199 VanDerWaalsContact NH1-CD 3.32Å; R173-E199 IonicContact NH1-OE1 3.03Å; R173-E199 PolarHBondContact NH1-OE1 3.46Å; R173-E199 VanDerWaalsContact NH1-OE1 3.09Å; R173-E199 IonicContact NH1-OE2 3.63Å; R173-E199 PolarHBondContact NH1-OE2 3.24Å; R173-L203 HydrophobicContact CB-CD1 3.47Å; R173-L203 VanDerWaalsContact CB-CD1 3.47Å
174	S	46	Very low	62.1	Low	18 Å²	18	17.4 Å²	17.4	13%	0.126	11%	0.105	C	C	.	.	H	α-helix	trans	-63	-70.2	169.5	77.8	0	0	0	0	109.1	L172 G176 S177 R207 E452	L172-S174 CarbonylContact O-C 3.2Å; L172-S174 PolarHBondContact O-N 2.98Å; S174-G176 PolarHBondContact O-N 3.49Å; S174-S177 PolarHBondContact O-N 2.74Å; S174-S177 VanDerWaalsContact O-N 3.16Å; S174-S177 PolarHBondContact O-OG 2.65Å; S174-R207 VanDerWaalsContact C-CZ 3.42Å; S174-R207 VanDerWaalsContact C-NH2 3.26Å; S174-R207 PolarHBondContact O-NE 3.34Å; S174-R207 PolarHBondContact O-NH1 3.17Å; S174-R207 PolarHBondContact O-NH2 3.49Å; S174-R207 VanDerWaalsContact O-NH2 3.1Å; S174-E452 VanDerWaalsContact CB-OE2 3.25Å; S174-E452 WeakPolarHBondContact CB-OE2 3.37Å; S174-E452 PolarHBondContact OG-OE2 3.42Å
175	R	55	Low	63.5	Low	17 Å²	17	17.3 Å²	17.3	6%	0.064	11%	0.105	C	C	.	.	H	α-helix	trans	-65.4	-39	-170.8	-73.1	168.2	165.5	-166.8	-23.5	116.6	L172 S177 S178 L179 A403 G404 G449	L172-R175 HydrophobicContact CD2-CB 3.52Å; L172-R175 PolarHBondContact O-N 3.1Å; R175-S177 PolarHBondContact O-N 3.36Å; R175-S178 PolarHBondContact O-N 3.32Å; R175-S178 VanDerWaalsContact O-N 3.13Å; R175-S178 PolarHBondContact O-OG 3.2Å; R175-L179 WeakPolarHBondContact O-CG 3.23Å; R175-L179 PolarHBondContact O-N 3.21Å; R175-L179 VanDerWaalsContact O-N 3.12Å; R175-A403 PolarHBondContact NH1-O 3.24Å; R175-A403 PolarHBondContact NH2-O 3.26Å; R175-G404 VanDerWaalsContact NH1-CA 3.27Å; R175-G404 PolarHBondContact NH2-O 2.71Å; R175-G449 VanDerWaalsContact NH1-N 3.13Å
176	G	54.6	Low	65.2	Low	4 Å²	4	17.1 Å²	17.1	4%	0.041	10%	0.104	C	C	.	.	H	α-helix	trans	-55.5	-39.7	174.6	0	0	0	0	0	111.1	L172 S174 S178 L179 C180	L172-G176 VanDerWaalsContact O-CA 3.27Å; L172-G176 WeakPolarHBondContact O-CA 3.47Å; L172-G176 PolarHBondContact O-N 3.24Å; S174-G176 PolarHBondContact O-N 3.49Å; G176-S178 PolarHBondContact O-N 2.71Å; G176-L179 PolarHBondContact O-N 3.33Å; G176-C180 VanDerWaalsContact O-CB 3.29Å; G176-C180 WeakPolarHBondContact O-CB 3.27Å; G176-C180 PolarHBondContact O-N 3.01Å; G176-C180 VanDerWaalsContact O-N 3.1Å; G176-C180 PolarHBondContact O-SG 3.36Å
177	S	54.4	Low	66.9	Low	0 Å²	0	16.8 Å²	16.8	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-72.7	-20.5	179.1	56.9	0	0	0	0	114.6	R173 S174 R175 R207 T209	R173-S177 WeakPolarHBondContact O-CB 3.13Å; R173-S177 PolarHBondContact O-OG 2.71Å; S174-S177 PolarHBondContact O-N 2.74Å; S174-S177 VanDerWaalsContact O-N 3.16Å; S174-S177 PolarHBondContact O-OG 2.65Å; R175-S177 PolarHBondContact O-N 3.36Å; S177-R207 WeakPolarHBondContact OG-CD 3.2Å; S177-R207 PolarHBondContact OG-NE 2.9Å; S177-R207 VanDerWaalsContact OG-NE 3.13Å; S177-T209 PolarHBondContact O-OG1 3.49Å
178	S	63.3	Low	69	Low	74 Å²	74	16.5 Å²	16.5	52%	0.517	10%	0.1	S	C	.	.	H	α-helix	trans	-83.4	-33.6	169.7	44.2	0	0	0	0	113.7	R175 G176 C180 R207	R175-S178 PolarHBondContact O-N 3.32Å; R175-S178 VanDerWaalsContact O-N 3.13Å; R175-S178 PolarHBondContact O-OG 3.2Å; G176-S178 PolarHBondContact O-N 2.71Å; S178-C180 VanDerWaalsContact C-N 3.32Å; S178-R207 VanDerWaalsContact N-NH1 3.17Å; S178-R207 PolarHBondContact OG-NH1 3Å
179	L	69.2	Low	71.1	Confident	38 Å²	38	16 Å²	16	20%	0.199	10%	0.097	C	C	.	.	H	α-helix	trans	-80.4	-21	-175.5	-69.4	165.6	0	0	0	111.8	V97 R175 G176 T319 L321 I336	V97-L179 WeakPolarHBondContact CG1-O 3.5Å; R175-L179 WeakPolarHBondContact O-CG 3.23Å; R175-L179 PolarHBondContact O-N 3.21Å; R175-L179 VanDerWaalsContact O-N 3.12Å; G176-L179 PolarHBondContact O-N 3.33Å; L179-T319 HydrophobicContact CD1-CG2 4.32Å; L179-L321 HydrophobicContact CD1-CD2 4.23Å; L179-I336 HydrophobicContact CD1-CG2 4.17Å
180	C	77.5	Confident	73.2	Confident	12 Å²	12	16.9 Å²	16.9	8%	0.081	10%	0.101	C	C	.	.			trans	-88.9	141.8	-176.7	-62.2	0	0	0	0	112.8	V97 C99 G176 S178	V97-C180 HydrophobicContact CG1-CB 4.2Å; V97-C180 CarbonylContact O-C 3.59Å; V97-C180 WeakPolarHBondContact O-CA 3.41Å; V97-C180 WeakPolarHBondContact O-CB 3.05Å; C99-C180 HydrophobicContact CB-CB 4.2Å; C99-C180 WeakPolarHBondContact CB-SG 3.36Å; C99-C180 PolarHBondContact N-SG 2.83Å; C99-C180 VanDerWaalsContact N-SG 3.44Å; G176-C180 VanDerWaalsContact O-CB 3.29Å; G176-C180 WeakPolarHBondContact O-CB 3.27Å; G176-C180 PolarHBondContact O-N 3.01Å; G176-C180 VanDerWaalsContact O-N 3.1Å; G176-C180 PolarHBondContact O-SG 3.36Å; S178-C180 VanDerWaalsContact C-N 3.32Å
181	D	85.3	Confident	75.6	Confident	17 Å²	17	18.8 Å²	18.8	9%	0.091	10%	0.102	C	C	.	.	S	Bend	trans	-78.2	-30.5	174	-58.6	-64.6	0	0	0	111.4	R94 P96 V97 P210 L306 L310	R94-D181 IonicContact CZ-OD1 2.6Å; R94-D181 IonicContact CZ-OD2 3.98Å; R94-D181 IonicContact NH1-OD1 2.66Å; R94-D181 IonicContact NH1-OD2 3.45Å; R94-D181 PolarHBondContact NH1-OD2 3.48Å; R94-D181 VanDerWaalsContact NH2-CG 3.3Å; R94-D181 IonicContact NH2-OD1 2.66Å; R94-D181 PolarHBondContact NH2-OD1 3.45Å; R94-D181 IonicContact NH2-OD2 3.68Å; R94-D181 PolarHBondContact NH2-OD2 3.32Å; R94-D181 VanDerWaalsContact NH2-OD2 3.12Å; P96-D181 HydrophobicContact CB-CB 4.48Å; V97-D181 PolarHBondContact N-OD2 2.93Å; V97-D181 PolarHBondContact O-N 3.29Å; D181-P210 VanDerWaalsContact O-CG 3.3Å; D181-P210 WeakPolarHBondContact O-CG 3.47Å; D181-L306 HydrophobicContact CB-CD1 4.33Å; D181-L306 WeakPolarHBondContact O-CD1 3.36Å; D181-L310 HydrophobicContact CB-CD2 4.15Å
182	L	88	Confident	77.8	Confident	0 Å²	0	17.3 Å²	17.3	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	149.1	-177.9	-175	70.6	0	0	0	110	V97 I98 C99 P210 V212 I298 F301 L306	V97-L182 PolarHBondContact O-N 3.09Å; I98-L182 VanDerWaalsContact CA-O 3.28Å; I98-L182 WeakPolarHBondContact CA-O 3.44Å; I98-L182 HydrophobicContact CD1-CD2 4.32Å; I98-L182 HydrophobicContact CG1-CB 4.39Å; C99-L182 PolarHBondContact N-O 3.33Å; C99-L182 VanDerWaalsContact N-O 3.16Å; L182-P210 HydrophobicContact CD1-CB 3.92Å; L182-P210 HydrophobicContact CD1-CG 3.94Å; L182-P210 WeakPolarHBondContact CD1-O 3.39Å; L182-V212 HydrophobicContact CD1-CG2 4.48Å; L182-V212 HydrophobicContact CD2-CG2 4.46Å; L182-I298 HydrophobicContact CD2-CB 4.36Å; L182-I298 HydrophobicContact CD2-CG1 4.21Å; L182-I298 HydrophobicContact CD2-CG2 4.02Å; L182-F301 HydrophobicContact CD1-CD1 3.57Å; L182-F301 HydrophobicContact CD1-CE1 3.76Å; L182-F301 HydrophobicContact CD1-CG 4.24Å; L182-L306 HydrophobicContact CB-CD1 4.22Å
183	A	89.1	Confident	79.7	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	146.6	171.1	0	0	0	0	0	112.4	C99 L101 L204 T209 P210 C211 V212	C99-A183 CarbonylContact O-C 3.57Å; C99-A183 WeakPolarHBondContact O-CA 3.47Å; C99-A183 WeakPolarHBondContact SG-CB 3.26Å; L101-A183 HydrophobicContact CD1-CB 4.19Å; A183-L204 HydrophobicContact CB-CD1 4.09Å; A183-L204 HydrophobicContact CB-CD2 3.35Å; A183-L204 HydrophobicContact CB-CG 4.36Å; A183-T209 HydrophobicContact CB-CG2 4.49Å; A183-P210 PolarHBondContact N-O 2.91Å; A183-C211 HydrophobicContact CB-CB 4.05Å; A183-C211 CarbonylContact O-C 3.59Å; A183-C211 WeakPolarHBondContact O-CA 3.48Å; A183-V212 PolarHBondContact O-N 2.83Å
184	V	91.9	Very high	81.3	Confident	4 Å²	4	19.3 Å²	19.3	2%	0.024	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	109.9	167.4	178.5	0	0	0	0	107.8	I98 C99 V100 L101 V186 V212 A214 L294 I298	I98-V184 HydrophobicContact CG2-CG2 3.75Å; C99-V184 PolarHBondContact O-N 3.38Å; V100-V184 CarbonylContact C-O 3.43Å; V100-V184 WeakPolarHBondContact CA-O 3.34Å; V100-V184 HydrophobicContact CG2-CB 4.39Å; L101-V184 PolarHBondContact N-O 3Å; V184-V186 HydrophobicContact CG1-CG2 4.39Å; V184-V212 CarbonylContact C-O 3.6Å; V184-V212 VanDerWaalsContact CA-O 3.27Å; V184-V212 WeakPolarHBondContact CA-O 3.48Å; V184-A214 HydrophobicContact CG1-CB 3.99Å; V184-L294 HydrophobicContact CG1-CD1 4.27Å; V184-L294 HydrophobicContact CG1-CD2 4.36Å; V184-I298 HydrophobicContact CG2-CD1 3.62Å; V184-I298 HydrophobicContact CG2-CG1 4.17Å
185	L	92.8	Very high	83.1	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	115.6	176.7	-176.3	66.3	0	0	0	109.4	L101 V187 T197 I201 V212 V213 A214 F258	L101-L185 HydrophobicContact CB-CD1 3.98Å; L185-V187 HydrophobicContact CD2-CG2 4.32Å; L185-V187 HydrophobicContact CG-CG2 4.15Å; L185-T197 HydrophobicContact CD1-CG2 4.1Å; L185-T197 HydrophobicContact CD2-CG2 4.05Å; L185-T197 HydrophobicContact CG-CG2 4.24Å; L185-I201 HydrophobicContact CD2-CD1 3.97Å; L185-I201 HydrophobicContact CD2-CG1 3.53Å; L185-V212 PolarHBondContact N-O 3.33Å; L185-V213 HydrophobicContact CB-CG2 4.2Å; L185-V213 HydrophobicContact CD2-CG2 4.31Å; L185-V213 CarbonylContact O-C 3.54Å; L185-V213 VanDerWaalsContact O-CA 3.28Å; L185-V213 WeakPolarHBondContact O-CA 3.4Å; L185-A214 PolarHBondContact O-N 3.08Å; L185-F258 HydrophobicContact CD2-CE1 4.17Å; L185-F258 HydrophobicContact CD2-CZ 4.05Å
186	V	94.3	Very high	84.5	Confident	0 Å²	0	24 Å²	24	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	115.2	-179.5	-172.8	0	0	0	0	109.4	V100 L101 T106 K108 I111 V184 A214 N216	V100-V186 HydrophobicContact CG1-CG2 3.45Å; V100-V186 VanDerWaalsContact CG1-CG2 3.45Å; L101-V186 PolarHBondContact O-N 2.82Å; T106-V186 WeakPolarHBondContact O-CG1 3.33Å; T106-V186 PolarHBondContact OG1-O 3.19Å; K108-V186 HydrophobicContact CG-CB 4.12Å; K108-V186 HydrophobicContact CG-CG2 4.11Å; I111-V186 HydrophobicContact CD1-CB 4.31Å; I111-V186 HydrophobicContact CD1-CG1 3.58Å; I111-V186 HydrophobicContact CD1-CG2 3.69Å; V184-V186 HydrophobicContact CG1-CG2 4.39Å; V186-A214 WeakPolarHBondContact CA-O 3.31Å; V186-A214 HydrophobicContact CG2-CB 4.41Å; V186-N216 HydrophobicContact CG1-CB 3.82Å
187	V	95.3	Very high	86.1	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	131.9	179.7	-179.2	0	0	0	0	108	L185 S192 L193 T197 V213 A214 L215 N216 F258	L185-V187 HydrophobicContact CD2-CG2 4.32Å; L185-V187 HydrophobicContact CG-CG2 4.15Å; V187-S192 VanDerWaalsContact CG1-O 3.3Å; V187-S192 WeakPolarHBondContact CG1-O 3.31Å; V187-L193 HydrophobicContact CG1-CD1 4.25Å; V187-T197 HydrophobicContact CG2-CG2 3.94Å; V187-V213 HydrophobicContact CB-CG1 4.22Å; V187-V213 HydrophobicContact CG2-CG1 3.74Å; V187-A214 PolarHBondContact N-O 2.74Å; V187-L215 HydrophobicContact CB-CD2 4.02Å; V187-L215 HydrophobicContact CG1-CD2 4Å; V187-L215 CarbonylContact O-C 3.6Å; V187-L215 WeakPolarHBondContact O-CA 3.39Å; V187-N216 PolarHBondContact O-N 2.83Å; V187-F258 HydrophobicContact CG2-CZ 4.26Å
188	D	95.4	Very high	87.7	Confident	2 Å²	2	26.1 Å²	26.1	1%	0.011	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	122.3	172.9	-173.8	-12.1	0	0	0	109.1	T106 M190 H191 S192 K217	T106-D188 HydrophobicContact CG2-CB 4.26Å; D188-M190 PolarHBondContact O-N 3.02Å; D188-M190 VanDerWaalsContact O-N 3.16Å; D188-M190 WeakPolarHBondContact OD1-CB 3.41Å; D188-M190 PolarHBondContact OD1-N 3.21Å; D188-H191 HydrophobicContact CB-CB 4.44Å; D188-H191 PolarHBondContact O-N 2.97Å; D188-H191 IonicContact OD2-CE1 3.38Å; D188-H191 IonicContact OD2-ND1 3.25Å; D188-H191 PolarHBondContact OD2-ND1 3.32Å; D188-S192 PolarHBondContact O-N 2.98Å; D188-K217 WeakPolarHBondContact OD2-CD 3.49Å; D188-K217 VanDerWaalsContact OD2-CE 3.32Å; D188-K217 WeakPolarHBondContact OD2-CE 3.34Å; D188-K217 IonicContact OD2-NZ 3.16Å; D188-K217 PolarHBondContact OD2-NZ 3.04Å
189	I	95.2	Very high	88.5	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-21.7	179.3	-164.5	166.2	0	0	0	113	N216 V218 L221 F247 R250	I189-N216 VanDerWaalsContact CG2-O 3.3Å; I189-N216 WeakPolarHBondContact CG2-O 3.45Å; I189-N216 PolarHBondContact N-O 3.45Å; I189-V218 HydrophobicContact CD1-CG1 4.06Å; I189-L221 HydrophobicContact CD1-CD1 4.3Å; I189-F247 HydrophobicContact CD1-CD2 3.74Å; I189-F247 HydrophobicContact CD1-CE2 3.83Å; I189-R250 HydrophobicContact CD1-CB 4.27Å; I189-R250 HydrophobicContact CG1-CB 3.75Å; I189-R250 HydrophobicContact CG1-CG 4.48Å
190	M	93.5	Very high	89.2	Confident	45 Å²	45	24.4 Å²	24.4	22%	0.222	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-30.9	-178.8	-57.9	-56.1	-65.9	0	0	113.4	D188 R220 L221	D188-M190 PolarHBondContact O-N 3.02Å; D188-M190 VanDerWaalsContact O-N 3.16Å; D188-M190 WeakPolarHBondContact OD1-CB 3.41Å; D188-M190 PolarHBondContact OD1-N 3.21Å; M190-R220 HydrophobicContact CG-CB 4.12Å; M190-R220 HydrophobicContact SD-CB 4.17Å; M190-L221 HydrophobicContact SD-CD2 3.93Å
191	H	92	Very high	89.7	Confident	105 Å²	105	24 Å²	24	49%	0.486	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.5	-4.9	-172.8	-60.1	103.4	0	0	0	113.5	D188 E194	D188-H191 HydrophobicContact CB-CB 4.44Å; D188-H191 PolarHBondContact O-N 2.97Å; D188-H191 IonicContact OD2-CE1 3.38Å; D188-H191 IonicContact OD2-ND1 3.25Å; D188-H191 PolarHBondContact OD2-ND1 3.32Å; H191-E194 HydrophobicContact CB-CG 4.37Å
192	S	90.8	Very high	89.7	Confident	2 Å²	2	26.3 Å²	26.3	1%	0.014	14%	0.136	C	C	.	.	B	Isolated β-bridge	trans	57.7	-137.5	179.8	-59.8	0	0	0	0	112.1	V187 D188 E253	V187-S192 VanDerWaalsContact CG1-O 3.3Å; V187-S192 WeakPolarHBondContact CG1-O 3.31Å; D188-S192 PolarHBondContact O-N 2.98Å; S192-E253 VanDerWaalsContact OG-CD 3.31Å; S192-E253 PolarHBondContact OG-OE1 3.38Å
193	L	92.6	Very high	89.2	Confident	22 Å²	22	27.5 Å²	27.5	12%	0.115	14%	0.143	C	C	.	.	S	Bend	trans	-89.4	113.8	-176.8	-87.5	67.2	0	0	0	111.5	V187 T197 I198 I201 V254 H257 F258 Q261	V187-L193 HydrophobicContact CG1-CD1 4.25Å; L193-T197 HydrophobicContact CG-CG2 4.14Å; L193-I198 HydrophobicContact CB-CG1 4.38Å; L193-I201 HydrophobicContact CD2-CD1 3.57Å; L193-I201 HydrophobicContact CG-CD1 4.34Å; L193-V254 HydrophobicContact CD1-CG1 4.31Å; L193-H257 HydrophobicContact CB-CB 4.19Å; L193-H257 HydrophobicContact CD1-CB 3.88Å; L193-H257 HydrophobicContact CD2-CB 4.11Å; L193-H257 HydrophobicContact CG-CB 4.26Å; L193-F258 HydrophobicContact CD1-CD2 3.94Å; L193-F258 HydrophobicContact CD1-CE2 3.73Å; L193-F258 HydrophobicContact CD1-CZ 4.24Å; L193-Q261 HydrophobicContact CD2-CG 4.02Å
194	E	91	Very high	88.9	Confident	45 Å²	45	27.9 Å²	27.9	21%	0.21	15%	0.145	C	C	.	.			trans	-95.6	163.9	174.4	-66.2	176.2	115.7	0	0	112.1	H103 H191 Q196 T197 I198	H103-E194 HydrophobicContact CB-CB 3.89Å; H103-E194 WeakPolarHBondContact CB-OE2 3.26Å; H103-E194 IonicContact CD2-OE1 2.68Å; H103-E194 PolarHBondContact CD2-OE1 2.9Å; H103-E194 IonicContact CD2-OE2 2.68Å; H103-E194 PolarHBondContact CD2-OE2 3.49Å; H103-E194 IonicContact CG-OE2 3.52Å; H103-E194 VanDerWaalsContact CG-OE2 3.22Å; H103-E194 IonicContact NE2-OE1 2.87Å; H103-E194 IonicContact NE2-OE2 3.81Å; H191-E194 HydrophobicContact CB-CG 4.37Å; E194-Q196 VanDerWaalsContact C-N 3.31Å; E194-Q196 PolarHBondContact O-N 3.42Å; E194-Q196 VanDerWaalsContact O-N 3.12Å; E194-T197 WeakPolarHBondContact O-CA 3.47Å; E194-T197 VanDerWaalsContact O-CB 3.26Å; E194-T197 WeakPolarHBondContact O-CB 3.44Å; E194-T197 PolarHBondContact O-N 3.25Å; E194-I198 PolarHBondContact O-N 3.46Å
195	P	84.8	Confident	88.6	Confident	100 Å²	100	31.7 Å²	31.7	65%	0.649	16%	0.161	S	C	*	.	H	α-helix	trans	-53.3	-40.4	-171.9	-30.1	36	0	0	0	115.1	T197 I198 E199	P195-T197 VanDerWaalsContact C-N 3.33Å; P195-T197 PolarHBondContact O-N 3.26Å; P195-I198 WeakPolarHBondContact O-CB 3.31Å; P195-I198 PolarHBondContact O-N 3.43Å; P195-E199 PolarHBondContact O-N 2.93Å
196	Q	82.8	Confident	87.9	Confident	34 Å²	34	38.6 Å²	38.6	16%	0.159	19%	0.193	C	C	.	.	H	α-helix	trans	-73.7	-24.7	177.8	-61.7	-176.8	3.5	0	0	113.5	H103 E194 S200	H103-Q196 HydrophobicContact CB-CB 4.22Å; H103-Q196 VanDerWaalsContact ND1-CB 3.33Å; H103-Q196 WeakPolarHBondContact ND1-CB 3.36Å; H103-Q196 WeakPolarHBondContact ND1-CG 3.14Å; E194-Q196 VanDerWaalsContact C-N 3.31Å; E194-Q196 PolarHBondContact O-N 3.42Å; E194-Q196 VanDerWaalsContact O-N 3.12Å; Q196-S200 WeakPolarHBondContact O-CB 2.79Å; Q196-S200 PolarHBondContact O-N 3.23Å; Q196-S200 PolarHBondContact O-OG 3.03Å
197	T	88.5	Confident	87	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-69.6	-42.7	171.7	-59.1	0	0	0	0	109	H103 L185 V187 L193 E194 P195 S200 I201	H103-T197 WeakPolarHBondContact CB-OG1 3.31Å; H103-T197 PolarHBondContact N-OG1 3.49Å; L185-T197 HydrophobicContact CD1-CG2 4.1Å; L185-T197 HydrophobicContact CD2-CG2 4.05Å; L185-T197 HydrophobicContact CG-CG2 4.24Å; V187-T197 HydrophobicContact CG2-CG2 3.94Å; L193-T197 HydrophobicContact CG-CG2 4.14Å; E194-T197 WeakPolarHBondContact O-CA 3.47Å; E194-T197 VanDerWaalsContact O-CB 3.26Å; E194-T197 WeakPolarHBondContact O-CB 3.44Å; E194-T197 PolarHBondContact O-N 3.25Å; P195-T197 VanDerWaalsContact C-N 3.33Å; P195-T197 PolarHBondContact O-N 3.26Å; T197-S200 WeakPolarHBondContact O-CB 3.5Å; T197-S200 PolarHBondContact O-N 3.5Å; T197-I201 HydrophobicContact CG2-CD1 4.26Å; T197-I201 VanDerWaalsContact O-CG1 3.32Å; T197-I201 WeakPolarHBondContact O-CG1 3.3Å; T197-I201 PolarHBondContact O-N 3.29Å
198	I	88.1	Confident	86.6	Confident	48 Å²	48	51 Å²	51	25%	0.246	25%	0.245	C	C	.	.	H	α-helix	trans	-61.3	-45.8	174	-62	169.1	0	0	0	111	L193 E194 P195 S200 I201 N202	L193-I198 HydrophobicContact CB-CG1 4.38Å; E194-I198 PolarHBondContact O-N 3.46Å; P195-I198 WeakPolarHBondContact O-CB 3.31Å; P195-I198 PolarHBondContact O-N 3.43Å; I198-S200 VanDerWaalsContact C-N 3.31Å; I198-S200 PolarHBondContact O-N 2.97Å; I198-I201 WeakPolarHBondContact O-CB 3.29Å; I198-I201 PolarHBondContact O-N 3.17Å; I198-N202 PolarHBondContact O-N 3.32Å; I198-N202 PolarHBondContact O-ND2 3.26Å
199	E	80.4	Confident	86	Confident	77 Å²	77	51.8 Å²	51.8	36%	0.36	25%	0.249	S	C	.	.	H	α-helix	trans	-55.3	-46.2	172.6	-174.2	-156.5	136.3	0	0	111.5	R173 P195 I201 N202 L203	R173-E199 WeakPolarHBondContact CD-OE1 3.42Å; R173-E199 VanDerWaalsContact NH1-CD 3.32Å; R173-E199 IonicContact NH1-OE1 3.03Å; R173-E199 PolarHBondContact NH1-OE1 3.46Å; R173-E199 VanDerWaalsContact NH1-OE1 3.09Å; R173-E199 IonicContact NH1-OE2 3.63Å; R173-E199 PolarHBondContact NH1-OE2 3.24Å; P195-E199 PolarHBondContact O-N 2.93Å; E199-I201 VanDerWaalsContact C-N 3.35Å; E199-I201 PolarHBondContact O-N 3.15Å; E199-N202 PolarHBondContact O-N 3.02Å; E199-L203 WeakPolarHBondContact O-CG 3.28Å; E199-L203 PolarHBondContact O-N 2.93Å
200	S	84.6	Confident	85.8	Confident	0 Å²	0	53 Å²	53	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-62.9	-40.5	177.7	-59.1	0	0	0	0	112	Q196 T197 I198 L203 L204	Q196-S200 WeakPolarHBondContact O-CB 2.79Å; Q196-S200 PolarHBondContact O-N 3.23Å; Q196-S200 PolarHBondContact O-OG 3.03Å; T197-S200 WeakPolarHBondContact O-CB 3.5Å; T197-S200 PolarHBondContact O-N 3.5Å; I198-S200 VanDerWaalsContact C-N 3.31Å; I198-S200 PolarHBondContact O-N 2.97Å; S200-L203 PolarHBondContact O-N 2.94Å; S200-L204 VanDerWaalsContact O-CG 3.29Å; S200-L204 WeakPolarHBondContact O-CG 3.49Å; S200-L204 PolarHBondContact O-N 2.92Å
201	I	88.2	Confident	85.6	Confident	4 Å²	4	52 Å²	52	2%	0.021	25%	0.254	C	S	.	.	H	α-helix	trans	-60.8	-45.9	174.8	-72.6	165.5	0	0	0	110.6	L185 L193 T197 I198 E199 L203 L204 K205 F258 L263	L185-I201 HydrophobicContact CD2-CD1 3.97Å; L185-I201 HydrophobicContact CD2-CG1 3.53Å; L193-I201 HydrophobicContact CD2-CD1 3.57Å; L193-I201 HydrophobicContact CG-CD1 4.34Å; T197-I201 HydrophobicContact CG2-CD1 4.26Å; T197-I201 VanDerWaalsContact O-CG1 3.32Å; T197-I201 WeakPolarHBondContact O-CG1 3.3Å; T197-I201 PolarHBondContact O-N 3.29Å; I198-I201 WeakPolarHBondContact O-CB 3.29Å; I198-I201 PolarHBondContact O-N 3.17Å; E199-I201 VanDerWaalsContact C-N 3.35Å; E199-I201 PolarHBondContact O-N 3.15Å; I201-L203 VanDerWaalsContact C-N 3.32Å; I201-L203 PolarHBondContact O-N 3.26Å; I201-L204 PolarHBondContact O-N 2.93Å; I201-K205 HydrophobicContact CG2-CD 4.15Å; I201-K205 HydrophobicContact CG2-CG 4.48Å; I201-K205 WeakPolarHBondContact O-CG 3.34Å; I201-K205 PolarHBondContact O-N 3.36Å; I201-F258 HydrophobicContact CD1-CD1 4.21Å; I201-F258 HydrophobicContact CD1-CE1 3.68Å; I201-F258 HydrophobicContact CD1-CZ 4.35Å; I201-F258 HydrophobicContact CG1-CE1 4.31Å; I201-L263 HydrophobicContact CG2-CD1 3.45Å; I201-L263 VanDerWaalsContact CG2-CD1 3.45Å
202	N	83.9	Confident	85.7	Confident	64 Å²	64	47 Å²	47	34%	0.342	23%	0.232	S	C	.	.	H	α-helix	trans	-61.6	-40.9	178.7	-72.1	-25.4	0	0	0	111.7	I198 E199 K205 Q206	I198-N202 PolarHBondContact O-N 3.32Å; I198-N202 PolarHBondContact O-ND2 3.26Å; E199-N202 PolarHBondContact O-N 3.02Å; N202-K205 PolarHBondContact O-N 2.89Å; N202-Q206 WeakPolarHBondContact O-CB 3.45Å; N202-Q206 WeakPolarHBondContact O-CG 3.26Å; N202-Q206 PolarHBondContact O-N 3.29Å
203	L	77.4	Confident	85.9	Confident	26 Å²	26	47 Å²	47	14%	0.136	23%	0.231	C	C	.	.	H	α-helix	trans	-63.6	-43.2	175.3	-69.4	170.4	0	0	0	112.5	R173 E199 S200 I201 K205 Q206 R207	R173-L203 HydrophobicContact CB-CD1 3.47Å; R173-L203 VanDerWaalsContact CB-CD1 3.47Å; E199-L203 WeakPolarHBondContact O-CG 3.28Å; E199-L203 PolarHBondContact O-N 2.93Å; S200-L203 PolarHBondContact O-N 2.94Å; I201-L203 VanDerWaalsContact C-N 3.32Å; I201-L203 PolarHBondContact O-N 3.26Å; L203-K205 VanDerWaalsContact C-N 3.35Å; L203-K205 PolarHBondContact O-N 3.46Å; L203-Q206 PolarHBondContact O-N 2.92Å; L203-R207 WeakPolarHBondContact O-CG 3.47Å; L203-R207 PolarHBondContact O-N 3.2Å
204	L	84.5	Confident	86.1	Confident	8 Å²	8	45.9 Å²	45.9	4%	0.042	23%	0.225	C	C	.	.	H	α-helix	trans	-63.3	-41	177	-69.1	172.3	0	0	0	112	L101 A183 S200 I201 R207 K208 T209 C211	L101-L204 HydrophobicContact CD1-CD1 3.98Å; L101-L204 HydrophobicContact CD1-CD2 3.75Å; L101-L204 HydrophobicContact CD1-CG 3.89Å; A183-L204 HydrophobicContact CB-CD1 4.09Å; A183-L204 HydrophobicContact CB-CD2 3.35Å; A183-L204 HydrophobicContact CB-CG 4.36Å; S200-L204 VanDerWaalsContact O-CG 3.29Å; S200-L204 WeakPolarHBondContact O-CG 3.49Å; S200-L204 PolarHBondContact O-N 2.92Å; I201-L204 PolarHBondContact O-N 2.93Å; L204-R207 PolarHBondContact O-N 2.96Å; L204-K208 WeakPolarHBondContact O-CA 3.35Å; L204-K208 PolarHBondContact O-N 3.34Å; L204-T209 HydrophobicContact CD2-CG2 4.13Å; L204-T209 PolarHBondContact O-N 3.12Å; L204-C211 HydrophobicContact CD1-CB 3.83Å
205	K	85.2	Confident	86.3	Confident	84 Å²	84	43.8 Å²	43.8	37%	0.365	22%	0.215	S	C	.	.	H	α-helix	trans	-64	-48.1	175.5	-75.8	176.4	167.4	-165.7	0	112.8	I201 N202 L203 R207 K208 Q261 L263	I201-K205 HydrophobicContact CG2-CD 4.15Å; I201-K205 HydrophobicContact CG2-CG 4.48Å; I201-K205 WeakPolarHBondContact O-CG 3.34Å; I201-K205 PolarHBondContact O-N 3.36Å; N202-K205 PolarHBondContact O-N 2.89Å; L203-K205 VanDerWaalsContact C-N 3.35Å; L203-K205 PolarHBondContact O-N 3.46Å; K205-R207 PolarHBondContact O-N 3.42Å; K205-K208 PolarHBondContact O-N 2.95Å; K205-K208 VanDerWaalsContact O-N 3.14Å; K205-Q261 PolarHBondContact NZ-O 3.42Å; K205-L263 VanDerWaalsContact CE-CD2 3.49Å; K205-L263 VanDerWaalsContact CE-CG 3.41Å
206	Q	77.5	Confident	86.9	Confident	144 Å²	144	39.1 Å²	39.1	67%	0.673	19%	0.185	S	C	*	.	H	α-helix	trans	-56.2	-37.1	179.1	-76.1	172.3	7	0	0	111.5	N202 L203	N202-Q206 WeakPolarHBondContact O-CB 3.45Å; N202-Q206 WeakPolarHBondContact O-CG 3.26Å; N202-Q206 PolarHBondContact O-N 3.29Å; L203-Q206 PolarHBondContact O-N 2.92Å
207	R	76.2	Confident	87.5	Confident	83 Å²	83	38.7 Å²	38.7	31%	0.313	18%	0.183	S	C	.	.	H	α-helix	trans	-94.6	-4.9	-178.1	-60.4	-169.5	-169.9	-140.2	-9.5	114.6	S174 S177 S178 L203 L204 K205 T209	S174-R207 VanDerWaalsContact C-CZ 3.42Å; S174-R207 VanDerWaalsContact C-NH2 3.26Å; S174-R207 PolarHBondContact O-NE 3.34Å; S174-R207 PolarHBondContact O-NH1 3.17Å; S174-R207 PolarHBondContact O-NH2 3.49Å; S174-R207 VanDerWaalsContact O-NH2 3.1Å; S177-R207 WeakPolarHBondContact OG-CD 3.2Å; S177-R207 PolarHBondContact OG-NE 2.9Å; S177-R207 VanDerWaalsContact OG-NE 3.13Å; S178-R207 VanDerWaalsContact N-NH1 3.17Å; S178-R207 PolarHBondContact OG-NH1 3Å; L203-R207 WeakPolarHBondContact O-CG 3.47Å; L203-R207 PolarHBondContact O-N 3.2Å; L204-R207 PolarHBondContact O-N 2.96Å; K205-R207 PolarHBondContact O-N 3.42Å; R207-T209 PolarHBondContact O-N 3.22Å
208	K	85.3	Confident	87.8	Confident	179 Å²	179	38.7 Å²	38.7	78%	0.778	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.1	38.7	-174.3	-56.6	178.9	176.3	-178.4	0	111.8	L204 K205	L204-K208 WeakPolarHBondContact O-CA 3.35Å; L204-K208 PolarHBondContact O-N 3.34Å; K205-K208 PolarHBondContact O-N 2.95Å; K205-K208 VanDerWaalsContact O-N 3.14Å
209	T	84.1	Confident	88.1	Confident	17 Å²	17	38.5 Å²	38.5	10%	0.104	18%	0.182	C	C	.	.			trans	-85.2	122.6	177.9	-53.3	0	0	0	0	108	S177 A183 L204 R207	S177-T209 PolarHBondContact O-OG1 3.49Å; A183-T209 HydrophobicContact CB-CG2 4.49Å; L204-T209 HydrophobicContact CD2-CG2 4.13Å; L204-T209 PolarHBondContact O-N 3.12Å; R207-T209 PolarHBondContact O-N 3.22Å
210	P	89.8	Confident	88.7	Confident	27 Å²	27	41.9 Å²	41.9	18%	0.175	19%	0.192	C	C	.	.			trans	-64.1	151.1	178.3	26.3	-32.1	0	0	0	110.3	D181 L182 A183 F301 L306	D181-P210 VanDerWaalsContact O-CG 3.3Å; D181-P210 WeakPolarHBondContact O-CG 3.47Å; L182-P210 HydrophobicContact CD1-CB 3.92Å; L182-P210 HydrophobicContact CD1-CG 3.94Å; L182-P210 WeakPolarHBondContact CD1-O 3.39Å; A183-P210 PolarHBondContact N-O 2.91Å; P210-F301 HydrophobicContact CB-CE1 3.41Å; P210-F301 VanDerWaalsContact CB-CE1 3.41Å; P210-F301 HydrophobicContact CB-CZ 3.39Å; P210-F301 HydrophobicContact CG-CE1 3.74Å; P210-F301 HydrophobicContact CG-CZ 4.2Å; P210-L306 HydrophobicContact CG-CD1 4.37Å; P210-L306 HydrophobicContact CG-CD2 4.23Å
211	C	90.7	Very high	89.1	Confident	22 Å²	22	42.1 Å²	42.1	15%	0.149	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	151.1	179.6	73	0	0	0	0	113.6	A183 L204	A183-C211 HydrophobicContact CB-CB 4.05Å; A183-C211 CarbonylContact O-C 3.59Å; A183-C211 WeakPolarHBondContact O-CA 3.48Å; L204-C211 HydrophobicContact CD1-CB 3.83Å
212	V	93	Very high	89.3	Confident	2 Å²	2	49.6 Å²	49.6	1%	0.012	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	135.6	168	178	0	0	0	0	107.2	L182 A183 V184 L185 V281 L294 A297	L182-V212 HydrophobicContact CD1-CG2 4.48Å; L182-V212 HydrophobicContact CD2-CG2 4.46Å; A183-V212 PolarHBondContact O-N 2.83Å; V184-V212 CarbonylContact C-O 3.6Å; V184-V212 VanDerWaalsContact CA-O 3.27Å; V184-V212 WeakPolarHBondContact CA-O 3.48Å; L185-V212 PolarHBondContact N-O 3.33Å; V212-V281 HydrophobicContact CG1-CG2 3.83Å; V212-L294 HydrophobicContact CG1-CD1 4Å; V212-A297 HydrophobicContact CG1-CB 4.47Å
213	V	95.2	Very high	89.6	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	123.3	-178.4	175.7	0	0	0	0	109.3	L185 V187 L215 F258 I278 S279 L280 V281	L185-V213 HydrophobicContact CB-CG2 4.2Å; L185-V213 HydrophobicContact CD2-CG2 4.31Å; L185-V213 CarbonylContact O-C 3.54Å; L185-V213 VanDerWaalsContact O-CA 3.28Å; L185-V213 WeakPolarHBondContact O-CA 3.4Å; V187-V213 HydrophobicContact CB-CG1 4.22Å; V187-V213 HydrophobicContact CG2-CG1 3.74Å; V213-L215 HydrophobicContact CG1-CG 4.41Å; V213-F258 HydrophobicContact CG1-CE2 4.3Å; V213-F258 HydrophobicContact CG1-CZ 4.12Å; V213-F258 HydrophobicContact CG2-CE1 4.17Å; V213-F258 HydrophobicContact CG2-CE2 4.39Å; V213-F258 HydrophobicContact CG2-CZ 3.65Å; V213-I278 HydrophobicContact CB-CG2 4.36Å; V213-I278 HydrophobicContact CG2-CG2 3.46Å; V213-I278 VanDerWaalsContact CG2-CG2 3.46Å; V213-S279 PolarHBondContact N-O 3.08Å; V213-L280 HydrophobicContact CB-CD2 3.55Å; V213-L280 HydrophobicContact CG1-CD2 3.61Å; V213-L280 HydrophobicContact CG2-CD2 3.98Å; V213-V281 PolarHBondContact O-N 3.31Å
214	A	96.2	Very high	90.4	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	106.3	168.9	0	0	0	0	0	108.8	I111 V184 L185 V186 V187 N216 V281 T283 L294	I111-A214 HydrophobicContact CD1-CB 4.31Å; V184-A214 HydrophobicContact CG1-CB 3.99Å; L185-A214 PolarHBondContact O-N 3.08Å; V186-A214 WeakPolarHBondContact CA-O 3.31Å; V186-A214 HydrophobicContact CG2-CB 4.41Å; V187-A214 PolarHBondContact N-O 2.74Å; A214-N216 PolarHBondContact O-N 2.95Å; A214-N216 VanDerWaalsContact O-N 3.14Å; A214-V281 CarbonylContact C-O 3.57Å; A214-V281 WeakPolarHBondContact CA-O 3.36Å; A214-T283 HydrophobicContact CB-CG2 4.49Å; A214-L294 HydrophobicContact CB-CD1 4.15Å; A214-L294 HydrophobicContact CB-CD2 3.98Å
215	L	96.3	Very high	90.8	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	89.2	172.1	-81.2	172.4	0	0	0	109.2	V187 V213 V251 V254 L280 V281 P282 T283	V187-L215 HydrophobicContact CB-CD2 4.02Å; V187-L215 HydrophobicContact CG1-CD2 4Å; V187-L215 CarbonylContact O-C 3.6Å; V187-L215 WeakPolarHBondContact O-CA 3.39Å; V213-L215 HydrophobicContact CG1-CG 4.41Å; L215-V251 HydrophobicContact CD1-CG2 4.29Å; L215-V254 HydrophobicContact CD2-CB 4.37Å; L215-V254 HydrophobicContact CD2-CG1 3.8Å; L215-V254 HydrophobicContact CD2-CG2 4.01Å; L215-L280 HydrophobicContact CD1-CB 3.83Å; L215-L280 HydrophobicContact CD1-CD1 4.15Å; L215-L280 HydrophobicContact CD1-CG 4.39Å; L215-L280 HydrophobicContact CG-CB 4.49Å; L215-V281 PolarHBondContact N-O 2.98Å; L215-P282 CarbonylContact O-C 3.59Å; L215-P282 WeakPolarHBondContact O-CA 3.39Å; L215-T283 PolarHBondContact O-N 3.4Å; L215-T283 PolarHBondContact O-OG1 3.49Å
216	N	96.8	Very high	90.9	Very high	3 Å²	3	53.5 Å²	53.5	2%	0.016	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	166	-171.6	-165	24.8	0	0	0	112.4	T106 I111 V186 V187 I189 A214 T283 A285	T106-N216 PolarHBondContact O-ND2 2.99Å; I111-N216 HydrophobicContact CD1-CB 4.33Å; V186-N216 HydrophobicContact CG1-CB 3.82Å; V187-N216 PolarHBondContact O-N 2.83Å; I189-N216 VanDerWaalsContact CG2-O 3.3Å; I189-N216 WeakPolarHBondContact CG2-O 3.45Å; I189-N216 PolarHBondContact N-O 3.45Å; A214-N216 PolarHBondContact O-N 2.95Å; A214-N216 VanDerWaalsContact O-N 3.14Å; N216-T283 CarbonylContact C-O 3.57Å; N216-T283 VanDerWaalsContact CA-O 3.23Å; N216-T283 WeakPolarHBondContact CA-O 3.5Å; N216-T283 PolarHBondContact OD1-O 3.23Å; N216-A285 WeakPolarHBondContact OD1-CB 3.47Å; N216-A285 PolarHBondContact OD1-N 3.49Å
217	K	95.6	Very high	91.5	Very high	24 Å²	24	49 Å²	49	10%	0.104	23%	0.229	C	C	.	.			trans	68.3	31.2	176.7	-48.9	-168.9	-164.4	162.5	0	115.3	D105 D188 D219 R220 T283	D105-K217 WeakPolarHBondContact O-CE 3.46Å; D105-K217 PolarHBondContact O-NZ 3.05Å; D188-K217 WeakPolarHBondContact OD2-CD 3.49Å; D188-K217 VanDerWaalsContact OD2-CE 3.32Å; D188-K217 WeakPolarHBondContact OD2-CE 3.34Å; D188-K217 IonicContact OD2-NZ 3.16Å; D188-K217 PolarHBondContact OD2-NZ 3.04Å; K217-D219 WeakPolarHBondContact CA-OD1 3.48Å; K217-D219 PolarHBondContact O-N 3.36Å; K217-D219 VanDerWaalsContact O-N 3.1Å; K217-R220 HydrophobicContact CB-CG 4.23Å; K217-R220 WeakPolarHBondContact O-CB 3.39Å; K217-R220 PolarHBondContact O-N 3.45Å; K217-T283 PolarHBondContact N-O 3.27Å; K217-T283 VanDerWaalsContact N-O 3.07Å
218	V	94.9	Very high	91.8	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-58.5	-23.3	171.7	-58.7	0	0	0	0	113	I189 R220 L221 W224 F247 P282 T283 D289	I189-V218 HydrophobicContact CD1-CG1 4.06Å; V218-R220 PolarHBondContact O-N 2.94Å; V218-L221 HydrophobicContact CB-CD1 4.42Å; V218-L221 WeakPolarHBondContact O-CB 3.36Å; V218-L221 WeakPolarHBondContact O-CG 3.41Å; V218-L221 PolarHBondContact O-N 2.94Å; V218-W224 HydrophobicContact CB-CH2 4.5Å; V218-W224 HydrophobicContact CB-CZ2 4.19Å; V218-W224 HydrophobicContact CG2-CZ2 3.9Å; V218-W224 VanDerWaalsContact O-CG 3.26Å; V218-F247 HydrophobicContact CG1-CE2 4.3Å; V218-P282 HydrophobicContact CG1-CB 3.87Å; V218-T283 PolarHBondContact N-O 3.32Å; V218-D289 HydrophobicContact CG2-CB 4.45Å
219	D	94.1	Very high	91.8	Very high	45 Å²	45	45.7 Å²	45.7	24%	0.241	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-66.6	-12.6	174.3	59.3	-69.3	0	0	0	114.4	K217 S284 T287	K217-D219 WeakPolarHBondContact CA-OD1 3.48Å; K217-D219 PolarHBondContact O-N 3.36Å; K217-D219 VanDerWaalsContact O-N 3.1Å; D219-S284 WeakPolarHBondContact CB-OG 3.25Å; D219-S284 VanDerWaalsContact OD1-CB 3.24Å; D219-S284 WeakPolarHBondContact OD1-CB 3.38Å; D219-S284 PolarHBondContact OD1-OG 2.85Å; D219-T287 HydrophobicContact CB-CG2 3.8Å
220	R	93.9	Very high	91.9	Very high	148 Å²	148	48.4 Å²	48.4	56%	0.558	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-89.6	-8.8	175.9	-68.3	-169.1	170.9	-166.2	-5.1	114.1	M190 K217 V218	M190-R220 HydrophobicContact CG-CB 4.12Å; M190-R220 HydrophobicContact SD-CB 4.17Å; K217-R220 HydrophobicContact CB-CG 4.23Å; K217-R220 WeakPolarHBondContact O-CB 3.39Å; K217-R220 PolarHBondContact O-N 3.45Å; V218-R220 PolarHBondContact O-N 2.94Å
221	L	93.5	Very high	91.8	Very high	4 Å²	4	47.3 Å²	47.3	2%	0.021	23%	0.232	C	C	.	.	S	Bend	trans	-63.8	142.9	173.2	-62.1	171.7	0	0	0	109.5	I189 M190 V218 D223 W224 E246 F247 R250	I189-L221 HydrophobicContact CD1-CD1 4.3Å; M190-L221 HydrophobicContact SD-CD2 3.93Å; V218-L221 HydrophobicContact CB-CD1 4.42Å; V218-L221 WeakPolarHBondContact O-CB 3.36Å; V218-L221 WeakPolarHBondContact O-CG 3.41Å; V218-L221 PolarHBondContact O-N 2.94Å; L221-D223 PolarHBondContact O-N 2.96Å; L221-W224 HydrophobicContact CB-CB 4.2Å; L221-W224 HydrophobicContact CB-CE3 4.39Å; L221-W224 HydrophobicContact CD1-CE3 3.88Å; L221-W224 HydrophobicContact CD1-CZ3 4.11Å; L221-W224 WeakPolarHBondContact O-CB 3.49Å; L221-W224 PolarHBondContact O-N 3.15Å; L221-W224 VanDerWaalsContact O-N 3.13Å; L221-E246 HydrophobicContact CD2-CG 3.96Å; L221-F247 HydrophobicContact CD1-CB 3.84Å; L221-F247 HydrophobicContact CD1-CD2 3.84Å; L221-F247 HydrophobicContact CD1-CG 4.34Å; L221-R250 HydrophobicContact CD2-CG 4.25Å
222	Y	91.8	Very high	91.8	Very high	161 Å²	161	46.3 Å²	46.3	63%	0.631	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.2	134.4	-174.6	-174.5	-96.5	0	0	0	110.2	W224 A243 E246	Y222-W224 PolarHBondContact O-N 3.4Å; Y222-A243 WeakPolarHBondContact O-CB 3.49Å; Y222-E246 PolarHBondContact N-OE2 2.95Å
223	D	90.7	Very high	91.8	Very high	67 Å²	67	49.1 Å²	49.1	36%	0.358	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.1	18.7	-174.7	-68.8	-30.9	0	0	0	116.1	L221 K225	L221-D223 PolarHBondContact O-N 2.96Å; D223-K225 PolarHBondContact O-N 3.19Å
224	W	93.2	Very high	91.5	Very high	26 Å²	26	53.5 Å²	53.5	10%	0.098	26%	0.256	C	S	.	.			trans	-65.9	123.5	176.1	-172.1	-90.5	0	0	0	112.5	V218 L221 Y222 I232 T235 L236 Q239 F247 D289	V218-W224 HydrophobicContact CB-CH2 4.5Å; V218-W224 HydrophobicContact CB-CZ2 4.19Å; V218-W224 HydrophobicContact CG2-CZ2 3.9Å; V218-W224 VanDerWaalsContact O-CG 3.26Å; L221-W224 HydrophobicContact CB-CB 4.2Å; L221-W224 HydrophobicContact CB-CE3 4.39Å; L221-W224 HydrophobicContact CD1-CE3 3.88Å; L221-W224 HydrophobicContact CD1-CZ3 4.11Å; L221-W224 WeakPolarHBondContact O-CB 3.49Å; L221-W224 PolarHBondContact O-N 3.15Å; L221-W224 VanDerWaalsContact O-N 3.13Å; Y222-W224 PolarHBondContact O-N 3.4Å; W224-I232 HydrophobicContact CH2-CD1 4.47Å; W224-I232 HydrophobicContact CZ2-CD1 4.02Å; W224-T235 HydrophobicContact CZ2-CG2 3.99Å; W224-L236 HydrophobicContact CH2-CD1 3.96Å; W224-L236 HydrophobicContact CZ3-CD1 3.9Å; W224-Q239 HydrophobicContact CD2-CG 4.39Å; W224-Q239 HydrophobicContact CE3-CG 3.9Å; W224-Q239 HydrophobicContact CH2-CG 4.17Å; W224-Q239 HydrophobicContact CZ3-CG 3.78Å; W224-F247 HydrophobicContact CZ3-CB 4.47Å; W224-F247 HydrophobicContact CZ3-CD2 4.38Å; W224-F247 HydrophobicContact CZ3-CG 4.5Å; W224-D289 PolarHBondContact NE1-OD2 3.45Å
225	K	92.2	Very high	91.3	Very high	133 Å²	133	53.6 Å²	53.6	58%	0.578	26%	0.256	S	S	*	.			trans	-106.5	95.1	176.4	-66.3	-176.9	-176.7	178.2	0	110.6	D223 Q239	D223-K225 PolarHBondContact O-N 3.19Å; K225-Q239 PolarHBondContact O-NE2 3.4Å
226	G	88.7	Confident	91.1	Very high	39 Å²	39	54.7 Å²	54.7	40%	0.402	26%	0.262	S	S	.	.			trans	-71.7	154.2	-177.8	0	0	0	0	0	115	D289	G226-D289 WeakPolarHBondContact CA-OD2 3.48Å
227	N	89	Confident	90.9	Very high	50 Å²	50	63.2 Å²	63.2	27%	0.267	30%	0.299	S	S	.	.			trans	-151.8	100.6	170.9	-168.5	-30.5	0	0	0	110.8	N229 K230 D289	N227-N229 PolarHBondContact O-N 3.41Å; N227-N229 VanDerWaalsContact O-N 3.09Å; N227-N229 PolarHBondContact OD1-N 2.81Å; N227-K230 HydrophobicContact CB-CD 4.42Å; N227-K230 HydrophobicContact CB-CG 4.47Å; N227-K230 PolarHBondContact O-N 3Å; N227-D289 WeakPolarHBondContact CA-OD1 3.48Å; N227-D289 PolarHBondContact N-OD1 3.01Å; N227-D289 PolarHBondContact N-OD2 3.12Å
228	P	84	Confident	90.7	Very high	56 Å²	56	67.2 Å²	67.2	36%	0.364	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-7.1	-172.8	29.1	-36.7	0	0	0	114	M148 T287 D289	M148-P228 WeakPolarHBondContact CE-O 3.47Å; P228-T287 WeakPolarHBondContact CB-O 2.84Å; P228-D289 VanDerWaalsContact N-OD1 3.14Å
229	N	84.7	Confident	90.6	Very high	135 Å²	135	68.1 Å²	68.1	72%	0.722	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	-3.6	179.3	-64.6	-41.1	0	0	0	112.9	N227	N227-N229 PolarHBondContact O-N 3.41Å; N227-N229 VanDerWaalsContact O-N 3.09Å; N227-N229 PolarHBondContact OD1-N 2.81Å
230	K	85.7	Confident	90.5	Very high	75 Å²	75	70.4 Å²	70.4	33%	0.326	33%	0.334	S	S	.	.	S	Bend	trans	-111.9	149.6	-179.8	-67.1	-174	-178.9	-177.9	0	111.3	M148 N227 I232 Q234 L238	M148-K230 WeakPolarHBondContact CE-O 3.3Å; N227-K230 HydrophobicContact CB-CD 4.42Å; N227-K230 HydrophobicContact CB-CG 4.47Å; N227-K230 PolarHBondContact O-N 3Å; K230-I232 PolarHBondContact O-N 3.02Å; K230-Q234 HydrophobicContact CB-CB 4.41Å; K230-L238 HydrophobicContact CD-CD1 4Å; K230-L238 VanDerWaalsContact NZ-CD1 3.31Å
231	D	88.7	Confident	90.4	Very high	3 Å²	3	67.1 Å²	67.1	2%	0.016	33%	0.334	C	S	.	.			trans	-54.3	135.7	168.2	-175.9	-24	0	0	0	109.2	R233 Q234 T235 N293	D231-R233 PolarHBondContact O-N 3.47Å; D231-R233 PolarHBondContact OD1-N 3.44Å; D231-R233 IonicContact OD1-NE 3.73Å; D231-R233 IonicContact OD2-CZ 3.38Å; D231-R233 VanDerWaalsContact OD2-CZ 3.28Å; D231-R233 IonicContact OD2-NE 2.76Å; D231-R233 PolarHBondContact OD2-NE 3.48Å; D231-R233 IonicContact OD2-NH2 3.12Å; D231-R233 PolarHBondContact OD2-NH2 3.24Å; D231-Q234 HydrophobicContact CB-CG 4.21Å; D231-Q234 WeakPolarHBondContact O-CA 3.28Å; D231-Q234 WeakPolarHBondContact O-CB 3.49Å; D231-Q234 PolarHBondContact O-N 3.28Å; D231-T235 PolarHBondContact O-N 2.96Å; D231-T235 PolarHBondContact O-OG1 3.43Å; D231-N293 PolarHBondContact OD1-ND2 2.97Å
232	I	90.7	Very high	90.4	Very high	1 Å²	1	71.6 Å²	71.6	1%	0.005	36%	0.358	C	S	.	.	H	α-helix	trans	-52.6	-31.8	178	-168.1	63.3	0	0	0	112.7	W224 K230 Q234 T235 L236 F268 W269 P282 D289 N293	W224-I232 HydrophobicContact CH2-CD1 4.47Å; W224-I232 HydrophobicContact CZ2-CD1 4.02Å; K230-I232 PolarHBondContact O-N 3.02Å; I232-Q234 VanDerWaalsContact C-N 3.31Å; I232-Q234 PolarHBondContact O-N 2.95Å; I232-T235 PolarHBondContact O-N 3.17Å; I232-L236 WeakPolarHBondContact O-CB 3.25Å; I232-L236 PolarHBondContact O-N 3.38Å; I232-F268 HydrophobicContact CG2-CE1 3.75Å; I232-F268 HydrophobicContact CG2-CZ 3.95Å; I232-W269 HydrophobicContact CG2-CE3 4.48Å; I232-W269 HydrophobicContact CG2-CZ3 3.84Å; I232-P282 HydrophobicContact CD1-CB 4.47Å; I232-P282 HydrophobicContact CG1-CB 4.01Å; I232-P282 HydrophobicContact CG1-CG 4.39Å; I232-D289 HydrophobicContact CD1-CB 4.21Å; I232-N293 HydrophobicContact CG2-CB 4.26Å; I232-N293 PolarHBondContact N-OD1 3.13Å; I232-N293 VanDerWaalsContact N-OD1 3.15Å
233	R	91.1	Very high	90.4	Very high	61 Å²	61	63.9 Å²	63.9	23%	0.23	33%	0.328	C	S	.	.	H	α-helix	trans	-62.4	-38.4	174.3	-64.8	-179.2	-67.3	-177	-4.8	112.2	E151 D231 K237 W269	E151-R233 IonicContact OE1-NH1 3.49Å; E151-R233 IonicContact OE2-CZ 2.73Å; E151-R233 VanDerWaalsContact OE2-CZ 3.24Å; E151-R233 IonicContact OE2-NH1 3.25Å; E151-R233 PolarHBondContact OE2-NH1 3.09Å; E151-R233 IonicContact OE2-NH2 3.88Å; E151-R233 PolarHBondContact OE2-NH2 3.21Å; D231-R233 PolarHBondContact O-N 3.47Å; D231-R233 PolarHBondContact OD1-N 3.44Å; D231-R233 IonicContact OD1-NE 3.73Å; D231-R233 IonicContact OD2-CZ 3.38Å; D231-R233 VanDerWaalsContact OD2-CZ 3.28Å; D231-R233 IonicContact OD2-NE 2.76Å; D231-R233 PolarHBondContact OD2-NE 3.48Å; D231-R233 IonicContact OD2-NH2 3.12Å; D231-R233 PolarHBondContact OD2-NH2 3.24Å; R233-K237 WeakPolarHBondContact O-CG 3.39Å; R233-K237 PolarHBondContact O-N 3.36Å; R233-W269 HydrophobicContact CG-CD2 3.95Å; R233-W269 HydrophobicContact CG-CE3 3.63Å; R233-W269 HydrophobicContact CG-CG 4.35Å; R233-W269 HydrophobicContact CG-CZ3 4.12Å
234	Q	90.7	Very high	90.6	Very high	93 Å²	93	61.8 Å²	61.8	44%	0.435	32%	0.318	S	S	.	.	H	α-helix	trans	-75.1	-40.9	176.6	-63.9	178.7	-4	0	0	110.8	K230 D231 I232 L236 K237 L238	K230-Q234 HydrophobicContact CB-CB 4.41Å; D231-Q234 HydrophobicContact CB-CG 4.21Å; D231-Q234 WeakPolarHBondContact O-CA 3.28Å; D231-Q234 WeakPolarHBondContact O-CB 3.49Å; D231-Q234 PolarHBondContact O-N 3.28Å; I232-Q234 VanDerWaalsContact C-N 3.31Å; I232-Q234 PolarHBondContact O-N 2.95Å; Q234-L236 VanDerWaalsContact C-N 3.3Å; Q234-L236 PolarHBondContact O-N 3.19Å; Q234-K237 PolarHBondContact O-N 3.31Å; Q234-L238 WeakPolarHBondContact O-CG 3.44Å; Q234-L238 PolarHBondContact O-N 2.83Å
235	T	91.6	Very high	90.6	Very high	2 Å²	2	64.8 Å²	64.8	1%	0.012	34%	0.335	C	S	.	.	H	α-helix	trans	-59.8	-42.2	175.6	-57.9	0	0	0	0	110.9	W224 D231 I232 L238 Q239	W224-T235 HydrophobicContact CZ2-CG2 3.99Å; D231-T235 PolarHBondContact O-N 2.96Å; D231-T235 PolarHBondContact O-OG1 3.43Å; I232-T235 PolarHBondContact O-N 3.17Å; T235-L238 PolarHBondContact O-N 3.23Å; T235-Q239 WeakPolarHBondContact O-CG 3.34Å; T235-Q239 PolarHBondContact O-N 3.15Å; T235-Q239 PolarHBondContact O-NE2 3.21Å
236	L	91.9	Very high	90.7	Very high	23 Å²	23	60.5 Å²	60.5	12%	0.12	32%	0.317	C	S	.	.	H	α-helix	trans	-63.4	-40.4	176.2	-173.3	64.4	0	0	0	112.5	W224 I232 Q234 L238 Q239 T244 F247 W269	W224-L236 HydrophobicContact CH2-CD1 3.96Å; W224-L236 HydrophobicContact CZ3-CD1 3.9Å; I232-L236 WeakPolarHBondContact O-CB 3.25Å; I232-L236 PolarHBondContact O-N 3.38Å; Q234-L236 VanDerWaalsContact C-N 3.3Å; Q234-L236 PolarHBondContact O-N 3.19Å; L236-L238 PolarHBondContact O-N 3.39Å; L236-Q239 WeakPolarHBondContact O-CB 3.28Å; L236-Q239 PolarHBondContact O-N 2.91Å; L236-T244 HydrophobicContact CD1-CG2 4.4Å; L236-F247 HydrophobicContact CD1-CB 4.32Å; L236-F247 HydrophobicContact CD1-CD1 3.58Å; L236-F247 HydrophobicContact CD1-CE1 4.07Å; L236-F247 HydrophobicContact CD1-CG 3.93Å; L236-F247 HydrophobicContact CD2-CD1 3.93Å; L236-F247 HydrophobicContact CD2-CE1 3.7Å; L236-F247 HydrophobicContact CG-CD1 4.44Å; L236-W269 HydrophobicContact CD2-CZ2 4.41Å
237	K	91.7	Very high	91.1	Very high	181 Å²	181	58.8 Å²	58.8	79%	0.787	30%	0.298	S	S	*	.	H	α-helix	trans	-65	-24.5	176.3	-75.2	176.6	-177.9	-176.5	0	113.8	R233 Q234	R233-K237 WeakPolarHBondContact O-CG 3.39Å; R233-K237 PolarHBondContact O-N 3.36Å; Q234-K237 PolarHBondContact O-N 3.31Å
238	L	92.7	Very high	91.4	Very high	109 Å²	109	64 Å²	64	57%	0.571	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	-7.2	179.7	-67.3	170.6	0	0	0	113	K230 Q234 T235 L236	K230-L238 HydrophobicContact CD-CD1 4Å; K230-L238 VanDerWaalsContact NZ-CD1 3.31Å; Q234-L238 WeakPolarHBondContact O-CG 3.44Å; Q234-L238 PolarHBondContact O-N 2.83Å; T235-L238 PolarHBondContact O-N 3.23Å; L236-L238 PolarHBondContact O-N 3.39Å
239	Q	91.9	Very high	91.9	Very high	19 Å²	19	66.5 Å²	66.5	9%	0.089	32%	0.321	C	S	.	.	S	Bend	trans	-71.4	157.7	178.3	-61.4	-48	-45.2	0	0	111.8	W224 K225 T235 L236 A243	W224-Q239 HydrophobicContact CD2-CG 4.39Å; W224-Q239 HydrophobicContact CE3-CG 3.9Å; W224-Q239 HydrophobicContact CH2-CG 4.17Å; W224-Q239 HydrophobicContact CZ3-CG 3.78Å; K225-Q239 PolarHBondContact O-NE2 3.4Å; T235-Q239 WeakPolarHBondContact O-CG 3.34Å; T235-Q239 PolarHBondContact O-N 3.15Å; T235-Q239 PolarHBondContact O-NE2 3.21Å; L236-Q239 WeakPolarHBondContact O-CB 3.28Å; L236-Q239 PolarHBondContact O-N 2.91Å; Q239-A243 HydrophobicContact CB-CB 4.18Å
240	Q	92.3	Very high	92.4	Very high	92 Å²	92	63.3 Å²	63.3	43%	0.43	30%	0.299	S	S	.	.			trans	-66.9	160.7	168.4	-67.5	-174	-21	0	0	110.7	N242 A243 T244	Q240-N242 VanDerWaalsContact C-N 3.25Å; Q240-N242 PolarHBondContact O-N 3.42Å; Q240-A243 PolarHBondContact O-N 2.95Å; Q240-T244 PolarHBondContact O-N 3.47Å; Q240-T244 VanDerWaalsContact O-N 3.11Å; Q240-T244 PolarHBondContact O-OG1 2.92Å
241	S	92.3	Very high	92.9	Very high	80 Å²	80	60 Å²	60	56%	0.559	29%	0.285	S	S	*	.	H	α-helix	trans	-55.4	-42.2	-179.8	49.8	0	0	0	0	112	T244 I245	S241-T244 PolarHBondContact O-N 3.13Å; S241-I245 VanDerWaalsContact O-CG1 3.25Å; S241-I245 WeakPolarHBondContact O-CG1 3.42Å; S241-I245 PolarHBondContact O-N 3.11Å
242	N	92.9	Very high	93.2	Very high	97 Å²	97	68 Å²	68	52%	0.519	32%	0.315	S	S	.	.	H	α-helix	trans	-63.1	-51.9	-176.6	-62.5	0.8	0	0	0	111.4	Q240 T244 I245 E246	Q240-N242 VanDerWaalsContact C-N 3.25Å; Q240-N242 PolarHBondContact O-N 3.42Å; N242-T244 VanDerWaalsContact C-N 3.25Å; N242-T244 PolarHBondContact O-N 2.96Å; N242-I245 PolarHBondContact O-N 2.96Å; N242-I245 VanDerWaalsContact O-N 3.15Å; N242-E246 PolarHBondContact O-N 2.92Å
243	A	92.5	Very high	93.4	Very high	0 Å²	0	71.4 Å²	71.4	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-59.8	-35.3	176.4	0	0	0	0	0	112.5	Y222 Q239 Q240 F247	Y222-A243 WeakPolarHBondContact O-CB 3.49Å; Q239-A243 HydrophobicContact CB-CB 4.18Å; Q240-A243 PolarHBondContact O-N 2.95Å; A243-F247 VanDerWaalsContact O-CB 3.24Å; A243-F247 WeakPolarHBondContact O-CB 3.46Å; A243-F247 PolarHBondContact O-N 3.05Å
244	T	93.4	Very high	93.6	Very high	23 Å²	23	68.5 Å²	68.5	14%	0.141	32%	0.32	C	S	.	.	H	α-helix	trans	-70.4	-38.3	177.3	-54	0	0	0	0	112.1	L236 Q240 S241 N242 R248	L236-T244 HydrophobicContact CD1-CG2 4.4Å; Q240-T244 PolarHBondContact O-N 3.47Å; Q240-T244 VanDerWaalsContact O-N 3.11Å; Q240-T244 PolarHBondContact O-OG1 2.92Å; S241-T244 PolarHBondContact O-N 3.13Å; N242-T244 VanDerWaalsContact C-N 3.25Å; N242-T244 PolarHBondContact O-N 2.96Å; T244-R248 VanDerWaalsContact O-CG 3.28Å; T244-R248 WeakPolarHBondContact O-CG 3.22Å; T244-R248 PolarHBondContact O-N 3.3Å; T244-R248 VanDerWaalsContact O-N 3.12Å
245	I	94.3	Very high	93.9	Very high	88 Å²	88	66.6 Å²	66.6	45%	0.451	31%	0.312	S	S	.	.	H	α-helix	trans	-66.7	-50	176.1	-68.9	163.3	0	0	0	109.5	S241 N242 F247 R248 E249	S241-I245 VanDerWaalsContact O-CG1 3.25Å; S241-I245 WeakPolarHBondContact O-CG1 3.42Å; S241-I245 PolarHBondContact O-N 3.11Å; N242-I245 PolarHBondContact O-N 2.96Å; N242-I245 VanDerWaalsContact O-N 3.15Å; I245-F247 VanDerWaalsContact C-N 3.34Å; I245-F247 PolarHBondContact O-N 3.44Å; I245-R248 PolarHBondContact O-N 2.97Å; I245-R248 VanDerWaalsContact O-N 3.08Å; I245-E249 HydrophobicContact CG2-CG 4.43Å; I245-E249 WeakPolarHBondContact O-CG 3.43Å; I245-E249 PolarHBondContact O-N 3.47Å
246	E	94.6	Very high	94	Very high	43 Å²	43	68.1 Å²	68.1	20%	0.201	33%	0.328	C	S	.	.	H	α-helix	trans	-57.2	-47.6	178	-169.6	-173.2	-179.4	0	0	110.9	L221 Y222 N242 R248 E249 R250	L221-E246 HydrophobicContact CD2-CG 3.96Å; Y222-E246 PolarHBondContact N-OE2 2.95Å; N242-E246 PolarHBondContact O-N 2.92Å; E246-R248 VanDerWaalsContact C-N 3.32Å; E246-R248 PolarHBondContact O-N 3.3Å; E246-E249 PolarHBondContact O-N 3.24Å; E246-R250 WeakPolarHBondContact O-CG 3.43Å; E246-R250 PolarHBondContact O-N 3.23Å
247	F	95.7	Very high	94.2	Very high	4 Å²	4	69.5 Å²	69.5	2%	0.018	33%	0.334	C	S	.	.	H	α-helix	trans	-54.5	-46.6	175.1	174.8	-99.9	0	0	0	112.2	I189 V218 L221 W224 L236 A243 I245 R250 V251 L267 P282	I189-F247 HydrophobicContact CD1-CD2 3.74Å; I189-F247 HydrophobicContact CD1-CE2 3.83Å; V218-F247 HydrophobicContact CG1-CE2 4.3Å; L221-F247 HydrophobicContact CD1-CB 3.84Å; L221-F247 HydrophobicContact CD1-CD2 3.84Å; L221-F247 HydrophobicContact CD1-CG 4.34Å; W224-F247 HydrophobicContact CZ3-CB 4.47Å; W224-F247 HydrophobicContact CZ3-CD2 4.38Å; W224-F247 HydrophobicContact CZ3-CG 4.5Å; L236-F247 HydrophobicContact CD1-CB 4.32Å; L236-F247 HydrophobicContact CD1-CD1 3.58Å; L236-F247 HydrophobicContact CD1-CE1 4.07Å; L236-F247 HydrophobicContact CD1-CG 3.93Å; L236-F247 HydrophobicContact CD2-CD1 3.93Å; L236-F247 HydrophobicContact CD2-CE1 3.7Å; L236-F247 HydrophobicContact CG-CD1 4.44Å; A243-F247 VanDerWaalsContact O-CB 3.24Å; A243-F247 WeakPolarHBondContact O-CB 3.46Å; A243-F247 PolarHBondContact O-N 3.05Å; I245-F247 VanDerWaalsContact C-N 3.34Å; I245-F247 PolarHBondContact O-N 3.44Å; F247-R250 PolarHBondContact O-N 2.77Å; F247-V251 HydrophobicContact CD1-CG2 4.35Å; F247-V251 HydrophobicContact CD2-CG2 4.3Å; F247-V251 HydrophobicContact CE1-CG2 3.89Å; F247-V251 HydrophobicContact CE2-CG2 3.81Å; F247-V251 HydrophobicContact CZ-CG2 3.59Å; F247-V251 WeakPolarHBondContact O-CB 3.45Å; F247-V251 VanDerWaalsContact O-CG2 3.25Å; F247-V251 WeakPolarHBondContact O-CG2 3.25Å; F247-V251 PolarHBondContact O-N 2.96Å; F247-L267 HydrophobicContact CZ-CD2 4.33Å; F247-P282 HydrophobicContact CE2-CB 3.83Å; F247-P282 HydrophobicContact CE2-CG 3.93Å; F247-P282 HydrophobicContact CZ-CB 4Å; F247-P282 HydrophobicContact CZ-CG 3.57Å
248	R	95.1	Very high	94.4	Very high	158 Å²	158	60.9 Å²	60.9	60%	0.596	30%	0.297	S	S	*	.	H	α-helix	trans	-67.7	-36.9	-179.5	-75.2	175	179.1	179	1.2	112.7	T244 I245 E246 R252	T244-R248 VanDerWaalsContact O-CG 3.28Å; T244-R248 WeakPolarHBondContact O-CG 3.22Å; T244-R248 PolarHBondContact O-N 3.3Å; T244-R248 VanDerWaalsContact O-N 3.12Å; I245-R248 PolarHBondContact O-N 2.97Å; I245-R248 VanDerWaalsContact O-N 3.08Å; E246-R248 VanDerWaalsContact C-N 3.32Å; E246-R248 PolarHBondContact O-N 3.3Å; R248-R252 WeakPolarHBondContact O-CB 3.34Å; R248-R252 PolarHBondContact O-N 3.16Å
249	E	95.2	Very high	94.5	Very high	109 Å²	109	58.3 Å²	58.3	51%	0.509	29%	0.291	S	S	.	.	H	α-helix	trans	-64.1	-48.9	175.6	-73.8	178.9	169.5	0	0	111	I245 E246 V251 R252 E253	I245-E249 HydrophobicContact CG2-CG 4.43Å; I245-E249 WeakPolarHBondContact O-CG 3.43Å; I245-E249 PolarHBondContact O-N 3.47Å; E246-E249 PolarHBondContact O-N 3.24Å; E249-V251 PolarHBondContact O-N 2.96Å; E249-R252 WeakPolarHBondContact O-CB 3.43Å; E249-R252 PolarHBondContact O-N 3.49Å; E249-R252 VanDerWaalsContact O-N 3.15Å; E249-E253 PolarHBondContact O-N 3.01Å
250	R	95	Very high	94.6	Very high	68 Å²	68	64 Å²	64	26%	0.257	32%	0.317	S	S	.	.	H	α-helix	trans	-62.2	-41.3	177	-64.2	-60.3	-173.8	169	6.9	113	I189 L221 E246 F247 R252 E253 V254	I189-R250 HydrophobicContact CD1-CB 4.27Å; I189-R250 HydrophobicContact CG1-CB 3.75Å; I189-R250 HydrophobicContact CG1-CG 4.48Å; L221-R250 HydrophobicContact CD2-CG 4.25Å; E246-R250 WeakPolarHBondContact O-CG 3.43Å; E246-R250 PolarHBondContact O-N 3.23Å; F247-R250 PolarHBondContact O-N 2.77Å; R250-R252 VanDerWaalsContact C-N 3.31Å; R250-R252 PolarHBondContact O-N 2.93Å; R250-E253 IonicContact NH1-OE2 3.21Å; R250-E253 PolarHBondContact NH1-OE2 2.92Å; R250-E253 WeakPolarHBondContact O-CB 3.48Å; R250-E253 PolarHBondContact O-N 2.94Å; R250-V254 WeakPolarHBondContact O-CG2 3.41Å; R250-V254 PolarHBondContact O-N 3.25Å
251	V	95.6	Very high	94.6	Very high	6 Å²	6	61.9 Å²	61.9	4%	0.036	31%	0.308	C	S	.	.	H	α-helix	trans	-62.5	-40.6	175.1	169.3	0	0	0	0	111	L215 F247 E249 V254 I255 L267	L215-V251 HydrophobicContact CD1-CG2 4.29Å; F247-V251 HydrophobicContact CD1-CG2 4.35Å; F247-V251 HydrophobicContact CD2-CG2 4.3Å; F247-V251 HydrophobicContact CE1-CG2 3.89Å; F247-V251 HydrophobicContact CE2-CG2 3.81Å; F247-V251 HydrophobicContact CZ-CG2 3.59Å; F247-V251 WeakPolarHBondContact O-CB 3.45Å; F247-V251 VanDerWaalsContact O-CG2 3.25Å; F247-V251 WeakPolarHBondContact O-CG2 3.25Å; F247-V251 PolarHBondContact O-N 2.96Å; E249-V251 PolarHBondContact O-N 2.96Å; V251-V254 PolarHBondContact O-N 3.31Å; V251-I255 HydrophobicContact CG1-CD1 3.81Å; V251-I255 HydrophobicContact CG1-CG1 4.41Å; V251-I255 VanDerWaalsContact O-CG1 3.25Å; V251-I255 WeakPolarHBondContact O-CG1 3.5Å; V251-I255 PolarHBondContact O-N 3.06Å; V251-L267 HydrophobicContact CG1-CD1 4.04Å; V251-L267 HydrophobicContact CG1-CD2 4.04Å; V251-L267 HydrophobicContact CG1-CG 3.97Å; V251-L267 HydrophobicContact CG2-CD2 4.31Å
252	R	95.6	Very high	94.6	Very high	170 Å²	170	61 Å²	61	64%	0.642	31%	0.31	S	S	*	.	H	α-helix	trans	-64.9	-41.4	177.2	-169.2	-173.4	-60.5	133.5	1.7	111.8	R248 E249 R250 I255 G256	R248-R252 WeakPolarHBondContact O-CB 3.34Å; R248-R252 PolarHBondContact O-N 3.16Å; E249-R252 WeakPolarHBondContact O-CB 3.43Å; E249-R252 PolarHBondContact O-N 3.49Å; E249-R252 VanDerWaalsContact O-N 3.15Å; R250-R252 VanDerWaalsContact C-N 3.31Å; R250-R252 PolarHBondContact O-N 2.93Å; R252-I255 PolarHBondContact O-N 2.86Å; R252-G256 PolarHBondContact O-N 3.12Å
253	E	95.5	Very high	94.6	Very high	74 Å²	74	58 Å²	58	35%	0.346	30%	0.295	S	S	.	.	H	α-helix	trans	-57.5	-50.6	174.3	-168.9	-167.1	144.2	0	0	110.8	S192 E249 R250 I255 G256 H257	S192-E253 VanDerWaalsContact OG-CD 3.31Å; S192-E253 PolarHBondContact OG-OE1 3.38Å; E249-E253 PolarHBondContact O-N 3.01Å; R250-E253 IonicContact NH1-OE2 3.21Å; R250-E253 PolarHBondContact NH1-OE2 2.92Å; R250-E253 WeakPolarHBondContact O-CB 3.48Å; R250-E253 PolarHBondContact O-N 2.94Å; E253-I255 PolarHBondContact O-N 3.14Å; E253-G256 WeakPolarHBondContact O-CA 3.47Å; E253-G256 PolarHBondContact O-N 3.31Å; E253-G256 VanDerWaalsContact O-N 3.12Å; E253-H257 PolarHBondContact O-CD2 3.34Å; E253-H257 PolarHBondContact O-N 3.17Å; E253-H257 IonicContact OE1-NE2 3.15Å
254	V	95.5	Very high	94.7	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-59.8	-44.3	177.2	169.8	0	0	0	0	112.1	L193 L215 R250 V251 G256 H257 F258	L193-V254 HydrophobicContact CD1-CG1 4.31Å; L215-V254 HydrophobicContact CD2-CB 4.37Å; L215-V254 HydrophobicContact CD2-CG1 3.8Å; L215-V254 HydrophobicContact CD2-CG2 4.01Å; R250-V254 WeakPolarHBondContact O-CG2 3.41Å; R250-V254 PolarHBondContact O-N 3.25Å; V251-V254 PolarHBondContact O-N 3.31Å; V254-G256 VanDerWaalsContact C-N 3.3Å; V254-G256 PolarHBondContact O-N 3.44Å; V254-H257 PolarHBondContact O-N 3.37Å; V254-F258 HydrophobicContact CG1-CD2 3.7Å; V254-F258 HydrophobicContact CG1-CE2 3.65Å; V254-F258 VanDerWaalsContact O-CD2 3.31Å; V254-F258 WeakPolarHBondContact O-CD2 3.32Å; V254-F258 PolarHBondContact O-N 3.19Å
255	I	95.9	Very high	94.8	Very high	52 Å²	52	61.6 Å²	61.6	27%	0.267	31%	0.314	S	S	.	.	H	α-helix	trans	-60.5	-41.8	176.2	-69.1	167.9	0	0	0	110.6	V251 R252 E253 H257 F258 A259 L280	V251-I255 HydrophobicContact CG1-CD1 3.81Å; V251-I255 HydrophobicContact CG1-CG1 4.41Å; V251-I255 VanDerWaalsContact O-CG1 3.25Å; V251-I255 WeakPolarHBondContact O-CG1 3.5Å; V251-I255 PolarHBondContact O-N 3.06Å; R252-I255 PolarHBondContact O-N 2.86Å; E253-I255 PolarHBondContact O-N 3.14Å; I255-H257 PolarHBondContact O-N 3.16Å; I255-F258 PolarHBondContact O-N 3.33Å; I255-A259 WeakPolarHBondContact O-CB 3.41Å; I255-A259 PolarHBondContact O-N 2.92Å; I255-L280 HydrophobicContact CD1-CD1 4.26Å; I255-L280 HydrophobicContact CG1-CD1 3.66Å
256	G	95.4	Very high	94.8	Very high	34 Å²	34	59.4 Å²	59.4	35%	0.351	30%	0.303	S	S	.	.	H	α-helix	trans	-56.1	-48	174.1	0	0	0	0	0	112.2	R252 E253 V254 F258 A259 E260	R252-G256 PolarHBondContact O-N 3.12Å; E253-G256 WeakPolarHBondContact O-CA 3.47Å; E253-G256 PolarHBondContact O-N 3.31Å; E253-G256 VanDerWaalsContact O-N 3.12Å; V254-G256 VanDerWaalsContact C-N 3.3Å; V254-G256 PolarHBondContact O-N 3.44Å; G256-F258 PolarHBondContact O-N 3Å; G256-A259 WeakPolarHBondContact O-CB 3.44Å; G256-A259 PolarHBondContact O-N 3.35Å; G256-A259 VanDerWaalsContact O-N 3.13Å; G256-E260 WeakPolarHBondContact O-CG 3.23Å; G256-E260 PolarHBondContact O-N 3.17Å
257	H	95.2	Very high	94.8	Very high	53 Å²	53	58.1 Å²	58.1	25%	0.245	30%	0.297	C	S	.	.	H	α-helix	trans	-65.4	-36.5	177	-73.7	-62.1	0	0	0	113.9	L193 E253 V254 I255 A259 E260 Q261	L193-H257 HydrophobicContact CB-CB 4.19Å; L193-H257 HydrophobicContact CD1-CB 3.88Å; L193-H257 HydrophobicContact CD2-CB 4.11Å; L193-H257 HydrophobicContact CG-CB 4.26Å; E253-H257 PolarHBondContact O-CD2 3.34Å; E253-H257 PolarHBondContact O-N 3.17Å; E253-H257 IonicContact OE1-NE2 3.15Å; V254-H257 PolarHBondContact O-N 3.37Å; I255-H257 PolarHBondContact O-N 3.16Å; H257-A259 VanDerWaalsContact C-N 3.31Å; H257-E260 IonicContact CE1-OE2 3.81Å; H257-E260 IonicContact CG-OE2 3.82Å; H257-E260 IonicContact ND1-OE2 2.71Å; H257-E260 PolarHBondContact ND1-OE2 2.89Å; H257-E260 PolarHBondContact O-N 3.07Å; H257-Q261 WeakPolarHBondContact O-CG 3.48Å; H257-Q261 PolarHBondContact O-N 3Å
258	F	95.4	Very high	94.7	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-64.5	-37.8	171.9	-86.6	-77.4	0	0	0	111.6	L185 V187 L193 I201 V213 V254 I255 G256 Q261 G262 L263 A265 L280	L185-F258 HydrophobicContact CD2-CE1 4.17Å; L185-F258 HydrophobicContact CD2-CZ 4.05Å; V187-F258 HydrophobicContact CG2-CZ 4.26Å; L193-F258 HydrophobicContact CD1-CD2 3.94Å; L193-F258 HydrophobicContact CD1-CE2 3.73Å; L193-F258 HydrophobicContact CD1-CZ 4.24Å; I201-F258 HydrophobicContact CD1-CD1 4.21Å; I201-F258 HydrophobicContact CD1-CE1 3.68Å; I201-F258 HydrophobicContact CD1-CZ 4.35Å; I201-F258 HydrophobicContact CG1-CE1 4.31Å; V213-F258 HydrophobicContact CG1-CE2 4.3Å; V213-F258 HydrophobicContact CG1-CZ 4.12Å; V213-F258 HydrophobicContact CG2-CE1 4.17Å; V213-F258 HydrophobicContact CG2-CE2 4.39Å; V213-F258 HydrophobicContact CG2-CZ 3.65Å; V254-F258 HydrophobicContact CG1-CD2 3.7Å; V254-F258 HydrophobicContact CG1-CE2 3.65Å; V254-F258 VanDerWaalsContact O-CD2 3.31Å; V254-F258 WeakPolarHBondContact O-CD2 3.32Å; V254-F258 PolarHBondContact O-N 3.19Å; I255-F258 PolarHBondContact O-N 3.33Å; G256-F258 PolarHBondContact O-N 3Å; F258-Q261 CarbonylContact O-C 3.57Å; F258-Q261 WeakPolarHBondContact O-CA 3.24Å; F258-Q261 WeakPolarHBondContact O-CB 3.44Å; F258-Q261 PolarHBondContact O-N 3.01Å; F258-Q261 VanDerWaalsContact O-N 3.15Å; F258-G262 PolarHBondContact O-N 2.53Å; F258-L263 CarbonylContact C-O 3.54Å; F258-L263 HydrophobicContact CB-CB 4.49Å; F258-L263 HydrophobicContact CD1-CB 4.23Å; F258-L263 HydrophobicContact CD1-CD1 4.14Å; F258-L263 PolarHBondContact O-N 2.84Å; F258-L263 VanDerWaalsContact O-O 3.05Å; F258-A265 HydrophobicContact CB-CB 3.82Å; F258-A265 HydrophobicContact CD1-CB 4.48Å; F258-A265 HydrophobicContact CD2-CB 4.01Å; F258-A265 HydrophobicContact CG-CB 3.86Å; F258-L280 HydrophobicContact CD2-CD2 4.4Å; F258-L280 HydrophobicContact CE2-CD2 4.01Å
259	A	95	Very high	94.5	Very high	55 Å²	55	55.5 Å²	55.5	46%	0.455	29%	0.288	S	S	.	.	H	α-helix	trans	-67.1	-37.1	176.6	0	0	0	0	0	112.5	I255 G256 H257 Q261 G262 L263	I255-A259 WeakPolarHBondContact O-CB 3.41Å; I255-A259 PolarHBondContact O-N 2.92Å; G256-A259 WeakPolarHBondContact O-CB 3.44Å; G256-A259 PolarHBondContact O-N 3.35Å; G256-A259 VanDerWaalsContact O-N 3.13Å; H257-A259 VanDerWaalsContact C-N 3.31Å; A259-Q261 PolarHBondContact O-N 2.83Å; A259-G262 WeakPolarHBondContact O-CA 3.46Å; A259-G262 PolarHBondContact O-N 3.31Å; A259-L263 PolarHBondContact N-O 3.03Å
260	E	94.6	Very high	94.3	Very high	138 Å²	138	55 Å²	55	65%	0.645	29%	0.286	S	S	*	.	H	α-helix	trans	-59.6	-36.9	170.1	-70.7	170	173.5	0	0	111.6	G256 H257 G262	G256-E260 WeakPolarHBondContact O-CG 3.23Å; G256-E260 PolarHBondContact O-N 3.17Å; H257-E260 IonicContact CE1-OE2 3.81Å; H257-E260 IonicContact CG-OE2 3.82Å; H257-E260 IonicContact ND1-OE2 2.71Å; H257-E260 PolarHBondContact ND1-OE2 2.89Å; H257-E260 PolarHBondContact O-N 3.07Å; E260-G262 PolarHBondContact O-N 3.24Å
261	Q	92.5	Very high	94	Very high	48 Å²	48	52.8 Å²	52.8	22%	0.224	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78	7.8	171.2	-59.3	-55.4	-49.6	0	0	112.3	L193 K205 H257 F258 A259 L263	L193-Q261 HydrophobicContact CD2-CG 4.02Å; K205-Q261 PolarHBondContact NZ-O 3.42Å; H257-Q261 WeakPolarHBondContact O-CG 3.48Å; H257-Q261 PolarHBondContact O-N 3Å; F258-Q261 CarbonylContact O-C 3.57Å; F258-Q261 WeakPolarHBondContact O-CA 3.24Å; F258-Q261 WeakPolarHBondContact O-CB 3.44Å; F258-Q261 PolarHBondContact O-N 3.01Å; F258-Q261 VanDerWaalsContact O-N 3.15Å; A259-Q261 PolarHBondContact O-N 2.83Å; Q261-L263 VanDerWaalsContact C-N 3.35Å; Q261-L263 PolarHBondContact O-N 3.41Å
262	G	92.2	Very high	93.5	Very high	60 Å²	60	62.4 Å²	62.4	62%	0.619	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.3	33.4	179.4	0	0	0	0	0	114.2	F258 A259 E260	F258-G262 PolarHBondContact O-N 2.53Å; A259-G262 WeakPolarHBondContact O-CA 3.46Å; A259-G262 PolarHBondContact O-N 3.31Å; E260-G262 PolarHBondContact O-N 3.24Å
263	L	93.1	Very high	93	Very high	36 Å²	36	57.3 Å²	57.3	19%	0.188	31%	0.306	C	S	.	.			trans	-124	132.4	174.5	-69.3	174.5	0	0	0	110.1	I201 K205 F258 A259 Q261 I278	I201-L263 HydrophobicContact CG2-CD1 3.45Å; I201-L263 VanDerWaalsContact CG2-CD1 3.45Å; K205-L263 VanDerWaalsContact CE-CD2 3.49Å; K205-L263 VanDerWaalsContact CE-CG 3.41Å; F258-L263 CarbonylContact C-O 3.54Å; F258-L263 HydrophobicContact CB-CB 4.49Å; F258-L263 HydrophobicContact CD1-CB 4.23Å; F258-L263 HydrophobicContact CD1-CD1 4.14Å; F258-L263 PolarHBondContact O-N 2.84Å; F258-L263 VanDerWaalsContact O-O 3.05Å; A259-L263 PolarHBondContact N-O 3.03Å; Q261-L263 VanDerWaalsContact C-N 3.35Å; Q261-L263 PolarHBondContact O-N 3.41Å; L263-I278 HydrophobicContact CB-CD1 3.99Å; L263-I278 HydrophobicContact CD1-CD1 3.69Å; L263-I278 HydrophobicContact CD2-CD1 4.07Å; L263-I278 HydrophobicContact CG-CD1 4.13Å
264	N	94.2	Very high	92.5	Very high	90 Å²	90	55.6 Å²	55.6	48%	0.481	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	123.3	172.1	-60.9	-42.6	0	0	0	108.9	Y277 I278	N264-Y277 HydrophobicContact CB-CD1 3.66Å; N264-Y277 HydrophobicContact CB-CE1 3.77Å; N264-Y277 HydrophobicContact CB-CG 4.24Å; N264-Y277 WeakPolarHBondContact O-CA 3.43Å; N264-I278 PolarHBondContact O-N 2.8Å
265	A	94.4	Very high	92	Very high	7 Å²	7	60.7 Å²	60.7	6%	0.058	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	141.2	177.7	0	0	0	0	0	110	F258 I278 L280	F258-A265 HydrophobicContact CB-CB 3.82Å; F258-A265 HydrophobicContact CD1-CB 4.48Å; F258-A265 HydrophobicContact CD2-CB 4.01Å; F258-A265 HydrophobicContact CG-CB 3.86Å; A265-I278 WeakPolarHBondContact CA-O 3.46Å; A265-I278 HydrophobicContact CB-CB 4.34Å; A265-L280 HydrophobicContact CB-CD1 4.03Å; A265-L280 HydrophobicContact CB-CD2 3.93Å; A265-L280 HydrophobicContact CB-CG 4.01Å
266	I	95.4	Very high	91.6	Very high	43 Å²	43	63.4 Å²	63.4	22%	0.221	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	159.1	177.9	-161	170.2	0	0	0	109.9	E270 N271 Y277 I278 L280	I266-E270 HydrophobicContact CD1-CB 3.72Å; I266-E270 HydrophobicContact CG1-CB 3.85Å; I266-N271 HydrophobicContact CG2-CB 3.6Å; I266-Y277 HydrophobicContact CB-CD1 4.21Å; I266-Y277 HydrophobicContact CG2-CD1 4.04Å; I266-Y277 HydrophobicContact CG2-CG 4.29Å; I266-I278 PolarHBondContact N-O 2.92Å; I266-L280 WeakPolarHBondContact O-CB 3.17Å; I266-L280 WeakPolarHBondContact O-CG 3.45Å; I266-L280 PolarHBondContact O-N 3.24Å
267	L	95.2	Very high	91.4	Very high	15 Å²	15	66.5 Å²	66.5	8%	0.079	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	139.6	175.6	-70.6	161.5	0	0	0	111.1	F247 V251 W269 E270 N271 L280 P282	F247-L267 HydrophobicContact CZ-CD2 4.33Å; V251-L267 HydrophobicContact CG1-CD1 4.04Å; V251-L267 HydrophobicContact CG1-CD2 4.04Å; V251-L267 HydrophobicContact CG1-CG 3.97Å; V251-L267 HydrophobicContact CG2-CD2 4.31Å; L267-W269 HydrophobicContact CB-CD2 4.23Å; L267-W269 HydrophobicContact CB-CH2 4.48Å; L267-W269 HydrophobicContact CB-CZ2 3.96Å; L267-W269 HydrophobicContact CD1-CH2 4.34Å; L267-W269 HydrophobicContact CD1-CZ2 3.56Å; L267-W269 HydrophobicContact CD2-CH2 3.87Å; L267-W269 HydrophobicContact CD2-CZ2 3.93Å; L267-W269 HydrophobicContact CG-CH2 4.45Å; L267-W269 HydrophobicContact CG-CZ2 4.02Å; L267-W269 PolarHBondContact O-N 2.97Å; L267-E270 PolarHBondContact O-N 3.06Å; L267-N271 PolarHBondContact O-N 3.24Å; L267-N271 VanDerWaalsContact O-N 3.12Å; L267-L280 HydrophobicContact CD2-CB 4.45Å; L267-P282 HydrophobicContact CD2-CG 4Å
268	F	92.4	Very high	91.3	Very high	38 Å²	38	65 Å²	65	17%	0.167	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-26	-170.3	78.7	-92.5	0	0	0	114.6	I232 L280 V281 N293	I232-F268 HydrophobicContact CG2-CE1 3.75Å; I232-F268 HydrophobicContact CG2-CZ 3.95Å; F268-L280 PolarHBondContact N-O 3.23Å; F268-V281 HydrophobicContact CB-CG2 3.94Å; F268-V281 HydrophobicContact CD1-CB 4.17Å; F268-V281 HydrophobicContact CD1-CG1 4.05Å; F268-V281 HydrophobicContact CD1-CG2 3.91Å; F268-V281 HydrophobicContact CE1-CG1 4.08Å; F268-V281 HydrophobicContact CG-CG2 4.07Å; F268-N293 HydrophobicContact CE1-CB 4.14Å; F268-N293 HydrophobicContact CZ-CB 3.85Å; F268-N293 VanDerWaalsContact CZ-ND2 3.35Å; F268-N293 WeakPolarHBondContact CZ-ND2 3.41Å
269	W	90.7	Very high	91.3	Very high	69 Å²	69	65.5 Å²	65.5	26%	0.261	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-15.5	178	58.3	73.1	0	0	0	113.7	I232 R233 L236 L267 P282	I232-W269 HydrophobicContact CG2-CE3 4.48Å; I232-W269 HydrophobicContact CG2-CZ3 3.84Å; R233-W269 HydrophobicContact CG-CD2 3.95Å; R233-W269 HydrophobicContact CG-CE3 3.63Å; R233-W269 HydrophobicContact CG-CG 4.35Å; R233-W269 HydrophobicContact CG-CZ3 4.12Å; L236-W269 HydrophobicContact CD2-CZ2 4.41Å; L267-W269 HydrophobicContact CB-CD2 4.23Å; L267-W269 HydrophobicContact CB-CH2 4.48Å; L267-W269 HydrophobicContact CB-CZ2 3.96Å; L267-W269 HydrophobicContact CD1-CH2 4.34Å; L267-W269 HydrophobicContact CD1-CZ2 3.56Å; L267-W269 HydrophobicContact CD2-CH2 3.87Å; L267-W269 HydrophobicContact CD2-CZ2 3.93Å; L267-W269 HydrophobicContact CG-CH2 4.45Å; L267-W269 HydrophobicContact CG-CZ2 4.02Å; L267-W269 PolarHBondContact O-N 2.97Å; W269-P282 HydrophobicContact CH2-CG 3.91Å; W269-P282 HydrophobicContact CZ3-CG 4.05Å
270	E	91.6	Very high	91.4	Very high	98 Å²	98	62.9 Å²	62.9	46%	0.458	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-19.4	173	-80.7	153.9	-141.6	0	0	111.5	I266 L267 K272	I266-E270 HydrophobicContact CD1-CB 3.72Å; I266-E270 HydrophobicContact CG1-CB 3.85Å; L267-E270 PolarHBondContact O-N 3.06Å; E270-K272 PolarHBondContact O-N 3.1Å
271	N	89	Confident	91.4	Very high	22 Å²	22	56.3 Å²	56.3	12%	0.118	29%	0.288	C	S	.	.			trans	-71.1	113.3	-178.4	-163.4	-4.5	0	0	0	112	I266 L267 D273 Y277 S279	I266-N271 HydrophobicContact CG2-CB 3.6Å; L267-N271 PolarHBondContact O-N 3.24Å; L267-N271 VanDerWaalsContact O-N 3.12Å; N271-D273 PolarHBondContact OD1-N 2.97Å; N271-D273 PolarHBondContact OD1-O 2.71Å; N271-Y277 PolarHBondContact ND2-O 3.41Å; N271-S279 PolarHBondContact ND2-OG 3.31Å
272	K	83.9	Confident	91.6	Very high	209 Å²	209	54 Å²	54	91%	0.909	28%	0.277	S	S	*	.			trans	-97.3	-20	171.8	-63.7	-178.9	-176.8	175.9	0	112.8	E270	E270-K272 PolarHBondContact O-N 3.1Å
273	D	87	Confident	91.8	Very high	62 Å²	62	51.2 Å²	51.2	33%	0.332	25%	0.248	S	C	.	.			trans	-125.1	101.4	-175.4	-168.8	-7.4	0	0	0	111.3	N271 D275 Y277	N271-D273 PolarHBondContact OD1-N 2.97Å; N271-D273 PolarHBondContact OD1-O 2.71Å; D273-D275 PolarHBondContact O-N 2.73Å; D273-D275 PolarHBondContact OD1-N 2.93Å; D273-Y277 HydrophobicContact CB-CD2 4.4Å; D273-Y277 PolarHBondContact O-N 3.18Å
274	L	83.4	Confident	91.9	Very high	38 Å²	38	49.5 Å²	49.5	20%	0.199	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-9.9	-179	-61.4	176.6	0	0	0	113.7	F301	L274-F301 HydrophobicContact CB-CD2 4.45Å; L274-F301 HydrophobicContact CB-CE2 4.23Å; L274-F301 HydrophobicContact CD1-CD2 4.38Å
275	D	85	Confident	91.8	Very high	108 Å²	108	45.4 Å²	45.4	58%	0.578	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-44.2	178.7	-67.7	-32.9	0	0	0	111.5	D273 K305	D273-D275 PolarHBondContact O-N 2.73Å; D273-D275 PolarHBondContact OD1-N 2.93Å; D275-K305 WeakPolarHBondContact OD1-CE 3.26Å; D275-K305 IonicContact OD1-NZ 3.2Å; D275-K305 PolarHBondContact OD1-NZ 3.04Å; D275-K305 IonicContact OD2-NZ 3.67Å; D275-K305 PolarHBondContact OD2-NZ 3.07Å
276	D	87.2	Confident	91.7	Very high	108 Å²	108	51.1 Å²	51.1	58%	0.578	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-27.1	-174	-74.7	-11.1	0	0	0	113.6
277	Y	92.5	Very high	91.5	Very high	99 Å²	99	50.9 Å²	50.9	39%	0.388	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	130.8	-175.1	-68.1	-98.8	0	0	0	112.7	N264 I266 N271 D273	N264-Y277 HydrophobicContact CB-CD1 3.66Å; N264-Y277 HydrophobicContact CB-CE1 3.77Å; N264-Y277 HydrophobicContact CB-CG 4.24Å; N264-Y277 WeakPolarHBondContact O-CA 3.43Å; I266-Y277 HydrophobicContact CB-CD1 4.21Å; I266-Y277 HydrophobicContact CG2-CD1 4.04Å; I266-Y277 HydrophobicContact CG2-CG 4.29Å; N271-Y277 PolarHBondContact ND2-O 3.41Å; D273-Y277 HydrophobicContact CB-CD2 4.4Å; D273-Y277 PolarHBondContact O-N 3.18Å
278	I	93.4	Very high	91.3	Very high	22 Å²	22	50.5 Å²	50.5	11%	0.113	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	129.3	170.8	-60.5	177	0	0	0	109.4	V213 L263 N264 A265 I266 L280	V213-I278 HydrophobicContact CB-CG2 4.36Å; V213-I278 HydrophobicContact CG2-CG2 3.46Å; V213-I278 VanDerWaalsContact CG2-CG2 3.46Å; L263-I278 HydrophobicContact CB-CD1 3.99Å; L263-I278 HydrophobicContact CD1-CD1 3.69Å; L263-I278 HydrophobicContact CD2-CD1 4.07Å; L263-I278 HydrophobicContact CG-CD1 4.13Å; N264-I278 PolarHBondContact O-N 2.8Å; A265-I278 WeakPolarHBondContact CA-O 3.46Å; A265-I278 HydrophobicContact CB-CB 4.34Å; I266-I278 PolarHBondContact N-O 2.92Å; I278-L280 PolarHBondContact O-N 3.2Å
279	S	94.9	Very high	91.3	Very high	11 Å²	11	48.7 Å²	48.7	8%	0.077	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	117.4	179.3	-63.2	0	0	0	0	111.4	V213 N271	V213-S279 PolarHBondContact N-O 3.08Å; N271-S279 PolarHBondContact ND2-OG 3.31Å
280	L	96.2	Very high	91.3	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	118	173	-55.7	178.6	0	0	0	109.9	V213 L215 I255 F258 A265 I266 L267 F268 I278	V213-L280 HydrophobicContact CB-CD2 3.55Å; V213-L280 HydrophobicContact CG1-CD2 3.61Å; V213-L280 HydrophobicContact CG2-CD2 3.98Å; L215-L280 HydrophobicContact CD1-CB 3.83Å; L215-L280 HydrophobicContact CD1-CD1 4.15Å; L215-L280 HydrophobicContact CD1-CG 4.39Å; L215-L280 HydrophobicContact CG-CB 4.49Å; I255-L280 HydrophobicContact CD1-CD1 4.26Å; I255-L280 HydrophobicContact CG1-CD1 3.66Å; F258-L280 HydrophobicContact CD2-CD2 4.4Å; F258-L280 HydrophobicContact CE2-CD2 4.01Å; A265-L280 HydrophobicContact CB-CD1 4.03Å; A265-L280 HydrophobicContact CB-CD2 3.93Å; A265-L280 HydrophobicContact CB-CG 4.01Å; I266-L280 WeakPolarHBondContact O-CB 3.17Å; I266-L280 WeakPolarHBondContact O-CG 3.45Å; I266-L280 PolarHBondContact O-N 3.24Å; L267-L280 HydrophobicContact CD2-CB 4.45Å; F268-L280 PolarHBondContact N-O 3.23Å; I278-L280 PolarHBondContact O-N 3.2Å
281	V	95.6	Very high	91.3	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	110.4	178.1	-172.7	0	0	0	0	109.8	V212 V213 A214 L215 F268 T283 N293 L294 A297	V212-V281 HydrophobicContact CG1-CG2 3.83Å; V213-V281 PolarHBondContact O-N 3.31Å; A214-V281 CarbonylContact C-O 3.57Å; A214-V281 WeakPolarHBondContact CA-O 3.36Å; L215-V281 PolarHBondContact N-O 2.98Å; F268-V281 HydrophobicContact CB-CG2 3.94Å; F268-V281 HydrophobicContact CD1-CB 4.17Å; F268-V281 HydrophobicContact CD1-CG1 4.05Å; F268-V281 HydrophobicContact CD1-CG2 3.91Å; F268-V281 HydrophobicContact CE1-CG1 4.08Å; F268-V281 HydrophobicContact CG-CG2 4.07Å; V281-T283 HydrophobicContact CG1-CG2 4.04Å; V281-T283 PolarHBondContact O-N 3.22Å; V281-N293 HydrophobicContact CG1-CB 4.04Å; V281-L294 HydrophobicContact CB-CD1 4.24Å; V281-L294 HydrophobicContact CG1-CB 4.05Å; V281-L294 HydrophobicContact CG2-CD1 4.33Å; V281-A297 HydrophobicContact CG2-CB 4.05Å
282	P	96.4	Very high	91.3	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	129.2	175.2	-13.5	27.6	0	0	0	110.7	L215 V218 I232 F247 L267 W269 G290	L215-P282 CarbonylContact O-C 3.59Å; L215-P282 WeakPolarHBondContact O-CA 3.39Å; V218-P282 HydrophobicContact CG1-CB 3.87Å; I232-P282 HydrophobicContact CD1-CB 4.47Å; I232-P282 HydrophobicContact CG1-CB 4.01Å; I232-P282 HydrophobicContact CG1-CG 4.39Å; F247-P282 HydrophobicContact CE2-CB 3.83Å; F247-P282 HydrophobicContact CE2-CG 3.93Å; F247-P282 HydrophobicContact CZ-CB 4Å; F247-P282 HydrophobicContact CZ-CG 3.57Å; L267-P282 HydrophobicContact CD2-CG 4Å; W269-P282 HydrophobicContact CH2-CG 3.91Å; W269-P282 HydrophobicContact CZ3-CG 4.05Å; P282-G290 WeakPolarHBondContact O-CA 3.44Å
283	T	95.9	Very high	91.6	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.156	C	C	.	.			trans	-139.4	156.2	-176.1	58	0	0	0	0	112.2	A214 L215 N216 K217 V218 V281 D289 M291 L294	A214-T283 HydrophobicContact CB-CG2 4.49Å; L215-T283 PolarHBondContact O-N 3.4Å; L215-T283 PolarHBondContact O-OG1 3.49Å; N216-T283 CarbonylContact C-O 3.57Å; N216-T283 VanDerWaalsContact CA-O 3.23Å; N216-T283 WeakPolarHBondContact CA-O 3.5Å; N216-T283 PolarHBondContact OD1-O 3.23Å; K217-T283 PolarHBondContact N-O 3.27Å; K217-T283 VanDerWaalsContact N-O 3.07Å; V218-T283 PolarHBondContact N-O 3.32Å; V281-T283 HydrophobicContact CG1-CG2 4.04Å; V281-T283 PolarHBondContact O-N 3.22Å; T283-D289 CarbonylContact C-O 3.52Å; T283-D289 VanDerWaalsContact CA-O 3.28Å; T283-D289 WeakPolarHBondContact CA-O 3.46Å; T283-M291 HydrophobicContact CG2-SD 4.3Å; T283-L294 HydrophobicContact CG2-CB 3.99Å; T283-L294 HydrophobicContact CG2-CD2 4.23Å
284	S	95.5	Very high	91.8	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.141	C	C	.	.			trans	-128.9	109.6	164.9	171.8	0	0	0	0	108.8	D219 H286 T287 G288 D289	D219-S284 WeakPolarHBondContact CB-OG 3.25Å; D219-S284 VanDerWaalsContact OD1-CB 3.24Å; D219-S284 WeakPolarHBondContact OD1-CB 3.38Å; D219-S284 PolarHBondContact OD1-OG 2.85Å; S284-H286 PolarHBondContact O-N 2.76Å; S284-T287 WeakPolarHBondContact CB-OG1 3.21Å; S284-T287 PolarHBondContact OG-N 3.44Å; S284-T287 VanDerWaalsContact OG-N 3.11Å; S284-T287 PolarHBondContact OG-OG1 3.14Å; S284-G288 WeakPolarHBondContact O-CA 3.06Å; S284-G288 PolarHBondContact O-N 2.84Å; S284-D289 PolarHBondContact N-O 3.3Å
285	A	92.2	Very high	92.1	Very high	4 Å²	4	25.9 Å²	25.9	3%	0.033	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-30	175.2	0	0	0	0	0	112.7	K110 I111 N216	K110-A285 HydrophobicContact CB-CB 3.84Å; K110-A285 HydrophobicContact CG-CB 3.85Å; I111-A285 HydrophobicContact CB-CB 4.48Å; I111-A285 HydrophobicContact CG1-CB 3.6Å; N216-A285 WeakPolarHBondContact OD1-CB 3.47Å; N216-A285 PolarHBondContact OD1-N 3.49Å
286	H	91.7	Very high	92.2	Very high	128 Å²	128	20.9 Å²	20.9	59%	0.593	11%	0.105	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77	-60.3	-178.6	-176.3	-108.4	0	0	0	111.2	K114 S284	K114-H286 PolarHBondContact NZ-O 3.01Å; S284-H286 PolarHBondContact O-N 2.76Å
287	T	91.1	Very high	92.2	Very high	38 Å²	38	16.6 Å²	16.6	23%	0.233	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75	-36.9	-176.6	63.3	0	0	0	0	111.9	K114 D219 P228 S284 D289	K114-T287 WeakPolarHBondContact CE-O 3.3Å; K114-T287 PolarHBondContact NZ-O 2.78Å; D219-T287 HydrophobicContact CB-CG2 3.8Å; P228-T287 WeakPolarHBondContact CB-O 2.84Å; S284-T287 WeakPolarHBondContact CB-OG1 3.21Å; S284-T287 PolarHBondContact OG-N 3.44Å; S284-T287 VanDerWaalsContact OG-N 3.11Å; S284-T287 PolarHBondContact OG-OG1 3.14Å; T287-D289 VanDerWaalsContact OG1-CG 3.3Å; T287-D289 PolarHBondContact OG1-N 2.91Å
288	G	91.4	Very high	92	Very high	6 Å²	6	12 Å²	12	6%	0.062	7%	0.067	C	C	.	.			trans	102.2	0.9	-173.4	0	0	0	0	0	114.2	S284 G290 M291	S284-G288 WeakPolarHBondContact O-CA 3.06Å; S284-G288 PolarHBondContact O-N 2.84Å; G288-G290 PolarHBondContact O-N 3.31Å; G288-M291 WeakPolarHBondContact O-CB 3.21Å; G288-M291 WeakPolarHBondContact O-CG 3.48Å; G288-M291 PolarHBondContact O-N 3.01Å
289	D	92.5	Very high	91.6	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.062	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56	135.9	176.7	-66.4	-12	0	0	0	110.8	V218 W224 G226 N227 P228 I232 T283 S284 T287 M291	V218-D289 HydrophobicContact CG2-CB 4.45Å; W224-D289 PolarHBondContact NE1-OD2 3.45Å; G226-D289 WeakPolarHBondContact CA-OD2 3.48Å; N227-D289 WeakPolarHBondContact CA-OD1 3.48Å; N227-D289 PolarHBondContact N-OD1 3.01Å; N227-D289 PolarHBondContact N-OD2 3.12Å; P228-D289 VanDerWaalsContact N-OD1 3.14Å; I232-D289 HydrophobicContact CD1-CB 4.21Å; T283-D289 CarbonylContact C-O 3.52Å; T283-D289 VanDerWaalsContact CA-O 3.28Å; T283-D289 WeakPolarHBondContact CA-O 3.46Å; S284-D289 PolarHBondContact N-O 3.3Å; T287-D289 VanDerWaalsContact OG1-CG 3.3Å; T287-D289 PolarHBondContact OG1-N 2.91Å; D289-M291 PolarHBondContact O-N 3.47Å
290	G	91.9	Very high	91.1	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.3	-5.9	176.6	0	0	0	0	0	116.1	P282 G288 G292 N293 L294	P282-G290 WeakPolarHBondContact O-CA 3.44Å; G288-G290 PolarHBondContact O-N 3.31Å; G290-G292 VanDerWaalsContact C-N 3.3Å; G290-G292 PolarHBondContact O-N 3.05Å; G290-N293 CarbonylContact O-C 3.59Å; G290-N293 WeakPolarHBondContact O-CA 3.22Å; G290-N293 VanDerWaalsContact O-CB 3.32Å; G290-N293 WeakPolarHBondContact O-CB 3.31Å; G290-N293 PolarHBondContact O-N 2.82Å; G290-L294 PolarHBondContact O-N 3.38Å
291	M	90.8	Very high	90.6	Very high	11 Å²	11	14.8 Å²	14.8	5%	0.054	8%	0.078	C	C	.	.	H	α-helix	trans	-61.4	-39.1	179	-68.6	-58.2	-63.7	0	0	112.2	I111 K114 I115 T283 G288 D289 N293 L294 M295	I111-M291 HydrophobicContact CB-CE 4.26Å; I111-M291 HydrophobicContact CG1-SD 4.49Å; I111-M291 HydrophobicContact CG2-CE 3.54Å; I111-M291 HydrophobicContact CG2-SD 4.36Å; K114-M291 HydrophobicContact CB-CE 4.48Å; K114-M291 HydrophobicContact CG-CG 4.26Å; I115-M291 HydrophobicContact CD1-CE 3.83Å; I115-M291 HydrophobicContact CG1-CE 3.53Å; T283-M291 HydrophobicContact CG2-SD 4.3Å; G288-M291 WeakPolarHBondContact O-CB 3.21Å; G288-M291 WeakPolarHBondContact O-CG 3.48Å; G288-M291 PolarHBondContact O-N 3.01Å; D289-M291 PolarHBondContact O-N 3.47Å; M291-N293 VanDerWaalsContact C-N 3.32Å; M291-N293 PolarHBondContact O-N 2.93Å; M291-L294 PolarHBondContact O-N 2.77Å; M291-M295 WeakPolarHBondContact O-CG 3.48Å; M291-M295 PolarHBondContact O-N 3.18Å
292	G	89	Confident	90.1	Very high	3 Å²	3	14.8 Å²	14.8	3%	0.031	8%	0.078	C	C	.	.	H	α-helix	trans	-62.5	-37.9	172.4	0	0	0	0	0	112.7	Q145 G290 A296	Q145-G292 WeakPolarHBondContact O-CA 3.4Å; G290-G292 VanDerWaalsContact C-N 3.3Å; G290-G292 PolarHBondContact O-N 3.05Å; G292-A296 WeakPolarHBondContact O-CB 3.26Å; G292-A296 PolarHBondContact O-N 3.29Å
293	N	91.2	Very high	89.3	Confident	2 Å²	2	16.4 Å²	16.4	1%	0.011	9%	0.086	C	C	.	.	H	α-helix	trans	-66.4	-39.5	174.7	-63.2	90	0	0	0	111.9	V149 D231 I232 F268 V281 G290 M291 A296 A297	V149-N293 WeakPolarHBondContact CG2-ND2 3.44Å; D231-N293 PolarHBondContact OD1-ND2 2.97Å; I232-N293 HydrophobicContact CG2-CB 4.26Å; I232-N293 PolarHBondContact N-OD1 3.13Å; I232-N293 VanDerWaalsContact N-OD1 3.15Å; F268-N293 HydrophobicContact CE1-CB 4.14Å; F268-N293 HydrophobicContact CZ-CB 3.85Å; F268-N293 VanDerWaalsContact CZ-ND2 3.35Å; F268-N293 WeakPolarHBondContact CZ-ND2 3.41Å; V281-N293 HydrophobicContact CG1-CB 4.04Å; G290-N293 CarbonylContact O-C 3.59Å; G290-N293 WeakPolarHBondContact O-CA 3.22Å; G290-N293 VanDerWaalsContact O-CB 3.32Å; G290-N293 WeakPolarHBondContact O-CB 3.31Å; G290-N293 PolarHBondContact O-N 2.82Å; M291-N293 VanDerWaalsContact C-N 3.32Å; M291-N293 PolarHBondContact O-N 2.93Å; N293-A296 PolarHBondContact O-N 2.92Å; N293-A297 WeakPolarHBondContact O-CB 3.43Å; N293-A297 PolarHBondContact O-N 3.12Å
294	L	91.4	Very high	88.7	Confident	2 Å²	2	19.6 Å²	19.6	1%	0.01	11%	0.105	C	C	.	.	H	α-helix	trans	-62.6	-48.4	176.8	178.5	63.5	0	0	0	111.1	I111 V184 V212 A214 V281 T283 G290 M291 A296 A297 I298	I111-L294 HydrophobicContact CG2-CD2 4.42Å; V184-L294 HydrophobicContact CG1-CD1 4.27Å; V184-L294 HydrophobicContact CG1-CD2 4.36Å; V212-L294 HydrophobicContact CG1-CD1 4Å; A214-L294 HydrophobicContact CB-CD1 4.15Å; A214-L294 HydrophobicContact CB-CD2 3.98Å; V281-L294 HydrophobicContact CB-CD1 4.24Å; V281-L294 HydrophobicContact CG1-CB 4.05Å; V281-L294 HydrophobicContact CG2-CD1 4.33Å; T283-L294 HydrophobicContact CG2-CB 3.99Å; T283-L294 HydrophobicContact CG2-CD2 4.23Å; G290-L294 PolarHBondContact O-N 3.38Å; M291-L294 PolarHBondContact O-N 2.77Å; L294-A296 VanDerWaalsContact C-N 3.31Å; L294-A296 PolarHBondContact O-N 2.78Å; L294-A297 PolarHBondContact O-N 2.92Å; L294-I298 HydrophobicContact CD1-CD1 4.25Å; L294-I298 HydrophobicContact CG-CD1 4.08Å; L294-I298 VanDerWaalsContact O-CG1 3.31Å; L294-I298 WeakPolarHBondContact O-CG1 3.45Å; L294-I298 PolarHBondContact O-N 2.81Å
295	M	88.3	Confident	88.2	Confident	2 Å²	2	23.7 Å²	23.7	1%	0.01	12%	0.123	C	C	.	.	H	α-helix	trans	-63.3	-39.5	177.1	-63.7	-46.6	-64.7	0	0	111.9	I115 L142 I165 M291 I298 V299	I115-M295 HydrophobicContact CD1-SD 3.73Å; I115-M295 HydrophobicContact CG1-SD 4.3Å; L142-M295 HydrophobicContact CD2-CB 4.39Å; L142-M295 HydrophobicContact CD2-CE 3.13Å; L142-M295 HydrophobicContact CD2-CG 4.48Å; I165-M295 HydrophobicContact CD1-CE 3.91Å; I165-M295 HydrophobicContact CD1-SD 4.36Å; M291-M295 WeakPolarHBondContact O-CG 3.48Å; M291-M295 PolarHBondContact O-N 3.18Å; M295-I298 PolarHBondContact O-N 3.49Å; M295-I298 HydrophobicContact SD-CD1 4.17Å; M295-V299 WeakPolarHBondContact O-CG2 3.43Å; M295-V299 PolarHBondContact O-N 2.98Å
296	A	86.8	Confident	87.9	Confident	2 Å²	2	23.8 Å²	23.8	2%	0.017	12%	0.123	C	C	.	.	H	α-helix	trans	-61.7	-45.1	174.9	0	0	0	0	0	112	A146 V152 G292 N293 L294 V299 H300	A146-A296 HydrophobicContact CB-CB 4.39Å; V152-A296 HydrophobicContact CB-CB 3.93Å; V152-A296 HydrophobicContact CG1-CB 3.72Å; V152-A296 HydrophobicContact CG2-CB 4.12Å; G292-A296 WeakPolarHBondContact O-CB 3.26Å; G292-A296 PolarHBondContact O-N 3.29Å; N293-A296 PolarHBondContact O-N 2.92Å; L294-A296 VanDerWaalsContact C-N 3.31Å; L294-A296 PolarHBondContact O-N 2.78Å; A296-V299 PolarHBondContact O-N 3.04Å; A296-H300 VanDerWaalsContact O-CB 3.28Å; A296-H300 WeakPolarHBondContact O-CB 3.36Å; A296-H300 PolarHBondContact O-N 2.94Å
297	A	88	Confident	87.3	Confident	18 Å²	18	20 Å²	20	15%	0.149	11%	0.111	C	C	.	.	H	α-helix	trans	-63.6	-43.2	178.1	0	0	0	0	0	112.1	V212 V281 N293 L294 H300 F301	V212-A297 HydrophobicContact CG1-CB 4.47Å; V281-A297 HydrophobicContact CG2-CB 4.05Å; N293-A297 WeakPolarHBondContact O-CB 3.43Å; N293-A297 PolarHBondContact O-N 3.12Å; L294-A297 PolarHBondContact O-N 2.92Å; A297-H300 PolarHBondContact O-N 2.78Å; A297-F301 WeakPolarHBondContact O-CB 3.47Å; A297-F301 PolarHBondContact O-N 3.01Å
298	I	88.1	Confident	87	Confident	3 Å²	3	27.1 Å²	27.1	2%	0.015	14%	0.139	C	C	.	.	H	α-helix	trans	-57.5	-52.5	174.9	-74.5	167.1	0	0	0	110.8	I98 L182 V184 L294 M295 H300 F301 C302	I98-I298 HydrophobicContact CD1-CG2 3.21Å; L182-I298 HydrophobicContact CD2-CB 4.36Å; L182-I298 HydrophobicContact CD2-CG1 4.21Å; L182-I298 HydrophobicContact CD2-CG2 4.02Å; V184-I298 HydrophobicContact CG2-CD1 3.62Å; V184-I298 HydrophobicContact CG2-CG1 4.17Å; L294-I298 HydrophobicContact CD1-CD1 4.25Å; L294-I298 HydrophobicContact CG-CD1 4.08Å; L294-I298 VanDerWaalsContact O-CG1 3.31Å; L294-I298 WeakPolarHBondContact O-CG1 3.45Å; L294-I298 PolarHBondContact O-N 2.81Å; M295-I298 PolarHBondContact O-N 3.49Å; M295-I298 HydrophobicContact SD-CD1 4.17Å; I298-H300 VanDerWaalsContact C-N 3.33Å; I298-H300 PolarHBondContact O-N 2.99Å; I298-F301 PolarHBondContact O-N 3.24Å; I298-C302 PolarHBondContact O-N 2.88Å; I298-C302 PolarHBondContact O-SG 3.45Å; I298-C302 VanDerWaalsContact O-SG 3.33Å
299	V	84.3	Confident	86.6	Confident	1 Å²	1	34.2 Å²	34.2	1%	0.006	16%	0.164	C	C	.	.	H	α-helix	trans	-65.7	-40.5	-177.4	178.5	0	0	0	0	110.8	L142 L156 V163 M295 A296 F301 C302 Q303	L142-V299 HydrophobicContact CD1-CG2 4.4Å; L156-V299 HydrophobicContact CD2-CB 3.75Å; L156-V299 HydrophobicContact CD2-CG1 3.27Å; L156-V299 HydrophobicContact CD2-CG2 4.17Å; V163-V299 HydrophobicContact CG2-CG2 4.34Å; M295-V299 WeakPolarHBondContact O-CG2 3.43Å; M295-V299 PolarHBondContact O-N 2.98Å; A296-V299 PolarHBondContact O-N 3.04Å; V299-F301 PolarHBondContact O-N 3.29Å; V299-C302 PolarHBondContact O-N 3.02Å; V299-Q303 HydrophobicContact CG1-CG 4.18Å; V299-Q303 WeakPolarHBondContact O-CB 3.4Å; V299-Q303 VanDerWaalsContact O-CG 3.28Å; V299-Q303 WeakPolarHBondContact O-CG 3.44Å; V299-Q303 PolarHBondContact O-N 3.36Å
300	H	84.9	Confident	86.2	Confident	69 Å²	69	34.2 Å²	34.2	32%	0.319	16%	0.164	S	C	.	.	H	α-helix	trans	-59	-46	175.5	-178.8	66.8	0	0	0	111.9	A296 A297 I298 Q303 T304	A296-H300 VanDerWaalsContact O-CB 3.28Å; A296-H300 WeakPolarHBondContact O-CB 3.36Å; A296-H300 PolarHBondContact O-N 2.94Å; A297-H300 PolarHBondContact O-N 2.78Å; I298-H300 VanDerWaalsContact C-N 3.33Å; I298-H300 PolarHBondContact O-N 2.99Å; H300-Q303 PolarHBondContact O-N 3.19Å; H300-T304 WeakPolarHBondContact O-CB 3.11Å; H300-T304 VanDerWaalsContact O-CG2 3.31Å; H300-T304 WeakPolarHBondContact O-CG2 3.37Å; H300-T304 PolarHBondContact O-N 2.91Å; H300-T304 PolarHBondContact O-OG1 2.93Å
301	F	86.7	Confident	85.9	Confident	21 Å²	21	38.3 Å²	38.3	9%	0.092	18%	0.183	C	C	.	.	H	α-helix	trans	-63.5	-46.4	177.7	-168.1	-81	0	0	0	111.6	L182 P210 L274 A297 I298 V299 Q303 T304 K305 L306	L182-F301 HydrophobicContact CD1-CD1 3.57Å; L182-F301 HydrophobicContact CD1-CE1 3.76Å; L182-F301 HydrophobicContact CD1-CG 4.24Å; P210-F301 HydrophobicContact CB-CE1 3.41Å; P210-F301 VanDerWaalsContact CB-CE1 3.41Å; P210-F301 HydrophobicContact CB-CZ 3.39Å; P210-F301 HydrophobicContact CG-CE1 3.74Å; P210-F301 HydrophobicContact CG-CZ 4.2Å; L274-F301 HydrophobicContact CB-CD2 4.45Å; L274-F301 HydrophobicContact CB-CE2 4.23Å; L274-F301 HydrophobicContact CD1-CD2 4.38Å; A297-F301 WeakPolarHBondContact O-CB 3.47Å; A297-F301 PolarHBondContact O-N 3.01Å; I298-F301 PolarHBondContact O-N 3.24Å; V299-F301 PolarHBondContact O-N 3.29Å; F301-Q303 VanDerWaalsContact C-N 3.33Å; F301-Q303 PolarHBondContact O-N 2.93Å; F301-T304 PolarHBondContact O-N 3.09Å; F301-T304 PolarHBondContact O-OG1 3.28Å; F301-K305 HydrophobicContact CD1-CB 4.38Å; F301-K305 HydrophobicContact CE1-CB 3.98Å; F301-K305 HydrophobicContact CE1-CG 4.45Å; F301-K305 HydrophobicContact CE2-CG 4.25Å; F301-K305 HydrophobicContact CZ-CB 4.12Å; F301-K305 HydrophobicContact CZ-CG 4.15Å; F301-K305 PolarHBondContact O-N 3.43Å; F301-L306 HydrophobicContact CD1-CD1 4.01Å; F301-L306 HydrophobicContact CD1-CG 4.28Å; F301-L306 HydrophobicContact CE1-CD1 4.06Å; F301-L306 HydrophobicContact CE1-CG 4.11Å
302	C	84.3	Confident	85.6	Confident	1 Å²	1	37.9 Å²	37.9	1%	0.007	18%	0.181	C	C	.	.	H	α-helix	trans	-61.1	-41.5	179.2	-70.9	0	0	0	0	112.3	F161 I298 V299 L306 S307 L310	F161-C302 HydrophobicContact CE2-CB 3.96Å; F161-C302 HydrophobicContact CZ-CB 3.61Å; I298-C302 PolarHBondContact O-N 2.88Å; I298-C302 PolarHBondContact O-SG 3.45Å; I298-C302 VanDerWaalsContact O-SG 3.33Å; V299-C302 PolarHBondContact O-N 3.02Å; C302-L306 CarbonylContact O-C 3.35Å; C302-L306 WeakPolarHBondContact O-CA 3.38Å; C302-L306 WeakPolarHBondContact O-CB 3.32Å; C302-L306 PolarHBondContact O-N 3.4Å; C302-L306 VanDerWaalsContact O-N 3.15Å; C302-S307 PolarHBondContact O-N 3.08Å; C302-L310 HydrophobicContact CB-CD1 3.97Å
303	Q	80.5	Confident	85.4	Confident	33 Å²	33	43.1 Å²	43.1	15%	0.154	20%	0.202	C	C	.	.	H	α-helix	trans	-69.7	-40	179.6	-74.2	173.3	-11.9	0	0	112.8	F159 F161 V299 H300 F301	F159-Q303 PolarHBondContact O-NE2 2.94Å; F161-Q303 HydrophobicContact CE1-CG 3.77Å; F161-Q303 HydrophobicContact CZ-CG 3.93Å; V299-Q303 HydrophobicContact CG1-CG 4.18Å; V299-Q303 WeakPolarHBondContact O-CB 3.4Å; V299-Q303 VanDerWaalsContact O-CG 3.28Å; V299-Q303 WeakPolarHBondContact O-CG 3.44Å; V299-Q303 PolarHBondContact O-N 3.36Å; H300-Q303 PolarHBondContact O-N 3.19Å; F301-Q303 VanDerWaalsContact C-N 3.33Å; F301-Q303 PolarHBondContact O-N 2.93Å
304	T	83.1	Confident	85.1	Confident	67 Å²	67	46.8 Å²	46.8	41%	0.411	23%	0.227	S	C	.	.	H	α-helix	trans	-80.9	-46.3	-174.5	51.7	0	0	0	0	112.6	H300 F301	H300-T304 WeakPolarHBondContact O-CB 3.11Å; H300-T304 VanDerWaalsContact O-CG2 3.31Å; H300-T304 WeakPolarHBondContact O-CG2 3.37Å; H300-T304 PolarHBondContact O-N 2.91Å; H300-T304 PolarHBondContact O-OG1 2.93Å; F301-T304 PolarHBondContact O-N 3.09Å; F301-T304 PolarHBondContact O-OG1 3.28Å
305	K	84.8	Confident	84.9	Confident	86 Å²	86	49.4 Å²	49.4	37%	0.374	25%	0.249	S	C	.	.	H	α-helix	trans	-103.6	-28.8	-171.4	-63.7	-65.9	-175.9	175.1	0	114	D275 F301	D275-K305 WeakPolarHBondContact OD1-CE 3.26Å; D275-K305 IonicContact OD1-NZ 3.2Å; D275-K305 PolarHBondContact OD1-NZ 3.04Å; D275-K305 IonicContact OD2-NZ 3.67Å; D275-K305 PolarHBondContact OD2-NZ 3.07Å; F301-K305 HydrophobicContact CD1-CB 4.38Å; F301-K305 HydrophobicContact CE1-CB 3.98Å; F301-K305 HydrophobicContact CE1-CG 4.45Å; F301-K305 HydrophobicContact CE2-CG 4.25Å; F301-K305 HydrophobicContact CZ-CB 4.12Å; F301-K305 HydrophobicContact CZ-CG 4.15Å; F301-K305 PolarHBondContact O-N 3.43Å
306	L	84.9	Confident	84.9	Confident	6 Å²	6	51.8 Å²	51.8	3%	0.031	26%	0.261	C	S	.	.	S	Bend	trans	-106.9	2.4	-170	-60.9	173.3	0	0	0	114.9	D181 L182 P210 F301 C302 K308 R309 L310	D181-L306 HydrophobicContact CB-CD1 4.33Å; D181-L306 WeakPolarHBondContact O-CD1 3.36Å; L182-L306 HydrophobicContact CB-CD1 4.22Å; P210-L306 HydrophobicContact CG-CD1 4.37Å; P210-L306 HydrophobicContact CG-CD2 4.23Å; F301-L306 HydrophobicContact CD1-CD1 4.01Å; F301-L306 HydrophobicContact CD1-CG 4.28Å; F301-L306 HydrophobicContact CE1-CD1 4.06Å; F301-L306 HydrophobicContact CE1-CG 4.11Å; C302-L306 CarbonylContact O-C 3.35Å; C302-L306 WeakPolarHBondContact O-CA 3.38Å; C302-L306 WeakPolarHBondContact O-CB 3.32Å; C302-L306 PolarHBondContact O-N 3.4Å; C302-L306 VanDerWaalsContact O-N 3.15Å; L306-K308 VanDerWaalsContact C-N 3.3Å; L306-K308 PolarHBondContact O-N 3.24Å; L306-K308 VanDerWaalsContact O-N 3.17Å; L306-R309 PolarHBondContact O-N 2.91Å; L306-L310 HydrophobicContact CB-CD1 3.96Å; L306-L310 HydrophobicContact CB-CG 4.12Å; L306-L310 WeakPolarHBondContact O-CG 3.3Å; L306-L310 PolarHBondContact O-N 3.38Å
307	S	79.9	Confident	84.9	Confident	50 Å²	50	55.1 Å²	55.1	35%	0.35	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.6	-47.2	-177.8	55.3	0	0	0	0	113.7	L93 C302 R309 L310 E311	L93-S307 WeakPolarHBondContact CD2-O 3.45Å; C302-S307 PolarHBondContact O-N 3.08Å; S307-R309 VanDerWaalsContact C-N 3.35Å; S307-R309 PolarHBondContact O-N 2.97Å; S307-L310 PolarHBondContact O-N 2.94Å; S307-E311 PolarHBondContact O-N 3.42Å
308	K	83.7	Confident	85	Confident	186 Å²	186	54.5 Å²	54.5	81%	0.809	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-31.3	177.5	-64.1	-176.4	-179.8	-179.7	0	114	L306	L306-K308 VanDerWaalsContact C-N 3.3Å; L306-K308 PolarHBondContact O-N 3.24Å; L306-K308 VanDerWaalsContact O-N 3.17Å
309	R	83.3	Confident	84.9	Confident	155 Å²	155	55.6 Å²	55.6	59%	0.585	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.1	-24.8	178.6	-69.2	-170.8	-179.6	-177.7	1.4	112.4	L306 S307	L306-R309 PolarHBondContact O-N 2.91Å; S307-R309 VanDerWaalsContact C-N 3.35Å; S307-R309 PolarHBondContact O-N 2.97Å
310	L	84.3	Confident	85.1	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.277	C	S	.	.	S	Bend	trans	-91	4.9	-179.4	-62.9	176.8	0	0	0	113.2	L93 R94 P96 F161 D181 C302 L306 S307 F312	L93-L310 CarbonylContact C-O 3.58Å; L93-L310 WeakPolarHBondContact CA-O 3.44Å; L93-L310 HydrophobicContact CD2-CB 4.45Å; R94-L310 WeakPolarHBondContact CG-O 3.33Å; R94-L310 PolarHBondContact N-O 3.29Å; P96-L310 HydrophobicContact CB-CD1 4.1Å; P96-L310 HydrophobicContact CB-CD2 3.78Å; F161-L310 HydrophobicContact CZ-CD1 4.25Å; D181-L310 HydrophobicContact CB-CD2 4.15Å; C302-L310 HydrophobicContact CB-CD1 3.97Å; L306-L310 HydrophobicContact CB-CD1 3.96Å; L306-L310 HydrophobicContact CB-CG 4.12Å; L306-L310 WeakPolarHBondContact O-CG 3.3Å; L306-L310 PolarHBondContact O-N 3.38Å; S307-L310 PolarHBondContact O-N 2.94Å; L310-F312 PolarHBondContact O-N 3.49Å
311	E	84.9	Confident	84.8	Confident	86 Å²	86	53.1 Å²	53.1	40%	0.402	27%	0.267	S	S	.	.	B	Isolated β-bridge	trans	-63.2	128.4	169.6	-171.2	175.2	-169.3	0	0	110.2	S307 K313	S307-E311 PolarHBondContact O-N 3.42Å; E311-K313 PolarHBondContact O-N 2.94Å
312	F	85	Confident	84.5	Confident	3 Å²	3	53.8 Å²	53.8	1%	0.013	27%	0.27	C	S	.	.			trans	-69.5	130.1	-178.9	177.7	-100.8	0	0	0	110.8	Y88 S92 R94 L310 F341 R386	Y88-F312 HydrophobicContact CD2-CD1 4.06Å; Y88-F312 HydrophobicContact CD2-CE1 4.2Å; Y88-F312 HydrophobicContact CE2-CD1 4.07Å; S92-F312 WeakPolarHBondContact O-CB 3.23Å; S92-F312 PolarHBondContact O-N 3.24Å; R94-F312 HydrophobicContact CB-CB 4.36Å; R94-F312 HydrophobicContact CB-CD2 4.22Å; L310-F312 PolarHBondContact O-N 3.49Å; F312-F341 AromaticContact CE1-CE2 3.78Å; F312-F341 HydrophobicContact CE1-CE2 3.78Å; F312-F341 AromaticContact CE1-CZ 3.75Å; F312-F341 HydrophobicContact CE1-CZ 3.75Å; F312-F341 HydrophobicContact CZ-CD2 4.3Å; F312-F341 HydrophobicContact CZ-CE1 4.23Å; F312-F341 AromaticContact CZ-CE2 3.62Å; F312-F341 HydrophobicContact CZ-CE2 3.62Å; F312-F341 AromaticContact CZ-CZ 3.59Å; F312-F341 HydrophobicContact CZ-CZ 3.59Å; F312-R386 HydrophobicContact CD2-CG 4.49Å; F312-R386 HydrophobicContact CE2-CG 3.71Å; F312-R386 HydrophobicContact CZ-CG 3.92Å
313	K	86.1	Confident	84.5	Confident	112 Å²	112	56.1 Å²	56.1	49%	0.487	28%	0.284	S	S	.	.			trans	-110.2	139.4	175.3	-62.4	-179.3	-178.2	-179.5	0	110.5	E311 A315 N339 G340	E311-K313 PolarHBondContact O-N 2.94Å; K313-A315 VanDerWaalsContact C-N 3.29Å; K313-A315 PolarHBondContact O-N 3.21Å; K313-N339 HydrophobicContact CB-CB 4.19Å; K313-N339 PolarHBondContact N-OD1 3.32Å; K313-N339 WeakPolarHBondContact O-CB 3.45Å; K313-G340 PolarHBondContact O-N 2.96Å
314	P	84.2	Confident	84.5	Confident	80 Å²	80	56.3 Å²	56.3	52%	0.519	28%	0.284	S	S	.	.	S	Bend	trans	-73.1	-21.5	176.8	28.6	-34.2	0	0	0	113	L316 G340	P314-L316 PolarHBondContact O-N 2.88Å; P314-G340 VanDerWaalsContact O-CA 3.31Å; P314-G340 WeakPolarHBondContact O-CA 3.42Å
315	A	87.1	Confident	84.6	Confident	57 Å²	57	60.7 Å²	60.7	47%	0.471	30%	0.3	S	S	.	.	S	Bend	trans	-62.6	130.6	176.4	0	0	0	0	0	111	K313 Q317 N339 G340	K313-A315 VanDerWaalsContact C-N 3.29Å; K313-A315 PolarHBondContact O-N 3.21Å; A315-Q317 PolarHBondContact O-N 3Å; A315-N339 CarbonylContact O-C 3.57Å; A315-N339 WeakPolarHBondContact O-CB 3.32Å; A315-G340 PolarHBondContact O-N 3.43Å
316	L	88.4	Confident	84.5	Confident	51 Å²	51	58.5 Å²	58.5	27%	0.267	29%	0.292	S	S	.	.			trans	-64.9	123.8	-179.6	-174.3	77.1	0	0	0	110.1	P314 C318 L337 L342 L407 V409	P314-L316 PolarHBondContact O-N 2.88Å; L316-C318 HydrophobicContact CD1-CB 4.25Å; L316-C318 HydrophobicContact CD2-CB 4.42Å; L316-C318 HydrophobicContact CG-CB 4.16Å; L316-L337 HydrophobicContact CD1-CD1 3.47Å; L316-L337 VanDerWaalsContact CD1-CD1 3.47Å; L316-L342 HydrophobicContact CD1-CD2 3.9Å; L316-L342 HydrophobicContact CD1-CG 4.34Å; L316-L407 HydrophobicContact CD2-CD2 4.35Å; L316-L407 WeakPolarHBondContact CD2-O 3.38Å; L316-V409 HydrophobicContact CD2-CB 3.83Å; L316-V409 HydrophobicContact CD2-CG2 3.46Å; L316-V409 VanDerWaalsContact CD2-CG2 3.46Å
317	Q	87.5	Confident	84.4	Confident	73 Å²	73	64.2 Å²	64.2	34%	0.341	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	96.6	168.4	-65.6	-177.5	-27.8	0	0	107.2	A315 V338 N339	A315-Q317 PolarHBondContact O-N 3Å; Q317-V338 HydrophobicContact CB-CB 4.17Å; Q317-V338 PolarHBondContact O-N 2.55Å; Q317-N339 HydrophobicContact CB-CB 4.08Å; Q317-N339 HydrophobicContact CG-CB 4.18Å; Q317-N339 PolarHBondContact N-O 3.16Å; Q317-N339 PolarHBondContact O-N 3.11Å; Q317-N339 PolarHBondContact OE1-ND2 3.46Å
318	C	88.5	Confident	84.6	Confident	4 Å²	4	65.7 Å²	65.7	3%	0.027	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	136	-177.1	-166.1	0	0	0	0	109.5	L316 V335 I336 L337 P406 L407	L316-C318 HydrophobicContact CD1-CB 4.25Å; L316-C318 HydrophobicContact CD2-CB 4.42Å; L316-C318 HydrophobicContact CG-CB 4.16Å; C318-V335 VanDerWaalsContact SG-CG2 3.59Å; C318-I336 WeakPolarHBondContact CA-O 3.48Å; C318-L337 HydrophobicContact CB-CD1 3.89Å; C318-P406 VanDerWaalsContact O-CA 3.32Å; C318-P406 WeakPolarHBondContact O-CA 3.47Å; C318-L407 HydrophobicContact CB-CB 4.1Å; C318-L407 HydrophobicContact CB-CD2 4.19Å; C318-L407 PolarHBondContact O-N 3.32Å
319	T	86.8	Confident	84.6	Confident	26 Å²	26	59.3 Å²	59.3	16%	0.16	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	133.3	178.2	-52.1	0	0	0	0	109.1	L179 L321 V335 I336	L179-T319 HydrophobicContact CD1-CG2 4.32Å; T319-L321 PolarHBondContact O-N 2.97Å; T319-V335 CarbonylContact O-C 3.59Å; T319-V335 VanDerWaalsContact O-CA 3.3Å; T319-V335 WeakPolarHBondContact O-CA 3.25Å; T319-I336 PolarHBondContact N-O 2.87Å; T319-I336 PolarHBondContact O-N 2.81Å
320	V	87.5	Confident	84.8	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.006	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	124.7	173	-176.8	0	0	0	0	108.7	V323 I333 V335 V350 G404 L405 L407	V320-V323 HydrophobicContact CG1-CG2 4.42Å; V320-I333 HydrophobicContact CG1-CB 4.2Å; V320-I333 HydrophobicContact CG1-CG2 4.38Å; V320-I333 HydrophobicContact CG2-CD1 4.4Å; V320-V335 HydrophobicContact CG2-CG1 4.25Å; V320-V350 HydrophobicContact CG2-CG1 4.32Å; V320-G404 WeakPolarHBondContact O-CA 3.32Å; V320-G404 PolarHBondContact O-N 2.64Å; V320-L405 PolarHBondContact N-O 3.48Å; V320-L407 HydrophobicContact CG2-CB 4.16Å
321	L	79.6	Confident	85.1	Confident	18 Å²	18	54.5 Å²	54.5	9%	0.094	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	-51.9	176.6	-67.9	179.8	0	0	0	111.6	F166 L172 L179 T319 D334 I336 A403	F166-L321 HydrophobicContact CD1-CD1 4.44Å; F166-L321 HydrophobicContact CE1-CD1 3.89Å; L172-L321 HydrophobicContact CD1-CD2 4.45Å; L179-L321 HydrophobicContact CD1-CD2 4.23Å; T319-L321 PolarHBondContact O-N 2.97Å; L321-D334 WeakPolarHBondContact CA-O 3.33Å; L321-D334 WeakPolarHBondContact CB-O 3.37Å; L321-D334 PolarHBondContact N-O 3.38Å; L321-I336 HydrophobicContact CD1-CB 4.01Å; L321-I336 HydrophobicContact CD1-CG2 4.33Å; L321-I336 HydrophobicContact CD2-CB 4.44Å; L321-I336 HydrophobicContact CD2-CG2 3.86Å; L321-I336 HydrophobicContact CG-CB 4.18Å; L321-I336 HydrophobicContact CG-CG2 4.01Å; L321-A403 WeakPolarHBondContact O-CB 3.37Å
322	E	79.7	Confident	85.4	Confident	34 Å²	34	50.4 Å²	50.4	16%	0.159	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	155.1	-176	-73.2	-176.9	159.9	0	0	110.7	I132 K324 I333 D334	I132-E322 HydrophobicContact CB-CG 4.39Å; I132-E322 WeakPolarHBondContact CB-OE1 3.46Å; I132-E322 HydrophobicContact CD1-CG 3.72Å; I132-E322 VanDerWaalsContact CD1-OE1 3.23Å; I132-E322 WeakPolarHBondContact CD1-OE1 3.38Å; I132-E322 VanDerWaalsContact CG1-OE1 3.31Å; I132-E322 WeakPolarHBondContact CG1-OE1 3.29Å; I132-E322 PolarHBondContact N-OE1 3.43Å; E322-K324 WeakPolarHBondContact OE2-CE 3.41Å; E322-K324 IonicContact OE2-NZ 3.47Å; E322-K324 PolarHBondContact OE2-NZ 3.35Å; E322-I333 WeakPolarHBondContact O-CA 3.49Å; E322-D334 HydrophobicContact CB-CB 4.4Å; E322-D334 PolarHBondContact N-O 3.13Å; E322-D334 PolarHBondContact O-N 2.97Å
323	V	84.6	Confident	85.7	Confident	50 Å²	50	50.2 Å²	50.2	30%	0.303	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	124.2	172.6	-172.7	0	0	0	0	108	V320 T331 I333 A401	V320-V323 HydrophobicContact CG1-CG2 4.42Å; V323-T331 HydrophobicContact CG1-CG2 3.6Å; V323-I333 HydrophobicContact CB-CG2 4.41Å; V323-I333 HydrophobicContact CG1-CG2 4.13Å; V323-I333 HydrophobicContact CG2-CG2 3.97Å; V323-A401 HydrophobicContact CG2-CB 4.09Å; V323-A401 WeakPolarHBondContact CG2-O 3.36Å
324	K	80.8	Confident	85.8	Confident	37 Å²	37	45.1 Å²	45.1	16%	0.161	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	135.7	-173.1	-73.2	-177.2	178.7	140.8	0	112.1	E322 T332 D334	E322-K324 WeakPolarHBondContact OE2-CE 3.41Å; E322-K324 IonicContact OE2-NZ 3.47Å; E322-K324 PolarHBondContact OE2-NZ 3.35Å; K324-T332 PolarHBondContact N-O 3.49Å; K324-T332 PolarHBondContact O-N 2.88Å; K324-T332 VanDerWaalsContact O-O 3.12Å; K324-T332 PolarHBondContact O-OG1 3.22Å; K324-D334 WeakPolarHBondContact CD-OD2 3.41Å; K324-D334 IonicContact NZ-OD2 3.78Å; K324-D334 PolarHBondContact NZ-OD2 2.98Å
325	Q	84.5	Confident	85.9	Confident	160 Å²	160	41.4 Å²	41.4	75%	0.748	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.7	122.9	168.8	-163.8	175	16.8	0	0	110
326	I	84.2	Confident	85.9	Confident	40 Å²	40	38.9 Å²	38.9	21%	0.205	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	129.7	-179.2	-60.1	177.1	0	0	0	109.4	G328 L329 G330 T332 K392	I326-G328 PolarHBondContact O-N 3.15Å; I326-L329 HydrophobicContact CB-CB 4.36Å; I326-L329 HydrophobicContact CG2-CB 4.48Å; I326-L329 HydrophobicContact CG2-CD1 4.15Å; I326-L329 HydrophobicContact CG2-CG 4.49Å; I326-L329 PolarHBondContact O-N 3.22Å; I326-L329 VanDerWaalsContact O-N 3.15Å; I326-G330 PolarHBondContact N-O 3.14Å; I326-G330 PolarHBondContact O-N 3.46Å; I326-T332 HydrophobicContact CD1-CG2 4.18Å; I326-T332 WeakPolarHBondContact CD1-OG1 3.3Å; I326-K392 HydrophobicContact CD1-CD 3.6Å
327	S	81.3	Confident	85.8	Confident	125 Å²	125	36.4 Å²	36.4	87%	0.874	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.9	124.2	175.2	-174.5	0	0	0	0	110.8
328	G	83.7	Confident	85.7	Confident	82 Å²	82	33.6 Å²	33.6	85%	0.845	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	91.7	-25.4	-179.8	0	0	0	0	0	115.4	I326	I326-G328 PolarHBondContact O-N 3.15Å
329	L	84.7	Confident	85.6	Confident	51 Å²	51	33.7 Å²	33.7	27%	0.267	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	-16.6	178.4	-62.7	174.6	0	0	0	113.2	I326 T332 L365 V394	I326-L329 HydrophobicContact CB-CB 4.36Å; I326-L329 HydrophobicContact CG2-CB 4.48Å; I326-L329 HydrophobicContact CG2-CD1 4.15Å; I326-L329 HydrophobicContact CG2-CG 4.49Å; I326-L329 PolarHBondContact O-N 3.22Å; I326-L329 VanDerWaalsContact O-N 3.15Å; L329-T332 HydrophobicContact CB-CG2 3.93Å; L329-T332 HydrophobicContact CD1-CG2 4.42Å; L329-L365 HydrophobicContact CD1-CD1 3.42Å; L329-L365 VanDerWaalsContact CD1-CD1 3.42Å; L329-L365 HydrophobicContact CD2-CD1 4.46Å; L329-V394 HydrophobicContact CD1-CG2 4.37Å; L329-V394 HydrophobicContact CD2-CG2 4.45Å
330	G	87.6	Confident	85.7	Confident	35 Å²	35	32.4 Å²	32.4	36%	0.361	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	78.2	-145.8	-172.4	0	0	0	0	0	111.2	I326	I326-G330 PolarHBondContact N-O 3.14Å; I326-G330 PolarHBondContact O-N 3.46Å
331	T	90.4	Very high	85.9	Confident	19 Å²	19	34.8 Å²	34.8	12%	0.117	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	129.3	176.7	-55.3	0	0	0	0	110.7	V323 L398 E399	V323-T331 HydrophobicContact CG1-CG2 3.6Å; T331-L398 HydrophobicContact CG2-CB 4.13Å; T331-E399 WeakPolarHBondContact OG1-CG 3.49Å
332	T	91.5	Very high	86.5	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	152.3	-178.7	63.8	0	0	0	0	109.3	K324 I326 L329 K392 V393 V394	K324-T332 PolarHBondContact N-O 3.49Å; K324-T332 PolarHBondContact O-N 2.88Å; K324-T332 VanDerWaalsContact O-O 3.12Å; K324-T332 PolarHBondContact O-OG1 3.22Å; I326-T332 HydrophobicContact CD1-CG2 4.18Å; I326-T332 WeakPolarHBondContact CD1-OG1 3.3Å; L329-T332 HydrophobicContact CB-CG2 3.93Å; L329-T332 HydrophobicContact CD1-CG2 4.42Å; T332-K392 HydrophobicContact CG2-CD 4.47Å; T332-K392 HydrophobicContact CG2-CG 4.44Å; T332-V393 WeakPolarHBondContact CA-O 3.31Å; T332-V394 HydrophobicContact CG2-CG2 3.94Å
333	I	90.9	Very high	87.2	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	132.9	172.1	59.2	-179.4	0	0	0	109.5	V320 E322 V323 V335 I348 V350 K392 V393 L398 A401 L407	V320-I333 HydrophobicContact CG1-CB 4.2Å; V320-I333 HydrophobicContact CG1-CG2 4.38Å; V320-I333 HydrophobicContact CG2-CD1 4.4Å; E322-I333 WeakPolarHBondContact O-CA 3.49Å; V323-I333 HydrophobicContact CB-CG2 4.41Å; V323-I333 HydrophobicContact CG1-CG2 4.13Å; V323-I333 HydrophobicContact CG2-CG2 3.97Å; I333-V335 HydrophobicContact CB-CG1 4.36Å; I333-V335 HydrophobicContact CD1-CG1 4Å; I333-V335 HydrophobicContact CG1-CG1 3.89Å; I333-I348 HydrophobicContact CD1-CD1 4.3Å; I333-V350 HydrophobicContact CD1-CG1 4.21Å; I333-K392 WeakPolarHBondContact O-CA 3.2Å; I333-V393 HydrophobicContact CD1-CB 4.31Å; I333-V393 HydrophobicContact CG1-CB 3.76Å; I333-V393 HydrophobicContact CG1-CG1 4.43Å; I333-V393 HydrophobicContact CG1-CG2 4.49Å; I333-V393 PolarHBondContact N-O 2.79Å; I333-V393 PolarHBondContact O-N 3.33Å; I333-L398 HydrophobicContact CB-CD1 4.48Å; I333-L398 HydrophobicContact CD1-CD1 4.11Å; I333-L398 HydrophobicContact CD1-CD2 4.2Å; I333-L398 HydrophobicContact CG1-CD1 3.93Å; I333-L398 HydrophobicContact CG2-CB 4.25Å; I333-L398 HydrophobicContact CG2-CD1 4.03Å; I333-L398 HydrophobicContact CG2-CD2 4.49Å; I333-A401 HydrophobicContact CG2-CB 4.19Å; I333-L407 HydrophobicContact CD1-CD1 3.82Å
334	D	87.4	Confident	87.7	Confident	5 Å²	5	36.9 Å²	36.9	3%	0.027	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	121.9	171.7	-69.3	-13.4	0	0	0	107.1	L321 E322 K324 L373 K392	L321-D334 WeakPolarHBondContact CA-O 3.33Å; L321-D334 WeakPolarHBondContact CB-O 3.37Å; L321-D334 PolarHBondContact N-O 3.38Å; E322-D334 HydrophobicContact CB-CB 4.4Å; E322-D334 PolarHBondContact N-O 3.13Å; E322-D334 PolarHBondContact O-N 2.97Å; K324-D334 WeakPolarHBondContact CD-OD2 3.41Å; K324-D334 IonicContact NZ-OD2 3.78Å; K324-D334 PolarHBondContact NZ-OD2 2.98Å; D334-L373 HydrophobicContact CB-CD2 3.99Å; D334-L373 WeakPolarHBondContact OD1-CD2 3.19Å; D334-K392 IonicContact OD1-NZ 3.94Å; D334-K392 PolarHBondContact OD1-NZ 2.93Å; D334-K392 IonicContact OD2-NZ 2.71Å; D334-K392 PolarHBondContact OD2-NZ 3.19Å
335	V	87.8	Confident	88.3	Confident	2 Å²	2	37.3 Å²	37.3	1%	0.012	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	147.5	-176.3	-50	0	0	0	0	110.6	C318 T319 V320 I333 L342 G390 V391 V393 L407	C318-V335 VanDerWaalsContact SG-CG2 3.59Å; T319-V335 CarbonylContact O-C 3.59Å; T319-V335 VanDerWaalsContact O-CA 3.3Å; T319-V335 WeakPolarHBondContact O-CA 3.25Å; V320-V335 HydrophobicContact CG2-CG1 4.25Å; I333-V335 HydrophobicContact CB-CG1 4.36Å; I333-V335 HydrophobicContact CD1-CG1 4Å; I333-V335 HydrophobicContact CG1-CG1 3.89Å; V335-L342 HydrophobicContact CG2-CD1 4.17Å; V335-G390 CarbonylContact O-C 3.56Å; V335-G390 WeakPolarHBondContact O-CA 3.23Å; V335-V391 HydrophobicContact CG2-CB 4.03Å; V335-V391 WeakPolarHBondContact CG2-O 3.41Å; V335-V391 PolarHBondContact N-O 3.02Å; V335-V391 PolarHBondContact O-N 3.44Å; V335-V393 HydrophobicContact CG1-CG2 4.18Å; V335-V393 HydrophobicContact CG2-CG2 3.75Å; V335-L407 HydrophobicContact CG1-CD1 3.96Å
336	I	85.5	Confident	88.7	Confident	3 Å²	3	31.3 Å²	31.3	2%	0.015	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	115.5	167.3	-174.9	173.3	0	0	0	108.8	V97 F166 L179 C318 T319 L321 V338	V97-I336 HydrophobicContact CG1-CD1 3.67Å; V97-I336 HydrophobicContact CG2-CD1 4.1Å; F166-I336 HydrophobicContact CD2-CD1 4.37Å; F166-I336 HydrophobicContact CE1-CD1 3.93Å; F166-I336 HydrophobicContact CE1-CG1 4.35Å; F166-I336 HydrophobicContact CE2-CD1 3.44Å; F166-I336 VanDerWaalsContact CE2-CD1 3.44Å; F166-I336 HydrophobicContact CE2-CG1 4.25Å; F166-I336 HydrophobicContact CZ-CB 4.25Å; F166-I336 HydrophobicContact CZ-CD1 3.18Å; F166-I336 HydrophobicContact CZ-CG1 3.61Å; L179-I336 HydrophobicContact CD1-CG2 4.17Å; C318-I336 WeakPolarHBondContact CA-O 3.48Å; T319-I336 PolarHBondContact N-O 2.87Å; T319-I336 PolarHBondContact O-N 2.81Å; L321-I336 HydrophobicContact CD1-CB 4.01Å; L321-I336 HydrophobicContact CD1-CG2 4.33Å; L321-I336 HydrophobicContact CD2-CB 4.44Å; L321-I336 HydrophobicContact CD2-CG2 3.86Å; L321-I336 HydrophobicContact CG-CB 4.18Å; L321-I336 HydrophobicContact CG-CG2 4.01Å; I336-V338 HydrophobicContact CD1-CG2 4.42Å; I336-V338 HydrophobicContact CG1-CG2 4.25Å
337	L	87.9	Confident	89.3	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	109.1	172.1	-174.3	67.5	0	0	0	107.8	L316 C318 N339 L342 V385 G387 A388 Q389	L316-L337 HydrophobicContact CD1-CD1 3.47Å; L316-L337 VanDerWaalsContact CD1-CD1 3.47Å; C318-L337 HydrophobicContact CB-CD1 3.89Å; L337-N339 VanDerWaalsContact CD1-O 3.29Å; L337-N339 WeakPolarHBondContact CD1-O 3.29Å; L337-L342 HydrophobicContact CD1-CD1 4.21Å; L337-L342 HydrophobicContact CD1-CG 4Å; L337-L342 HydrophobicContact CD2-CD1 4.3Å; L337-L342 HydrophobicContact CD2-CG 4.1Å; L337-V385 HydrophobicContact CD2-CG1 4.37Å; L337-G387 CarbonylContact O-C 3.37Å; L337-A388 CarbonylContact O-C 3.53Å; L337-A388 WeakPolarHBondContact O-CA 3.49Å; L337-A388 PolarHBondContact O-N 3.44Å; L337-Q389 PolarHBondContact N-O 3.04Å; L337-Q389 PolarHBondContact O-N 3.1Å
338	V	84	Confident	89.9	Confident	14 Å²	14	25 Å²	25	9%	0.085	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	-49.1	178.4	-179.2	0	0	0	0	110.2	R94 Q317 I336 A388	R94-V338 WeakPolarHBondContact CD-O 3.42Å; Q317-V338 HydrophobicContact CB-CB 4.17Å; Q317-V338 PolarHBondContact O-N 2.55Å; I336-V338 HydrophobicContact CD1-CG2 4.42Å; I336-V338 HydrophobicContact CG1-CG2 4.25Å; V338-A388 PolarHBondContact O-N 3.42Å
339	N	86.3	Confident	90.4	Very high	5 Å²	5	21 Å²	21	3%	0.027	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	162.5	-179.2	-79.2	-55.3	0	0	0	110.9	R94 K313 A315 Q317 L337	R94-N339 WeakPolarHBondContact CD-OD1 3.39Å; K313-N339 HydrophobicContact CB-CB 4.19Å; K313-N339 PolarHBondContact N-OD1 3.32Å; K313-N339 WeakPolarHBondContact O-CB 3.45Å; A315-N339 CarbonylContact O-C 3.57Å; A315-N339 WeakPolarHBondContact O-CB 3.32Å; Q317-N339 HydrophobicContact CB-CB 4.08Å; Q317-N339 HydrophobicContact CG-CB 4.18Å; Q317-N339 PolarHBondContact N-O 3.16Å; Q317-N339 PolarHBondContact O-N 3.11Å; Q317-N339 PolarHBondContact OE1-ND2 3.46Å; L337-N339 VanDerWaalsContact CD1-O 3.29Å; L337-N339 WeakPolarHBondContact CD1-O 3.29Å
340	G	89.9	Confident	90.8	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	12%	0.115	C	C	.	.	S	Bend	trans	81.5	-159.4	-177.1	0	0	0	0	0	114.2	K313 P314 A315 G387	K313-G340 PolarHBondContact O-N 2.96Å; P314-G340 VanDerWaalsContact O-CA 3.31Å; P314-G340 WeakPolarHBondContact O-CA 3.42Å; A315-G340 PolarHBondContact O-N 3.43Å; G340-G387 PolarHBondContact O-N 2.96Å
341	F	91.2	Very high	91	Very high	50 Å²	50	17.2 Å²	17.2	22%	0.219	10%	0.099	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	143.5	-173.9	-61	-89	0	0	0	110.4	F312 V384 V385 R386	F312-F341 AromaticContact CE1-CE2 3.78Å; F312-F341 HydrophobicContact CE1-CE2 3.78Å; F312-F341 AromaticContact CE1-CZ 3.75Å; F312-F341 HydrophobicContact CE1-CZ 3.75Å; F312-F341 HydrophobicContact CZ-CD2 4.3Å; F312-F341 HydrophobicContact CZ-CE1 4.23Å; F312-F341 AromaticContact CZ-CE2 3.62Å; F312-F341 HydrophobicContact CZ-CE2 3.62Å; F312-F341 AromaticContact CZ-CZ 3.59Å; F312-F341 HydrophobicContact CZ-CZ 3.59Å; F341-V384 HydrophobicContact CD1-CG1 4.22Å; F341-V385 WeakPolarHBondContact CA-O 3.4Å; F341-R386 HydrophobicContact CD1-CB 4.18Å; F341-R386 HydrophobicContact CD1-CG 4.33Å; F341-R386 HydrophobicContact CE1-CB 4Å; F341-R386 HydrophobicContact CE1-CG 3.8Å; F341-R386 HydrophobicContact CZ-CG 4.4Å
342	L	93.4	Very high	90.9	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	137.7	165.7	-68.5	175.2	0	0	0	109	L316 V335 L337 I361 L364 V384 V385 L407 V409	L316-L342 HydrophobicContact CD1-CD2 3.9Å; L316-L342 HydrophobicContact CD1-CG 4.34Å; V335-L342 HydrophobicContact CG2-CD1 4.17Å; L337-L342 HydrophobicContact CD1-CD1 4.21Å; L337-L342 HydrophobicContact CD1-CG 4Å; L337-L342 HydrophobicContact CD2-CD1 4.3Å; L337-L342 HydrophobicContact CD2-CG 4.1Å; L342-I361 HydrophobicContact CD2-CD1 4.32Å; L342-L364 HydrophobicContact CB-CD1 3.91Å; L342-L364 HydrophobicContact CB-CD2 4.27Å; L342-L364 VanDerWaalsContact O-CD1 3.32Å; L342-L364 WeakPolarHBondContact O-CD1 3.37Å; L342-V384 CarbonylContact O-C 3.59Å; L342-V384 WeakPolarHBondContact O-CA 3.36Å; L342-V385 PolarHBondContact N-O 2.9Å; L342-V385 PolarHBondContact O-N 3.33Å; L342-L407 HydrophobicContact CD2-CD2 4.01Å; L342-V409 HydrophobicContact CD2-CG2 3.7Å
343	R	94.2	Very high	90.5	Very high	83 Å²	83	18.2 Å²	18.2	31%	0.313	11%	0.108	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	148.3	177.9	-45	-179.2	-178.9	-162.8	-0.4	110.7	V84 G345 D346 K383 V384	V84-R343 VanDerWaalsContact CG2-NH2 3.28Å; R343-G345 PolarHBondContact O-N 2.82Å; R343-D346 WeakPolarHBondContact CB-OD2 3.47Å; R343-D346 PolarHBondContact N-OD2 3.07Å; R343-D346 WeakPolarHBondContact O-CB 3.35Å; R343-D346 PolarHBondContact O-N 3Å; R343-D346 VanDerWaalsContact O-N 3.15Å; R343-K383 WeakPolarHBondContact CA-O 3.24Å; R343-V384 HydrophobicContact CB-CG2 4.38Å; R343-V384 HydrophobicContact CG-CG1 4.27Å; R343-V384 HydrophobicContact CG-CG2 4.05Å
344	V	94.5	Very high	90.1	Very high	64 Å²	64	24.5 Å²	24.5	39%	0.388	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	128.5	166.2	174.1	0	0	0	0	108.5	R362 L364 N382 K383	V344-R362 WeakPolarHBondContact CG1-O 3.38Å; V344-L364 HydrophobicContact CG2-CB 4.42Å; V344-L364 HydrophobicContact CG2-CD1 4.28Å; V344-L364 HydrophobicContact CG2-CG 4.06Å; V344-N382 WeakPolarHBondContact CG2-O 3.45Å; V344-K383 PolarHBondContact N-O 2.81Å
345	G	93.2	Very high	90.1	Very high	45 Å²	45	25.8 Å²	25.8	46%	0.464	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	97.7	-12.1	-173.6	0	0	0	0	0	114.9	R343 T347 I361	R343-G345 PolarHBondContact O-N 2.82Å; G345-T347 PolarHBondContact O-N 2.85Å; G345-I361 PolarHBondContact N-O 2.8Å
346	D	94.3	Very high	90.3	Very high	34 Å²	34	27.7 Å²	27.7	18%	0.182	16%	0.164	C	C	.	.	P	Polyproline II helix	trans	-62.5	137.8	176.1	-74.5	-10.9	0	0	0	110.6	R343 I361 V409	R343-D346 WeakPolarHBondContact CB-OD2 3.47Å; R343-D346 PolarHBondContact N-OD2 3.07Å; R343-D346 WeakPolarHBondContact O-CB 3.35Å; R343-D346 PolarHBondContact O-N 3Å; R343-D346 VanDerWaalsContact O-N 3.15Å; D346-I361 HydrophobicContact CB-CD1 3.98Å; D346-I361 WeakPolarHBondContact O-CG1 3.25Å; D346-I361 PolarHBondContact O-N 2.81Å; D346-V409 HydrophobicContact CB-CG1 3.92Å
347	T	94.9	Very high	90.7	Very high	32 Å²	32	28.7 Å²	28.7	20%	0.196	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	116.6	171.3	-59.6	0	0	0	0	108.4	G345 V358 S359 V409 A410 V416	G345-T347 PolarHBondContact O-N 2.85Å; T347-V358 HydrophobicContact CG2-CG1 3.59Å; T347-S359 CarbonylContact C-O 3.57Å; T347-V409 CarbonylContact O-C 3.56Å; T347-V409 WeakPolarHBondContact O-CA 3.27Å; T347-A410 HydrophobicContact CG2-CB 4.34Å; T347-A410 PolarHBondContact O-N 2.92Å; T347-V416 HydrophobicContact CG2-CG2 4.27Å
348	I	95.2	Very high	91	Very high	0 Å²	0	31 Å²	31	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	145.3	179.5	56.5	167.4	0	0	0	111.1	I333 V350 V358 S359 I361 V393 A395 L407 L408 V409	I333-I348 HydrophobicContact CD1-CD1 4.3Å; I348-V350 HydrophobicContact CD1-CG1 4.46Å; I348-V358 WeakPolarHBondContact O-CA 3.48Å; I348-S359 VanDerWaalsContact CG1-O 3.22Å; I348-S359 WeakPolarHBondContact CG1-O 3.28Å; I348-S359 PolarHBondContact N-O 3.07Å; I348-S359 PolarHBondContact O-N 3.46Å; I348-I361 HydrophobicContact CD1-CG1 4.16Å; I348-I361 HydrophobicContact CG1-CG1 4.22Å; I348-I361 HydrophobicContact CG2-CD1 3.54Å; I348-I361 HydrophobicContact CG2-CG1 3.69Å; I348-V393 HydrophobicContact CD1-CG1 4.11Å; I348-A395 HydrophobicContact CD1-CB 4.27Å; I348-L407 HydrophobicContact CB-CD1 4.47Å; I348-L407 HydrophobicContact CB-CD2 4.23Å; I348-L407 HydrophobicContact CB-CG 4.28Å; I348-L407 HydrophobicContact CD1-CD1 4.02Å; I348-L407 HydrophobicContact CG2-CD1 4.37Å; I348-L407 HydrophobicContact CG2-CD2 3.74Å; I348-L407 HydrophobicContact CG2-CG 4.27Å; I348-L408 CarbonylContact C-O 3.38Å; I348-L408 VanDerWaalsContact CA-O 3.25Å; I348-L408 WeakPolarHBondContact CA-O 3.26Å; I348-V409 HydrophobicContact CG2-CG2 3.97Å
349	V	94.7	Very high	91.5	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	126.9	170.1	-161.7	0	0	0	0	108	P356 I357 V358 L408 L419 K420 I423	V349-P356 HydrophobicContact CG1-CB 4.35Å; V349-I357 WeakPolarHBondContact CA-O 3.42Å; V349-V358 HydrophobicContact CG1-CG2 4.21Å; V349-V358 HydrophobicContact CG2-CG2 4.32Å; V349-L408 PolarHBondContact N-O 3.43Å; V349-L408 PolarHBondContact O-N 3.43Å; V349-L419 HydrophobicContact CB-CB 4.34Å; V349-L419 HydrophobicContact CG2-CB 3.95Å; V349-L419 HydrophobicContact CG2-CD1 4.23Å; V349-K420 HydrophobicContact CG1-CG 4.07Å; V349-I423 VanDerWaalsContact C-CD1 3.4Å; V349-I423 HydrophobicContact CB-CD1 3.7Å; V349-I423 HydrophobicContact CG1-CD1 3.62Å; V349-I423 WeakPolarHBondContact O-CD1 3.14Å
350	V	93	Very high	91.9	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.006	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	153.2	179.1	-62	0	0	0	0	110.4	V320 I333 I348 I357 L398 A401 L407	V320-V350 HydrophobicContact CG2-CG1 4.32Å; I333-V350 HydrophobicContact CD1-CG1 4.21Å; I348-V350 HydrophobicContact CD1-CG1 4.46Å; V350-I357 HydrophobicContact CG2-CB 3.88Å; V350-I357 HydrophobicContact CG2-CG2 4.39Å; V350-I357 PolarHBondContact N-O 3.42Å; V350-I357 PolarHBondContact O-N 2.76Å; V350-L398 HydrophobicContact CG2-CD2 4.08Å; V350-A401 HydrophobicContact CG2-CB 4.25Å; V350-L407 HydrophobicContact CG1-CB 4.14Å; V350-L407 HydrophobicContact CG1-CD1 3.96Å; V350-L407 HydrophobicContact CG1-CG 3.85Å
351	A	90.4	Very high	92.2	Very high	4 Å²	4	36.7 Å²	36.7	3%	0.033	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	135.5	174	0	0	0	0	0	110.6	A401 L402 L405 I423 L427	A351-A401 CarbonylContact O-C 3.58Å; A351-A401 WeakPolarHBondContact O-CA 3.44Å; A351-L402 HydrophobicContact CB-CB 4.41Å; A351-L402 PolarHBondContact O-N 3.32Å; A351-L405 HydrophobicContact CB-CB 4.03Å; A351-L405 HydrophobicContact CB-CD1 3.28Å; A351-L405 HydrophobicContact CB-CG 4.27Å; A351-I423 HydrophobicContact CB-CG2 3.56Å; A351-L427 HydrophobicContact CB-CD1 4.49Å
352	G	88.7	Confident	92.3	Very high	6 Å²	6	41 Å²	41	6%	0.062	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	165.8	169.9	0	0	0	0	0	112.7	E354 G355 K400	G352-E354 PolarHBondContact O-N 3.44Å; G352-G355 CarbonylContact C-O 3.46Å; G352-G355 WeakPolarHBondContact CA-O 3Å; G352-G355 PolarHBondContact N-O 2.67Å; G352-G355 PolarHBondContact O-N 3.29Å; G352-K400 CarbonylContact C-O 3.55Å; G352-K400 WeakPolarHBondContact CA-O 3.46Å
353	S	82.9	Confident	92.3	Very high	34 Å²	34	44.3 Å²	44.3	24%	0.238	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-26.8	179.9	59.6	0	0	0	0	113.7	K400	S353-K400 PolarHBondContact N-O 3.07Å
354	E	83	Confident	92.3	Very high	133 Å²	133	40.4 Å²	40.4	62%	0.621	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.1	-3.8	-179.8	-68.3	177	-178.1	0	0	113.5	G352 K400	G352-E354 PolarHBondContact O-N 3.44Å; E354-K400 HydrophobicContact CG-CD 4.17Å; E354-K400 IonicContact OE1-NZ 3.22Å; E354-K400 PolarHBondContact OE1-NZ 3.43Å; E354-K400 WeakPolarHBondContact OE2-CD 3.28Å; E354-K400 IonicContact OE2-NZ 2.91Å; E354-K400 PolarHBondContact OE2-NZ 2.59Å
355	G	87	Confident	92.1	Very high	31 Å²	31	37.4 Å²	37.4	32%	0.32	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	143.8	177.5	-172.2	0	0	0	0	0	112.1	G352	G352-G355 CarbonylContact C-O 3.46Å; G352-G355 WeakPolarHBondContact CA-O 3Å; G352-G355 PolarHBondContact N-O 2.67Å; G352-G355 PolarHBondContact O-N 3.29Å
356	P	92.2	Very high	91.7	Very high	42 Å²	42	36.1 Å²	36.1	27%	0.273	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	136.8	178.1	29.7	-34.1	0	0	0	110.9	V349 K420	V349-P356 HydrophobicContact CG1-CB 4.35Å; P356-K420 HydrophobicContact CB-CB 4.09Å; P356-K420 HydrophobicContact CB-CG 3.94Å; P356-K420 HydrophobicContact CG-CB 3.73Å; P356-K420 HydrophobicContact CG-CD 4.29Å; P356-K420 HydrophobicContact CG-CG 3.77Å
357	I	93.7	Very high	91	Very high	24 Å²	24	35 Å²	35	12%	0.123	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	127.6	-179.7	-58.2	167.3	0	0	0	107.9	V349 V350 K400 A401	V349-I357 WeakPolarHBondContact CA-O 3.42Å; V350-I357 HydrophobicContact CG2-CB 3.88Å; V350-I357 HydrophobicContact CG2-CG2 4.39Å; V350-I357 PolarHBondContact N-O 3.42Å; V350-I357 PolarHBondContact O-N 2.76Å; I357-K400 HydrophobicContact CD1-CB 4.11Å; I357-A401 HydrophobicContact CD1-CB 4.29Å
358	V	94.8	Very high	90.4	Very high	50 Å²	50	36.4 Å²	36.4	30%	0.303	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	129.1	172.5	-177.2	0	0	0	0	108.4	T347 I348 V349 V416 K420	T347-V358 HydrophobicContact CG2-CG1 3.59Å; I348-V358 WeakPolarHBondContact O-CA 3.48Å; V349-V358 HydrophobicContact CG1-CG2 4.21Å; V349-V358 HydrophobicContact CG2-CG2 4.32Å; V358-V416 HydrophobicContact CB-CG1 4.38Å; V358-V416 HydrophobicContact CG1-CG1 3.95Å; V358-V416 HydrophobicContact CG2-CG1 3.52Å; V358-K420 HydrophobicContact CG2-CD 4.27Å; V358-K420 HydrophobicContact CG2-CG 4.11Å
359	S	94.8	Very high	89.4	Confident	8 Å²	8	39.4 Å²	39.4	6%	0.056	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	158.5	179.4	-160.8	0	0	0	0	111.1	T347 I348 A395 K396	T347-S359 CarbonylContact C-O 3.57Å; I348-S359 VanDerWaalsContact CG1-O 3.22Å; I348-S359 WeakPolarHBondContact CG1-O 3.28Å; I348-S359 PolarHBondContact N-O 3.07Å; I348-S359 PolarHBondContact O-N 3.46Å; S359-A395 VanDerWaalsContact OG-CB 3.27Å; S359-A395 WeakPolarHBondContact OG-CB 3.48Å; S359-K396 VanDerWaalsContact CB-O 3.31Å; S359-K396 WeakPolarHBondContact CB-O 3.14Å; S359-K396 WeakPolarHBondContact OG-CA 3.31Å; S359-K396 PolarHBondContact OG-N 3.13Å; S359-K396 PolarHBondContact OG-O 3.37Å
360	Q	94.7	Very high	88.4	Confident	126 Å²	126	41.2 Å²	41.2	59%	0.589	22%	0.217	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-102.5	133.7	174.6	-72.6	179.1	-2.1	0	0	110.3	R362 A395	Q360-R362 PolarHBondContact O-N 2.86Å; Q360-A395 WeakPolarHBondContact O-CB 3.07Å
361	I	95.3	Very high	87.5	Confident	4 Å²	4	46.3 Å²	46.3	2%	0.021	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	117.1	177.6	-61.6	179.3	0	0	0	109.2	L342 G345 D346 I348 L364 V393	L342-I361 HydrophobicContact CD2-CD1 4.32Å; G345-I361 PolarHBondContact N-O 2.8Å; D346-I361 HydrophobicContact CB-CD1 3.98Å; D346-I361 WeakPolarHBondContact O-CG1 3.25Å; D346-I361 PolarHBondContact O-N 2.81Å; I348-I361 HydrophobicContact CD1-CG1 4.16Å; I348-I361 HydrophobicContact CG1-CG1 4.22Å; I348-I361 HydrophobicContact CG2-CD1 3.54Å; I348-I361 HydrophobicContact CG2-CG1 3.69Å; I361-L364 HydrophobicContact CD1-CD2 4.09Å; I361-L364 HydrophobicContact CG2-CD2 3.58Å; I361-L364 HydrophobicContact CG2-CG 3.79Å; I361-V393 HydrophobicContact CB-CG1 4.49Å; I361-V393 HydrophobicContact CD1-CG1 4.25Å; I361-V393 HydrophobicContact CG1-CG1 3.86Å; I361-V393 HydrophobicContact CG2-CG1 4.15Å
362	R	94.1	Very high	86.5	Confident	141 Å²	141	46.3 Å²	46.3	53%	0.532	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	-44.6	173.4	-59.8	-169.7	-171.7	-177	8.9	112	V344 Q360 V394	V344-R362 WeakPolarHBondContact CG1-O 3.38Å; Q360-R362 PolarHBondContact O-N 2.86Å; R362-V394 WeakPolarHBondContact CB-O 3.37Å; R362-V394 PolarHBondContact N-O 3.1Å
363	E	93.8	Very high	85.6	Confident	69 Å²	69	46.5 Å²	46.5	32%	0.322	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	143.5	-177.9	-62.2	-174.8	-157.7	0	0	110.9	L365 H381 V394	E363-L365 HydrophobicContact CB-CD2 4.3Å; E363-L365 HydrophobicContact CB-CG 4.49Å; E363-H381 IonicContact OE2-CE1 2.88Å; E363-H381 PolarHBondContact OE2-CE1 2.91Å; E363-H381 IonicContact OE2-ND1 3.28Å; E363-H381 PolarHBondContact OE2-ND1 2.91Å; E363-V394 HydrophobicContact CB-CB 4.15Å; E363-V394 HydrophobicContact CB-CG2 4.21Å; E363-V394 PolarHBondContact N-O 2.9Å; E363-V394 PolarHBondContact O-N 3.44Å
364	L	93.3	Very high	84.8	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	114.6	169.3	-61.5	172.5	0	0	0	108.2	L342 V344 I361 N382 V385 V391 V393	L342-L364 HydrophobicContact CB-CD1 3.91Å; L342-L364 HydrophobicContact CB-CD2 4.27Å; L342-L364 VanDerWaalsContact O-CD1 3.32Å; L342-L364 WeakPolarHBondContact O-CD1 3.37Å; V344-L364 HydrophobicContact CG2-CB 4.42Å; V344-L364 HydrophobicContact CG2-CD1 4.28Å; V344-L364 HydrophobicContact CG2-CG 4.06Å; I361-L364 HydrophobicContact CD1-CD2 4.09Å; I361-L364 HydrophobicContact CG2-CD2 3.58Å; I361-L364 HydrophobicContact CG2-CG 3.79Å; L364-N382 PolarHBondContact O-N 3.21Å; L364-V385 HydrophobicContact CB-CG2 4.07Å; L364-V385 HydrophobicContact CD1-CG2 4.04Å; L364-V391 HydrophobicContact CB-CG1 4.03Å; L364-V391 HydrophobicContact CD2-CG1 3.92Å; L364-V393 HydrophobicContact CD2-CG1 4.38Å; L364-V393 HydrophobicContact CD2-CG2 3.88Å
365	L	90.2	Very high	84	Confident	1 Å²	1	42.7 Å²	42.7	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	131.9	-175.3	-58.2	179.7	0	0	0	109.7	L329 E363 Y379 H381 K392 V394	L329-L365 HydrophobicContact CD1-CD1 3.42Å; L329-L365 VanDerWaalsContact CD1-CD1 3.42Å; L329-L365 HydrophobicContact CD2-CD1 4.46Å; E363-L365 HydrophobicContact CB-CD2 4.3Å; E363-L365 HydrophobicContact CB-CG 4.49Å; L365-Y379 HydrophobicContact CB-CD1 4.2Å; L365-Y379 HydrophobicContact CB-CG 4.07Å; L365-Y379 HydrophobicContact CD1-CD2 4.13Å; L365-Y379 HydrophobicContact CD1-CG 4.28Å; L365-H381 WeakPolarHBondContact CD2-CE1 3.06Å; L365-H381 VanDerWaalsContact CD2-ND1 3.28Å; L365-H381 WeakPolarHBondContact CD2-ND1 3.42Å; L365-K392 HydrophobicContact CB-CB 4.03Å; L365-K392 HydrophobicContact CB-CD 4.4Å; L365-K392 HydrophobicContact CB-CG 4.36Å; L365-K392 HydrophobicContact CD1-CD 4.02Å; L365-K392 HydrophobicContact CD1-CG 4.39Å; L365-K392 PolarHBondContact N-O 2.91Å; L365-K392 PolarHBondContact O-N 3.42Å; L365-V394 HydrophobicContact CD1-CG2 3.68Å; L365-V394 HydrophobicContact CG-CG2 4.15Å
366	M	85.6	Confident	83	Confident	18 Å²	18	50.9 Å²	50.9	9%	0.089	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	149.6	174.7	-76.6	-179.6	47.5	0	0	111.3	L380 N382 V385 Q389	M366-L380 HydrophobicContact CB-CB 4.34Å; M366-L380 PolarHBondContact N-O 2.93Å; M366-L380 PolarHBondContact O-N 2.95Å; M366-N382 PolarHBondContact SD-ND2 2.98Å; M366-V385 HydrophobicContact CG-CG2 4.44Å; M366-V385 HydrophobicContact SD-CG1 3.89Å; M366-V385 HydrophobicContact SD-CG2 3.88Å; M366-Q389 PolarHBondContact SD-OE1 2.92Å
367	P	79.8	Confident	81.9	Confident	11 Å²	11	50.8 Å²	50.8	7%	0.071	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-69.3	150.9	168.7	31.4	-29.7	0	0	0	109.1	L373	P367-L373 HydrophobicContact CB-CD1 4.47Å; P367-L373 HydrophobicContact CG-CD1 4.27Å
368	H	80.7	Confident	81.1	Confident	60 Å²	60	54 Å²	54	28%	0.278	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-58.2	149.4	164.7	-78.3	-82.3	0	0	0	110.3	L370 R371 P378 L380	H368-L370 PolarHBondContact O-N 3.15Å; H368-R371 HydrophobicContact CB-CB 4.49Å; H368-R371 HydrophobicContact CB-CG 4.32Å; H368-R371 WeakPolarHBondContact O-CB 3.44Å; H368-R371 PolarHBondContact O-N 2.82Å; H368-P378 PolarHBondContact CD2-O 2.92Å; H368-P378 PolarHBondContact NE2-O 2.85Å; H368-L380 WeakPolarHBondContact CE1-CD2 3.21Å
369	P	75.6	Confident	80.6	Confident	63 Å²	63	53.8 Å²	53.8	41%	0.409	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.7	142.9	174.4	-26.9	34.3	0	0	0	112.1	F136 P138 R371	F136-P369 HydrophobicContact CD1-CB 4.31Å; P138-P369 HydrophobicContact CG-CB 3.73Å; P369-R371 PolarHBondContact O-N 2.8Å
370	L	73.2	Confident	80.1	Confident	38 Å²	38	56.3 Å²	56.3	20%	0.199	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.9	6.5	-175.9	-51.7	173	0	0	0	115.4	R116 F136 V137 T141 H368	R116-L370 WeakPolarHBondContact CB-O 3.44Å; R116-L370 VanDerWaalsContact CD-O 3.29Å; R116-L370 WeakPolarHBondContact CD-O 3.06Å; R116-L370 VanDerWaalsContact CG-O 3.24Å; R116-L370 WeakPolarHBondContact CG-O 3.42Å; F136-L370 PolarHBondContact O-N 2.92Å; V137-L370 HydrophobicContact CG1-CD2 4.16Å; V137-L370 HydrophobicContact CG2-CD2 4.49Å; T141-L370 HydrophobicContact CG2-CD1 4.26Å; T141-L370 HydrophobicContact CG2-CD2 4.02Å; H368-L370 PolarHBondContact O-N 3.15Å
371	R	74.2	Confident	79.9	Confident	108 Å²	108	56.2 Å²	56.2	41%	0.408	27%	0.268	S	S	.	.			trans	-107.8	156.5	168.3	-59.3	-163.3	-177	-176.9	4.5	110.1	H368 P369 N377	H368-R371 HydrophobicContact CB-CB 4.49Å; H368-R371 HydrophobicContact CB-CG 4.32Å; H368-R371 WeakPolarHBondContact O-CB 3.44Å; H368-R371 PolarHBondContact O-N 2.82Å; P369-R371 PolarHBondContact O-N 2.8Å; R371-N377 WeakPolarHBondContact CD-ND2 3.29Å; R371-N377 PolarHBondContact NH1-OD1 2.83Å
372	E	69.4	Low	79.6	Confident	4 Å²	4	58.5 Å²	58.5	2%	0.019	28%	0.28	C	S	.	.	B	Isolated β-bridge	trans	-100.2	146.5	179.9	-172.3	166.4	-118.8	0	0	111	R116 G133 R374 V375	R116-E372 IonicContact NH1-OE1 3.02Å; R116-E372 PolarHBondContact NH1-OE1 3.29Å; G133-E372 VanDerWaalsContact C-OE1 3.3Å; G133-E372 WeakPolarHBondContact CA-OE1 3.2Å; E372-R374 HydrophobicContact CG-CB 4.35Å; E372-R374 HydrophobicContact CG-CG 4.24Å; E372-R374 PolarHBondContact O-N 2.81Å; E372-R374 VanDerWaalsContact O-N 3.08Å; E372-R374 IonicContact OE1-CZ 3.87Å; E372-R374 IonicContact OE1-NE 2.92Å; E372-R374 IonicContact OE1-NH2 3.92Å; E372-R374 IonicContact OE2-CZ 3.98Å; E372-R374 IonicContact OE2-NE 3.68Å; E372-R374 PolarHBondContact OE2-NE 2.79Å; E372-R374 IonicContact OE2-NH2 3Å; E372-R374 PolarHBondContact OE2-NH2 3.29Å; E372-V375 PolarHBondContact O-N 3.09Å
373	L	69.2	Low	79.5	Confident	11 Å²	11	60.2 Å²	60.2	6%	0.058	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-19.5	-178.6	-164.4	70.6	0	0	0	114.1	D334 P367 Y379 K392	D334-L373 HydrophobicContact CB-CD2 3.99Å; D334-L373 WeakPolarHBondContact OD1-CD2 3.19Å; P367-L373 HydrophobicContact CB-CD1 4.47Å; P367-L373 HydrophobicContact CG-CD1 4.27Å; L373-Y379 HydrophobicContact CD1-CD1 4.48Å; L373-Y379 HydrophobicContact CD1-CE1 4.02Å; L373-K392 HydrophobicContact CD1-CB 3.93Å; L373-K392 HydrophobicContact CD2-CB 4.28Å; L373-K392 HydrophobicContact CG-CB 4.49Å
374	R	66.7	Low	79.4	Confident	35 Å²	35	59.6 Å²	59.6	13%	0.132	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-31.3	-176.6	-61.2	-175.7	-69.5	164.5	14.8	113.6	E124 T129 Q131 I132 E372	E124-R374 IonicContact OE1-CZ 2.64Å; E124-R374 IonicContact OE1-NH1 3.98Å; E124-R374 PolarHBondContact OE1-NH1 3.28Å; E124-R374 IonicContact OE1-NH2 2.72Å; E124-R374 PolarHBondContact OE1-NH2 2.82Å; T129-R374 VanDerWaalsContact CG2-NH1 3.27Å; Q131-R374 VanDerWaalsContact CB-CD 3.48Å; Q131-R374 HydrophobicContact CB-CG 4.44Å; Q131-R374 PolarHBondContact O-NH1 2.83Å; I132-R374 WeakPolarHBondContact O-CD 3.28Å; E372-R374 HydrophobicContact CG-CB 4.35Å; E372-R374 HydrophobicContact CG-CG 4.24Å; E372-R374 PolarHBondContact O-N 2.81Å; E372-R374 VanDerWaalsContact O-N 3.08Å; E372-R374 IonicContact OE1-CZ 3.87Å; E372-R374 IonicContact OE1-NE 2.92Å; E372-R374 IonicContact OE1-NH2 3.92Å; E372-R374 IonicContact OE2-CZ 3.98Å; E372-R374 IonicContact OE2-NE 3.68Å; E372-R374 PolarHBondContact OE2-NE 2.79Å; E372-R374 IonicContact OE2-NH2 3Å; E372-R374 PolarHBondContact OE2-NH2 3.29Å
375	V	66	Low	79.2	Confident	52 Å²	52	59.6 Å²	59.6	32%	0.315	29%	0.292	S	S	.	.	S	Bend	trans	-80.2	127.4	-174.2	-178.1	0	0	0	0	108.7	V120 E372 N377	V120-V375 HydrophobicContact CG1-CG2 4.1Å; V120-V375 HydrophobicContact CG2-CG2 4.18Å; E372-V375 PolarHBondContact O-N 3.09Å; V375-N377 VanDerWaalsContact C-N 3.32Å; V375-N377 WeakPolarHBondContact CB-ND2 3.37Å; V375-N377 VanDerWaalsContact CG1-ND2 3.3Å; V375-N377 WeakPolarHBondContact CG1-ND2 2.92Å; V375-N377 PolarHBondContact O-N 3.11Å; V375-N377 PolarHBondContact O-ND2 2.83Å
376	K	66.8	Low	79	Confident	203 Å²	203	63.4 Å²	63.4	88%	0.883	31%	0.306	S	S	*	.			trans	-57.7	94.7	174.1	-71.7	-176	-178.8	178.1	0	109.6
377	N	67.2	Low	78.9	Confident	40 Å²	40	62.9 Å²	62.9	21%	0.214	31%	0.305	C	S	.	.			trans	-129.8	158.1	178.1	-75.5	-54.4	0	0	0	108.1	R371 V375 Y379	R371-N377 WeakPolarHBondContact CD-ND2 3.29Å; R371-N377 PolarHBondContact NH1-OD1 2.83Å; V375-N377 VanDerWaalsContact C-N 3.32Å; V375-N377 WeakPolarHBondContact CB-ND2 3.37Å; V375-N377 VanDerWaalsContact CG1-ND2 3.3Å; V375-N377 WeakPolarHBondContact CG1-ND2 2.92Å; V375-N377 PolarHBondContact O-N 3.11Å; V375-N377 PolarHBondContact O-ND2 2.83Å; N377-Y379 PolarHBondContact O-N 3.06Å
378	P	78.1	Confident	78.8	Confident	91 Å²	91	62.4 Å²	62.4	59%	0.591	30%	0.302	S	S	*	.	P	Polyproline II helix	trans	-54	128.6	163.7	24.4	-32.6	0	0	0	108.4	H368	H368-P378 PolarHBondContact CD2-O 2.92Å; H368-P378 PolarHBondContact NE2-O 2.85Å
379	Y	83.3	Confident	78.8	Confident	46 Å²	46	61.2 Å²	61.2	18%	0.18	30%	0.297	C	S	.	.	P	Polyproline II helix	trans	-84.8	150.3	175	-66.3	-76.9	0	0	0	109.5	L365 L373 N377 H381 K392	L365-Y379 HydrophobicContact CB-CD1 4.2Å; L365-Y379 HydrophobicContact CB-CG 4.07Å; L365-Y379 HydrophobicContact CD1-CD2 4.13Å; L365-Y379 HydrophobicContact CD1-CG 4.28Å; L373-Y379 HydrophobicContact CD1-CD1 4.48Å; L373-Y379 HydrophobicContact CD1-CE1 4.02Å; N377-Y379 PolarHBondContact O-N 3.06Å; Y379-H381 PolarHBondContact O-CD2 2.74Å; Y379-K392 HydrophobicContact CE1-CD 4.28Å; Y379-K392 WeakPolarHBondContact OH-CE 3.5Å
380	L	86	Confident	79.1	Confident	60 Å²	60	58.3 Å²	58.3	31%	0.314	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	118.3	165.1	-69.6	174.5	0	0	0	108.2	M366 H368	M366-L380 HydrophobicContact CB-CB 4.34Å; M366-L380 PolarHBondContact N-O 2.93Å; M366-L380 PolarHBondContact O-N 2.95Å; H368-L380 WeakPolarHBondContact CE1-CD2 3.21Å
381	H	90.5	Very high	79.8	Confident	125 Å²	125	56.5 Å²	56.5	58%	0.579	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.6	115.8	175.1	-64.7	-103.8	0	0	0	109.1	E363 L365 Y379	E363-H381 IonicContact OE2-CE1 2.88Å; E363-H381 PolarHBondContact OE2-CE1 2.91Å; E363-H381 IonicContact OE2-ND1 3.28Å; E363-H381 PolarHBondContact OE2-ND1 2.91Å; L365-H381 WeakPolarHBondContact CD2-CE1 3.06Å; L365-H381 VanDerWaalsContact CD2-ND1 3.28Å; L365-H381 WeakPolarHBondContact CD2-ND1 3.42Å; Y379-H381 PolarHBondContact O-CD2 2.74Å
382	N	89.1	Confident	80.5	Confident	51 Å²	51	51.5 Å²	51.5	27%	0.273	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	137.7	-178.6	-72.9	2.7	0	0	0	110.3	V344 L364 M366 V385	V344-N382 WeakPolarHBondContact CG2-O 3.45Å; L364-N382 PolarHBondContact O-N 3.21Å; M366-N382 PolarHBondContact SD-ND2 2.98Å; N382-V385 HydrophobicContact CB-CG2 3.83Å
383	K	90.7	Very high	81.7	Confident	178 Å²	178	51.3 Å²	51.3	77%	0.774	25%	0.249	S	C	*	.	S	Bend	trans	-76.1	-35.5	173.2	-67.7	-173.8	178.5	-177.3	0	112.1	R343 V344	R343-K383 WeakPolarHBondContact CA-O 3.24Å; V344-K383 PolarHBondContact N-O 2.81Å
384	V	91.9	Very high	82.9	Confident	56 Å²	56	51.1 Å²	51.1	34%	0.339	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	135.2	179.5	-178.3	0	0	0	0	108.2	L86 F341 L342 R343	L86-V384 HydrophobicContact CD1-CG1 4.49Å; F341-V384 HydrophobicContact CD1-CG1 4.22Å; L342-V384 CarbonylContact O-C 3.59Å; L342-V384 WeakPolarHBondContact O-CA 3.36Å; R343-V384 HydrophobicContact CB-CG2 4.38Å; R343-V384 HydrophobicContact CG-CG1 4.27Å; R343-V384 HydrophobicContact CG-CG2 4.05Å
385	V	89.1	Confident	84.2	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.006	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	128.8	172.2	-175.6	0	0	0	0	109.4	L337 F341 L342 L364 M366 N382 Q389 V391	L337-V385 HydrophobicContact CD2-CG1 4.37Å; F341-V385 WeakPolarHBondContact CA-O 3.4Å; L342-V385 PolarHBondContact N-O 2.9Å; L342-V385 PolarHBondContact O-N 3.33Å; L364-V385 HydrophobicContact CB-CG2 4.07Å; L364-V385 HydrophobicContact CD1-CG2 4.04Å; M366-V385 HydrophobicContact CG-CG2 4.44Å; M366-V385 HydrophobicContact SD-CG1 3.89Å; M366-V385 HydrophobicContact SD-CG2 3.88Å; N382-V385 HydrophobicContact CB-CG2 3.83Å; V385-Q389 HydrophobicContact CG1-CB 4Å; V385-Q389 HydrophobicContact CG1-CG 4.43Å; V385-V391 HydrophobicContact CB-CG2 4.11Å; V385-V391 HydrophobicContact CG1-CG2 3.55Å; V385-V391 HydrophobicContact CG2-CG1 4.28Å; V385-V391 HydrophobicContact CG2-CG2 4.23Å
386	R	86.9	Confident	85.4	Confident	81 Å²	81	53 Å²	53	31%	0.306	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	150.3	173.3	-175.8	175.8	179.9	179.7	0.2	109.9	S92 F312 F341 Q389	S92-R386 PolarHBondContact OG-NH2 3.36Å; F312-R386 HydrophobicContact CD2-CG 4.49Å; F312-R386 HydrophobicContact CE2-CG 3.71Å; F312-R386 HydrophobicContact CZ-CG 3.92Å; F341-R386 HydrophobicContact CD1-CB 4.18Å; F341-R386 HydrophobicContact CD1-CG 4.33Å; F341-R386 HydrophobicContact CE1-CB 4Å; F341-R386 HydrophobicContact CE1-CG 3.8Å; F341-R386 HydrophobicContact CZ-CG 4.4Å; R386-Q389 PolarHBondContact O-NE2 3.41Å
387	G	82.3	Confident	86.6	Confident	6 Å²	6	49.3 Å²	49.3	6%	0.062	25%	0.245	C	C	.	.	S	Bend	trans	-52.5	169.5	177	0	0	0	0	0	116.7	L337 G340	L337-G387 CarbonylContact O-C 3.37Å; G340-G387 PolarHBondContact O-N 2.96Å
388	A	78.5	Confident	87.7	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.008	24%	0.235	C	C	.	.	S	Bend	trans	65.9	39.2	-166.7	0	0	0	0	0	115.6	R94 S95 L337 V338	R94-A388 HydrophobicContact CB-CB 3.96Å; R94-A388 HydrophobicContact CG-CB 4.33Å; S95-A388 WeakPolarHBondContact O-CB 3.42Å; L337-A388 CarbonylContact O-C 3.53Å; L337-A388 WeakPolarHBondContact O-CA 3.49Å; L337-A388 PolarHBondContact O-N 3.44Å; V338-A388 PolarHBondContact O-N 3.42Å
389	Q	80.2	Confident	88.2	Confident	35 Å²	35	50.1 Å²	50.1	16%	0.164	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	140.9	-177.8	-59.9	-175.7	69.2	0	0	111.1	L337 M366 V385 R386 V391	L337-Q389 PolarHBondContact N-O 3.04Å; L337-Q389 PolarHBondContact O-N 3.1Å; M366-Q389 PolarHBondContact SD-OE1 2.92Å; V385-Q389 HydrophobicContact CG1-CB 4Å; V385-Q389 HydrophobicContact CG1-CG 4.43Å; R386-Q389 PolarHBondContact O-NE2 3.41Å; Q389-V391 HydrophobicContact CB-CG2 4.37Å
390	G	81.6	Confident	88.4	Confident	3 Å²	3	52.3 Å²	52.3	3%	0.031	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	124.9	165.6	0	0	0	0	0	109.7	Y164 V335	Y164-G390 VanDerWaalsContact CE2-N 3.35Å; Y164-G390 WeakPolarHBondContact OH-CA 3.28Å; Y164-G390 PolarHBondContact OH-N 3.38Å; Y164-G390 VanDerWaalsContact OH-N 3.11Å; V335-G390 CarbonylContact O-C 3.56Å; V335-G390 WeakPolarHBondContact O-CA 3.23Å
391	V	87.8	Confident	88.6	Confident	0 Å²	0	50 Å²	50	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	137.6	-173.4	-171.7	0	0	0	0	108.6	V335 L364 V385 Q389 V393	V335-V391 HydrophobicContact CG2-CB 4.03Å; V335-V391 WeakPolarHBondContact CG2-O 3.41Å; V335-V391 PolarHBondContact N-O 3.02Å; V335-V391 PolarHBondContact O-N 3.44Å; L364-V391 HydrophobicContact CB-CG1 4.03Å; L364-V391 HydrophobicContact CD2-CG1 3.92Å; V385-V391 HydrophobicContact CB-CG2 4.11Å; V385-V391 HydrophobicContact CG1-CG2 3.55Å; V385-V391 HydrophobicContact CG2-CG1 4.28Å; V385-V391 HydrophobicContact CG2-CG2 4.23Å; Q389-V391 HydrophobicContact CB-CG2 4.37Å; V391-V393 HydrophobicContact CG1-CG2 4.34Å
392	K	90.2	Very high	88.4	Confident	2 Å²	2	44.5 Å²	44.5	1%	0.009	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	116.9	168	173.1	-176.3	-58.4	-57.7	0	108.1	I326 T332 I333 D334 L365 L373 Y379	I326-K392 HydrophobicContact CD1-CD 3.6Å; T332-K392 HydrophobicContact CG2-CD 4.47Å; T332-K392 HydrophobicContact CG2-CG 4.44Å; I333-K392 WeakPolarHBondContact O-CA 3.2Å; D334-K392 IonicContact OD1-NZ 3.94Å; D334-K392 PolarHBondContact OD1-NZ 2.93Å; D334-K392 IonicContact OD2-NZ 2.71Å; D334-K392 PolarHBondContact OD2-NZ 3.19Å; L365-K392 HydrophobicContact CB-CB 4.03Å; L365-K392 HydrophobicContact CB-CD 4.4Å; L365-K392 HydrophobicContact CB-CG 4.36Å; L365-K392 HydrophobicContact CD1-CD 4.02Å; L365-K392 HydrophobicContact CD1-CG 4.39Å; L365-K392 PolarHBondContact N-O 2.91Å; L365-K392 PolarHBondContact O-N 3.42Å; L373-K392 HydrophobicContact CD1-CB 3.93Å; L373-K392 HydrophobicContact CD2-CB 4.28Å; L373-K392 HydrophobicContact CG-CB 4.49Å; Y379-K392 HydrophobicContact CE1-CD 4.28Å; Y379-K392 WeakPolarHBondContact OH-CE 3.5Å
393	V	93.5	Very high	88.1	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	129	-178.4	-178.1	0	0	0	0	108.8	T332 I333 V335 I348 I361 L364 V391	T332-V393 WeakPolarHBondContact CA-O 3.31Å; I333-V393 HydrophobicContact CD1-CB 4.31Å; I333-V393 HydrophobicContact CG1-CB 3.76Å; I333-V393 HydrophobicContact CG1-CG1 4.43Å; I333-V393 HydrophobicContact CG1-CG2 4.49Å; I333-V393 PolarHBondContact N-O 2.79Å; I333-V393 PolarHBondContact O-N 3.33Å; V335-V393 HydrophobicContact CG1-CG2 4.18Å; V335-V393 HydrophobicContact CG2-CG2 3.75Å; I348-V393 HydrophobicContact CD1-CG1 4.11Å; I361-V393 HydrophobicContact CB-CG1 4.49Å; I361-V393 HydrophobicContact CD1-CG1 4.25Å; I361-V393 HydrophobicContact CG1-CG1 3.86Å; I361-V393 HydrophobicContact CG2-CG1 4.15Å; L364-V393 HydrophobicContact CD2-CG1 4.38Å; L364-V393 HydrophobicContact CD2-CG2 3.88Å; V391-V393 HydrophobicContact CG1-CG2 4.34Å
394	V	94.3	Very high	87.5	Confident	8 Å²	8	34.7 Å²	34.7	5%	0.048	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	117.6	173.7	-173.2	0	0	0	0	108.2	L329 T332 R362 E363 L365	L329-V394 HydrophobicContact CD1-CG2 4.37Å; L329-V394 HydrophobicContact CD2-CG2 4.45Å; T332-V394 HydrophobicContact CG2-CG2 3.94Å; R362-V394 WeakPolarHBondContact CB-O 3.37Å; R362-V394 PolarHBondContact N-O 3.1Å; E363-V394 HydrophobicContact CB-CB 4.15Å; E363-V394 HydrophobicContact CB-CG2 4.21Å; E363-V394 PolarHBondContact N-O 2.9Å; E363-V394 PolarHBondContact O-N 3.44Å; L365-V394 HydrophobicContact CD1-CG2 3.68Å; L365-V394 HydrophobicContact CG-CG2 4.15Å
395	A	94	Very high	87.1	Confident	9 Å²	9	32.6 Å²	32.6	7%	0.074	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	170.3	177	0	0	0	0	0	110.6	I348 S359 Q360 L398	I348-A395 HydrophobicContact CD1-CB 4.27Å; S359-A395 VanDerWaalsContact OG-CB 3.27Å; S359-A395 WeakPolarHBondContact OG-CB 3.48Å; Q360-A395 WeakPolarHBondContact O-CB 3.07Å; A395-L398 HydrophobicContact CB-CD1 3.62Å; A395-L398 HydrophobicContact CB-CD2 4.35Å; A395-L398 HydrophobicContact CB-CG 3.99Å
396	K	92.4	Very high	87.1	Confident	118 Å²	118	35 Å²	35	51%	0.513	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.6	151.8	174.5	-76.6	177.7	179.2	-179.5	0	111.1	S359 L398	S359-K396 VanDerWaalsContact CB-O 3.31Å; S359-K396 WeakPolarHBondContact CB-O 3.14Å; S359-K396 WeakPolarHBondContact OG-CA 3.31Å; S359-K396 PolarHBondContact OG-N 3.13Å; S359-K396 PolarHBondContact OG-O 3.37Å; K396-L398 PolarHBondContact O-N 2.75Å; K396-L398 VanDerWaalsContact O-N 3.13Å
397	D	90.4	Very high	87.3	Confident	124 Å²	124	31.2 Å²	31.2	66%	0.663	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.4	27.1	164.6	-49.2	-39.5	0	0	0	115.7	E399	D397-E399 VanDerWaalsContact C-N 3.26Å; D397-E399 PolarHBondContact O-N 2.95Å
398	L	91.7	Very high	87.8	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.005	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-81.5	4.3	178.5	-64.2	178.3	0	0	0	114.2	T331 I333 V350 A395 K396 K400 A401	T331-L398 HydrophobicContact CG2-CB 4.13Å; I333-L398 HydrophobicContact CB-CD1 4.48Å; I333-L398 HydrophobicContact CD1-CD1 4.11Å; I333-L398 HydrophobicContact CD1-CD2 4.2Å; I333-L398 HydrophobicContact CG1-CD1 3.93Å; I333-L398 HydrophobicContact CG2-CB 4.25Å; I333-L398 HydrophobicContact CG2-CD1 4.03Å; I333-L398 HydrophobicContact CG2-CD2 4.49Å; V350-L398 HydrophobicContact CG2-CD2 4.08Å; A395-L398 HydrophobicContact CB-CD1 3.62Å; A395-L398 HydrophobicContact CB-CD2 4.35Å; A395-L398 HydrophobicContact CB-CG 3.99Å; K396-L398 PolarHBondContact O-N 2.75Å; K396-L398 VanDerWaalsContact O-N 3.13Å; L398-K400 VanDerWaalsContact C-N 3.26Å; L398-K400 PolarHBondContact O-N 3.3Å; L398-A401 VanDerWaalsContact O-CB 3.3Å; L398-A401 WeakPolarHBondContact O-CB 3.46Å; L398-A401 PolarHBondContact O-N 3.04Å
399	E	87.9	Confident	88.5	Confident	147 Å²	147	33.7 Å²	33.7	69%	0.687	18%	0.177	S	C	*	.	G	3₁₀ helix	trans	-60	-34.1	-176.2	-67.2	178.9	176.6	0	0	113.7	T331 D397	T331-E399 WeakPolarHBondContact OG1-CG 3.49Å; D397-E399 VanDerWaalsContact C-N 3.26Å; D397-E399 PolarHBondContact O-N 2.95Å
400	K	87.6	Confident	89.1	Confident	92 Å²	92	32.4 Å²	32.4	40%	0.4	17%	0.172	S	C	.	.	G	3₁₀ helix	trans	-99.7	8.4	-177.7	-58.4	-172.4	-170.6	-175.6	0	112.9	G352 S353 E354 I357 L398	G352-K400 CarbonylContact C-O 3.55Å; G352-K400 WeakPolarHBondContact CA-O 3.46Å; S353-K400 PolarHBondContact N-O 3.07Å; E354-K400 HydrophobicContact CG-CD 4.17Å; E354-K400 IonicContact OE1-NZ 3.22Å; E354-K400 PolarHBondContact OE1-NZ 3.43Å; E354-K400 WeakPolarHBondContact OE2-CD 3.28Å; E354-K400 IonicContact OE2-NZ 2.91Å; E354-K400 PolarHBondContact OE2-NZ 2.59Å; I357-K400 HydrophobicContact CD1-CB 4.11Å; L398-K400 VanDerWaalsContact C-N 3.26Å; L398-K400 PolarHBondContact O-N 3.3Å
401	A	89.9	Confident	89.4	Confident	11 Å²	11	39.2 Å²	39.2	9%	0.091	20%	0.201	C	C	.	.	B	Isolated β-bridge	trans	-65.8	145.1	-178.1	0	0	0	0	0	111.5	V323 I333 V350 A351 I357 L398	V323-A401 HydrophobicContact CG2-CB 4.09Å; V323-A401 WeakPolarHBondContact CG2-O 3.36Å; I333-A401 HydrophobicContact CG2-CB 4.19Å; V350-A401 HydrophobicContact CG2-CB 4.25Å; A351-A401 CarbonylContact O-C 3.58Å; A351-A401 WeakPolarHBondContact O-CA 3.44Å; I357-A401 HydrophobicContact CD1-CB 4.29Å; L398-A401 VanDerWaalsContact O-CB 3.3Å; L398-A401 WeakPolarHBondContact O-CB 3.46Å; L398-A401 PolarHBondContact O-N 3.04Å
402	L	86.2	Confident	89.5	Confident	10 Å²	10	42 Å²	42	5%	0.052	22%	0.22	C	C	.	.			trans	-104.5	137.1	-179	-64.9	-179.8	0	0	0	111.5	A351 L405 L427 V470	A351-L402 HydrophobicContact CB-CB 4.41Å; A351-L402 PolarHBondContact O-N 3.32Å; L402-L405 HydrophobicContact CB-CD1 4.33Å; L402-L427 HydrophobicContact CD1-CD1 3.53Å; L402-V470 HydrophobicContact CD2-CB 4.48Å; L402-V470 HydrophobicContact CD2-CG1 3.89Å
403	A	83.2	Confident	89.3	Confident	6 Å²	6	50.3 Å²	50.3	5%	0.05	26%	0.259	C	S	.	.	B	Isolated β-bridge	trans	-82.6	142.6	-179.2	0	0	0	0	0	113.8	R175 L321 T447	R175-A403 PolarHBondContact NH1-O 3.24Å; R175-A403 PolarHBondContact NH2-O 3.26Å; L321-A403 WeakPolarHBondContact O-CB 3.37Å; A403-T447 HydrophobicContact CB-CG2 3.65Å
404	G	78	Confident	89	Confident	17 Å²	17	56.7 Å²	56.7	18%	0.175	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.9	24.1	177	0	0	0	0	0	116	R175 V320	R175-G404 VanDerWaalsContact NH1-CA 3.27Å; R175-G404 PolarHBondContact NH2-O 2.71Å; V320-G404 WeakPolarHBondContact O-CA 3.32Å; V320-G404 PolarHBondContact O-N 2.64Å
405	L	83.6	Confident	88.8	Confident	12 Å²	12	58.5 Å²	58.5	6%	0.063	30%	0.301	C	S	.	.	S	Bend	trans	-99.2	159.9	159.8	-70.1	167.2	0	0	0	109.6	V320 A351 L402 L427 L448	V320-L405 PolarHBondContact N-O 3.48Å; A351-L405 HydrophobicContact CB-CB 4.03Å; A351-L405 HydrophobicContact CB-CD1 3.28Å; A351-L405 HydrophobicContact CB-CG 4.27Å; L402-L405 HydrophobicContact CB-CD1 4.33Å; L405-L427 HydrophobicContact CD1-CB 4.15Å; L405-L427 HydrophobicContact CD1-CD1 3.81Å; L405-L427 HydrophobicContact CD1-CG 4.27Å; L405-L448 HydrophobicContact CD2-CD2 4.18Å
406	P	88	Confident	88.7	Confident	52 Å²	52	58.9 Å²	58.9	34%	0.338	30%	0.302	S	S	.	.	B	Isolated β-bridge	trans	-61.5	148.4	177.7	-22.1	34	0	0	0	112.2	C318 L408	C318-P406 VanDerWaalsContact O-CA 3.32Å; C318-P406 WeakPolarHBondContact O-CA 3.47Å; P406-L408 HydrophobicContact CB-CD2 4.24Å
407	L	92	Very high	88.7	Confident	1 Å²	1	59 Å²	59	1%	0.005	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-102.2	123.6	163	176.8	158.3	0	0	0	107.4	L316 C318 V320 I333 V335 L342 I348 V350 V409	L316-L407 HydrophobicContact CD2-CD2 4.35Å; L316-L407 WeakPolarHBondContact CD2-O 3.38Å; C318-L407 HydrophobicContact CB-CB 4.1Å; C318-L407 HydrophobicContact CB-CD2 4.19Å; C318-L407 PolarHBondContact O-N 3.32Å; V320-L407 HydrophobicContact CG2-CB 4.16Å; I333-L407 HydrophobicContact CD1-CD1 3.82Å; V335-L407 HydrophobicContact CG1-CD1 3.96Å; L342-L407 HydrophobicContact CD2-CD2 4.01Å; I348-L407 HydrophobicContact CB-CD1 4.47Å; I348-L407 HydrophobicContact CB-CD2 4.23Å; I348-L407 HydrophobicContact CB-CG 4.28Å; I348-L407 HydrophobicContact CD1-CD1 4.02Å; I348-L407 HydrophobicContact CG2-CD1 4.37Å; I348-L407 HydrophobicContact CG2-CD2 3.74Å; I348-L407 HydrophobicContact CG2-CG 4.27Å; V350-L407 HydrophobicContact CG1-CB 4.14Å; V350-L407 HydrophobicContact CG1-CD1 3.96Å; V350-L407 HydrophobicContact CG1-CG 3.85Å; L407-V409 HydrophobicContact CD2-CG2 4.18Å
408	L	93.2	Very high	88.7	Confident	30 Å²	30	59.7 Å²	59.7	16%	0.157	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	152.4	178	-54.5	-179.6	0	0	0	109.8	I348 V349 P406 L419 E422 I423	I348-L408 CarbonylContact C-O 3.38Å; I348-L408 VanDerWaalsContact CA-O 3.25Å; I348-L408 WeakPolarHBondContact CA-O 3.26Å; V349-L408 PolarHBondContact N-O 3.43Å; V349-L408 PolarHBondContact O-N 3.43Å; P406-L408 HydrophobicContact CB-CD2 4.24Å; L408-L419 HydrophobicContact CB-CD1 4.35Å; L408-L419 HydrophobicContact CB-CD2 4.14Å; L408-L419 HydrophobicContact CD1-CB 4.32Å; L408-L419 HydrophobicContact CD1-CD2 3.66Å; L408-L419 HydrophobicContact CG-CD2 4.45Å; L408-E422 HydrophobicContact CD1-CG 4.44Å; L408-I423 HydrophobicContact CB-CD1 4.26Å; L408-I423 HydrophobicContact CD1-CD1 3.76Å; L408-I423 HydrophobicContact CD1-CG1 3.5Å; L408-I423 VanDerWaalsContact CD1-CG1 3.5Å; L408-I423 HydrophobicContact CG-CD1 3.9Å; L408-I423 HydrophobicContact CG-CG1 4.07Å
409	V	93.7	Very high	88.7	Confident	30 Å²	30	60.3 Å²	60.3	18%	0.182	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	123	175.8	171.4	0	0	0	0	107.9	L316 L342 D346 T347 I348 L407	L316-V409 HydrophobicContact CD2-CB 3.83Å; L316-V409 HydrophobicContact CD2-CG2 3.46Å; L316-V409 VanDerWaalsContact CD2-CG2 3.46Å; L342-V409 HydrophobicContact CD2-CG2 3.7Å; D346-V409 HydrophobicContact CB-CG1 3.92Å; T347-V409 CarbonylContact O-C 3.56Å; T347-V409 WeakPolarHBondContact O-CA 3.27Å; I348-V409 HydrophobicContact CG2-CG2 3.97Å; L407-V409 HydrophobicContact CD2-CG2 4.18Å
410	A	92.6	Very high	88.9	Confident	8 Å²	8	56 Å²	56	7%	0.066	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	132.8	174	0	0	0	0	0	110	T347 V416 L419	T347-A410 HydrophobicContact CG2-CB 4.34Å; T347-A410 PolarHBondContact O-N 2.92Å; A410-V416 HydrophobicContact CB-CG2 3.64Å; A410-L419 HydrophobicContact CB-CD1 3.68Å
411	K	88	Confident	89	Confident	146 Å²	146	57.6 Å²	57.6	64%	0.635	30%	0.295	S	S	*	.	S	Bend	trans	-91.1	-31.8	175.9	-61.2	176.6	-176	169.2	0	112.3	F79 E415	F79-K411 HydrophobicContact CZ-CD 4.21Å; F79-K411 VanDerWaalsContact CZ-NZ 3.34Å; K411-E415 WeakPolarHBondContact CB-OE2 3.17Å; K411-E415 PolarHBondContact N-OE2 2.86Å
412	S	88.6	Confident	89	Confident	58 Å²	58	61 Å²	61	41%	0.406	31%	0.309	S	S	.	.	S	Bend	trans	-127.5	163.7	178	63.7	0	0	0	0	111.2	D414 E415	S412-D414 VanDerWaalsContact C-N 3.3Å; S412-E415 PolarHBondContact O-N 3.29Å; S412-E415 PolarHBondContact OG-N 3.17Å
413	E	86.7	Confident	89.1	Confident	176 Å²	176	60.8 Å²	60.8	82%	0.822	31%	0.308	S	S	*	.	H	α-helix	trans	-65.2	-34.5	175.3	-66.3	-173.5	166.9	0	0	112	E415 V416	E413-E415 VanDerWaalsContact C-N 3.33Å; E413-E415 PolarHBondContact O-N 3.14Å; E413-V416 VanDerWaalsContact O-CB 3.29Å; E413-V416 WeakPolarHBondContact O-CB 3.48Å; E413-V416 PolarHBondContact O-N 2.83Å
414	D	87.6	Confident	89.2	Confident	135 Å²	135	62 Å²	62	72%	0.722	32%	0.316	S	S	*	.	H	α-helix	trans	-64.6	-38.1	177.9	-56.9	-39.7	0	0	0	111.9	S412 V416 E417	S412-D414 VanDerWaalsContact C-N 3.3Å; D414-V416 PolarHBondContact O-N 2.92Å; D414-E417 PolarHBondContact O-N 3.3Å
415	E	90.6	Very high	89.7	Confident	46 Å²	46	64.7 Å²	64.7	22%	0.215	33%	0.326	C	S	.	.	H	α-helix	trans	-67.6	-22.1	178.8	-167.4	179.8	-166.2	0	0	111.8	K411 S412 E413 E417 E418 L419	K411-E415 WeakPolarHBondContact CB-OE2 3.17Å; K411-E415 PolarHBondContact N-OE2 2.86Å; S412-E415 PolarHBondContact O-N 3.29Å; S412-E415 PolarHBondContact OG-N 3.17Å; E413-E415 VanDerWaalsContact C-N 3.33Å; E413-E415 PolarHBondContact O-N 3.14Å; E415-E417 VanDerWaalsContact C-N 3.34Å; E415-E417 PolarHBondContact O-N 3.22Å; E415-E418 PolarHBondContact O-N 3.09Å; E415-L419 HydrophobicContact CG-CD1 3.83Å; E415-L419 HydrophobicContact CG-CG 3.99Å; E415-L419 WeakPolarHBondContact O-CB 3.4Å; E415-L419 VanDerWaalsContact O-CG 3.22Å; E415-L419 WeakPolarHBondContact O-CG 3.19Å; E415-L419 PolarHBondContact O-N 2.89Å
416	V	90.8	Very high	89.6	Confident	17 Å²	17	65.1 Å²	65.1	10%	0.103	33%	0.332	C	S	.	.	H	α-helix	trans	-61.1	-43	-179.7	175.7	0	0	0	0	111.5	T347 V358 A410 E413 D414 L419 K420	T347-V416 HydrophobicContact CG2-CG2 4.27Å; V358-V416 HydrophobicContact CB-CG1 4.38Å; V358-V416 HydrophobicContact CG1-CG1 3.95Å; V358-V416 HydrophobicContact CG2-CG1 3.52Å; A410-V416 HydrophobicContact CB-CG2 3.64Å; E413-V416 VanDerWaalsContact O-CB 3.29Å; E413-V416 WeakPolarHBondContact O-CB 3.48Å; E413-V416 PolarHBondContact O-N 2.83Å; D414-V416 PolarHBondContact O-N 2.92Å; V416-L419 PolarHBondContact O-N 3.41Å; V416-K420 HydrophobicContact CG1-CD 4.47Å; V416-K420 VanDerWaalsContact O-CG 3.29Å; V416-K420 WeakPolarHBondContact O-CG 3.46Å; V416-K420 PolarHBondContact O-N 3.1Å
417	E	91.6	Very high	89.2	Confident	120 Å²	120	64.5 Å²	64.5	56%	0.561	33%	0.326	S	S	*	.	H	α-helix	trans	-69.6	-38.5	-179.3	-65.5	-54.5	130.5	0	0	111.7	D414 E415 K420 E421	D414-E417 PolarHBondContact O-N 3.3Å; E415-E417 VanDerWaalsContact C-N 3.34Å; E415-E417 PolarHBondContact O-N 3.22Å; E417-K420 WeakPolarHBondContact O-CB 3.3Å; E417-K420 PolarHBondContact O-N 2.65Å; E417-K420 IonicContact OE1-NZ 2.92Å; E417-K420 PolarHBondContact OE1-NZ 2.65Å; E417-K420 IonicContact OE2-NZ 3.92Å; E417-E421 PolarHBondContact O-N 3.1Å
418	E	91.7	Very high	88.9	Confident	139 Å²	139	69.8 Å²	69.8	65%	0.65	35%	0.349	S	S	*	.	H	α-helix	trans	-61.7	-46.4	174.6	-62.2	-175.8	174	0	0	111.3	E415 K420 E421 E422	E415-E418 PolarHBondContact O-N 3.09Å; E418-K420 PolarHBondContact O-N 3.46Å; E418-E421 PolarHBondContact O-N 3.28Å; E418-E422 PolarHBondContact O-N 3.07Å
419	L	91.3	Very high	88.4	Confident	14 Å²	14	73.4 Å²	73.4	7%	0.073	37%	0.365	C	S	.	.	H	α-helix	trans	-68.6	-32.5	179.9	-66.4	173.5	0	0	0	112.7	V349 L408 A410 E415 V416 E421 E422 I423	V349-L419 HydrophobicContact CB-CB 4.34Å; V349-L419 HydrophobicContact CG2-CB 3.95Å; V349-L419 HydrophobicContact CG2-CD1 4.23Å; L408-L419 HydrophobicContact CB-CD1 4.35Å; L408-L419 HydrophobicContact CB-CD2 4.14Å; L408-L419 HydrophobicContact CD1-CB 4.32Å; L408-L419 HydrophobicContact CD1-CD2 3.66Å; L408-L419 HydrophobicContact CG-CD2 4.45Å; A410-L419 HydrophobicContact CB-CD1 3.68Å; E415-L419 HydrophobicContact CG-CD1 3.83Å; E415-L419 HydrophobicContact CG-CG 3.99Å; E415-L419 WeakPolarHBondContact O-CB 3.4Å; E415-L419 VanDerWaalsContact O-CG 3.22Å; E415-L419 WeakPolarHBondContact O-CG 3.19Å; E415-L419 PolarHBondContact O-N 2.89Å; V416-L419 PolarHBondContact O-N 3.41Å; L419-E421 VanDerWaalsContact C-N 3.32Å; L419-E422 PolarHBondContact O-N 3.24Å; L419-I423 WeakPolarHBondContact O-CG1 3.5Å; L419-I423 PolarHBondContact O-N 3.44Å
420	K	92	Very high	87.6	Confident	55 Å²	55	73.2 Å²	73.2	24%	0.239	36%	0.363	C	S	.	.	H	α-helix	trans	-60.8	-43.4	172.1	-81.1	177.2	-176.2	169.9	0	111.2	V349 P356 V358 V416 E417 E418 S424	V349-K420 HydrophobicContact CG1-CG 4.07Å; P356-K420 HydrophobicContact CB-CB 4.09Å; P356-K420 HydrophobicContact CB-CG 3.94Å; P356-K420 HydrophobicContact CG-CB 3.73Å; P356-K420 HydrophobicContact CG-CD 4.29Å; P356-K420 HydrophobicContact CG-CG 3.77Å; V358-K420 HydrophobicContact CG2-CD 4.27Å; V358-K420 HydrophobicContact CG2-CG 4.11Å; V416-K420 HydrophobicContact CG1-CD 4.47Å; V416-K420 VanDerWaalsContact O-CG 3.29Å; V416-K420 WeakPolarHBondContact O-CG 3.46Å; V416-K420 PolarHBondContact O-N 3.1Å; E417-K420 WeakPolarHBondContact O-CB 3.3Å; E417-K420 PolarHBondContact O-N 2.65Å; E417-K420 IonicContact OE1-NZ 2.92Å; E417-K420 PolarHBondContact OE1-NZ 2.65Å; E417-K420 IonicContact OE2-NZ 3.92Å; E418-K420 PolarHBondContact O-N 3.46Å; K420-S424 WeakPolarHBondContact O-CB 3.25Å; K420-S424 PolarHBondContact O-N 3.28Å; K420-S424 VanDerWaalsContact O-N 3.08Å; K420-S424 PolarHBondContact O-OG 2.96Å
421	E	90.9	Very high	87.1	Confident	126 Å²	126	74.4 Å²	74.4	59%	0.589	37%	0.368	S	S	*	.	H	α-helix	trans	-67.5	-44.2	177.8	-162.7	-176.6	164	0	0	110.8	E417 E418 L419 I423 S424 N425	E417-E421 PolarHBondContact O-N 3.1Å; E418-E421 PolarHBondContact O-N 3.28Å; L419-E421 VanDerWaalsContact C-N 3.32Å; E421-I423 PolarHBondContact O-N 3.46Å; E421-S424 PolarHBondContact O-N 3.32Å; E421-N425 WeakPolarHBondContact O-CB 3.49Å; E421-N425 VanDerWaalsContact O-CG 3.22Å; E421-N425 PolarHBondContact O-N 3.17Å; E421-N425 PolarHBondContact O-ND2 3.06Å
422	E	89.3	Confident	86.9	Confident	82 Å²	82	74.7 Å²	74.7	38%	0.383	37%	0.372	S	S	.	.	H	α-helix	trans	-56.2	-48.9	177.1	-171.6	-177.9	169.9	0	0	112	L408 E418 L419 N425 A426	L408-E422 HydrophobicContact CD1-CG 4.44Å; E418-E422 PolarHBondContact O-N 3.07Å; L419-E422 PolarHBondContact O-N 3.24Å; E422-N425 PolarHBondContact O-N 3.44Å; E422-A426 WeakPolarHBondContact O-CB 3.01Å; E422-A426 PolarHBondContact O-N 3.31Å
423	I	87.3	Confident	86.5	Confident	6 Å²	6	73.6 Å²	73.6	3%	0.031	36%	0.364	C	S	.	.	H	α-helix	trans	-66.3	-40.6	179.6	-71.5	177.5	0	0	0	111.7	V349 A351 L408 L419 E421 N425 A426 L427	V349-I423 VanDerWaalsContact C-CD1 3.4Å; V349-I423 HydrophobicContact CB-CD1 3.7Å; V349-I423 HydrophobicContact CG1-CD1 3.62Å; V349-I423 WeakPolarHBondContact O-CD1 3.14Å; A351-I423 HydrophobicContact CB-CG2 3.56Å; L408-I423 HydrophobicContact CB-CD1 4.26Å; L408-I423 HydrophobicContact CD1-CD1 3.76Å; L408-I423 HydrophobicContact CD1-CG1 3.5Å; L408-I423 VanDerWaalsContact CD1-CG1 3.5Å; L408-I423 HydrophobicContact CG-CD1 3.9Å; L408-I423 HydrophobicContact CG-CG1 4.07Å; L419-I423 WeakPolarHBondContact O-CG1 3.5Å; L419-I423 PolarHBondContact O-N 3.44Å; E421-I423 PolarHBondContact O-N 3.46Å; I423-N425 VanDerWaalsContact C-N 3.3Å; I423-N425 PolarHBondContact O-N 3.43Å; I423-A426 WeakPolarHBondContact O-CB 2.98Å; I423-A426 PolarHBondContact O-N 2.9Å; I423-L427 PolarHBondContact O-N 3.46Å
424	S	86.7	Confident	86.3	Confident	33 Å²	33	66.3 Å²	66.3	23%	0.231	33%	0.332	C	S	.	.	H	α-helix	trans	-63.5	-40.2	177.2	-61.4	0	0	0	0	111.2	K420 E421 K428	K420-S424 WeakPolarHBondContact O-CB 3.25Å; K420-S424 PolarHBondContact O-N 3.28Å; K420-S424 VanDerWaalsContact O-N 3.08Å; K420-S424 PolarHBondContact O-OG 2.96Å; E421-S424 PolarHBondContact O-N 3.32Å; S424-K428 VanDerWaalsContact O-CG 3.31Å; S424-K428 WeakPolarHBondContact O-CG 3.2Å; S424-K428 PolarHBondContact O-N 3.36Å
425	N	87.2	Confident	86.1	Confident	72 Å²	72	68.3 Å²	68.3	39%	0.385	33%	0.334	S	S	.	.	H	α-helix	trans	-69.2	-37.7	176	-71.7	-19.9	0	0	0	111.5	E421 E422 I423 L427 K428 H429	E421-N425 WeakPolarHBondContact O-CB 3.49Å; E421-N425 VanDerWaalsContact O-CG 3.22Å; E421-N425 PolarHBondContact O-N 3.17Å; E421-N425 PolarHBondContact O-ND2 3.06Å; E422-N425 PolarHBondContact O-N 3.44Å; I423-N425 VanDerWaalsContact C-N 3.3Å; I423-N425 PolarHBondContact O-N 3.43Å; N425-L427 PolarHBondContact O-N 3.14Å; N425-K428 PolarHBondContact O-N 2.99Å; N425-H429 VanDerWaalsContact O-CB 3.23Å; N425-H429 WeakPolarHBondContact O-CB 3.46Å; N425-H429 PolarHBondContact O-N 3.43Å
426	A	81.5	Confident	86	Confident	22 Å²	22	70.5 Å²	70.5	18%	0.182	35%	0.347	C	S	.	.	H	α-helix	trans	-59.5	-47.1	174.2	0	0	0	0	0	111.6	E422 I423 H429 V430	E422-A426 WeakPolarHBondContact O-CB 3.01Å; E422-A426 PolarHBondContact O-N 3.31Å; I423-A426 WeakPolarHBondContact O-CB 2.98Å; I423-A426 PolarHBondContact O-N 2.9Å; A426-H429 PolarHBondContact O-N 2.99Å; A426-V430 VanDerWaalsContact O-CG2 3.31Å; A426-V430 WeakPolarHBondContact O-CG2 3.34Å; A426-V430 PolarHBondContact O-N 3.05Å; A426-V430 VanDerWaalsContact O-N 3.09Å
427	L	80.9	Confident	85.9	Confident	39 Å²	39	72.3 Å²	72.3	20%	0.204	36%	0.36	C	S	.	.	H	α-helix	trans	-62.7	-47.6	176.5	-177.2	151.3	0	0	0	111.6	A351 L402 L405 I423 N425 H429 V430 L431	A351-L427 HydrophobicContact CB-CD1 4.49Å; L402-L427 HydrophobicContact CD1-CD1 3.53Å; L405-L427 HydrophobicContact CD1-CB 4.15Å; L405-L427 HydrophobicContact CD1-CD1 3.81Å; L405-L427 HydrophobicContact CD1-CG 4.27Å; I423-L427 PolarHBondContact O-N 3.46Å; N425-L427 PolarHBondContact O-N 3.14Å; L427-H429 VanDerWaalsContact C-N 3.35Å; L427-H429 PolarHBondContact O-N 2.94Å; L427-V430 PolarHBondContact O-N 2.9Å; L427-L431 HydrophobicContact CD2-CD1 3.55Å; L427-L431 HydrophobicContact CD2-CG 4.22Å; L427-L431 HydrophobicContact CG-CD1 4.42Å; L427-L431 WeakPolarHBondContact O-CG 3.49Å; L427-L431 PolarHBondContact O-N 3.01Å
428	K	84.3	Confident	85.6	Confident	112 Å²	112	74.6 Å²	74.6	49%	0.487	37%	0.371	S	S	.	.	H	α-helix	trans	-59.3	-45.3	178	-74.8	172.8	-175.3	171.6	0	111.8	S424 N425 V430 L431 Q432	S424-K428 VanDerWaalsContact O-CG 3.31Å; S424-K428 WeakPolarHBondContact O-CG 3.2Å; S424-K428 PolarHBondContact O-N 3.36Å; N425-K428 PolarHBondContact O-N 2.99Å; K428-V430 VanDerWaalsContact C-N 3.29Å; K428-V430 PolarHBondContact O-N 3.29Å; K428-L431 PolarHBondContact O-N 3.48Å; K428-Q432 VanDerWaalsContact O-CB 3.29Å; K428-Q432 WeakPolarHBondContact O-CB 3.09Å; K428-Q432 VanDerWaalsContact O-CG 3.23Å; K428-Q432 WeakPolarHBondContact O-CG 3.34Å; K428-Q432 PolarHBondContact O-N 2.96Å
429	H	83.5	Confident	85.5	Confident	106 Å²	106	74.4 Å²	74.4	49%	0.491	36%	0.364	S	S	.	.	H	α-helix	trans	-64.2	-37.2	-178.7	-163.8	-61.1	0	0	0	111.3	N425 A426 L427 S433	N425-H429 VanDerWaalsContact O-CB 3.23Å; N425-H429 WeakPolarHBondContact O-CB 3.46Å; N425-H429 PolarHBondContact O-N 3.43Å; A426-H429 PolarHBondContact O-N 2.99Å; L427-H429 VanDerWaalsContact C-N 3.35Å; L427-H429 PolarHBondContact O-N 2.94Å; H429-S433 WeakPolarHBondContact O-CB 3.49Å; H429-S433 PolarHBondContact O-N 3.35Å; H429-S433 VanDerWaalsContact O-N 3.15Å
430	V	77.8	Confident	85.5	Confident	25 Å²	25	73.8 Å²	73.8	15%	0.152	36%	0.361	C	S	.	.	H	α-helix	trans	-67.4	-45.6	174.2	178.4	0	0	0	0	111.2	A426 L427 K428 S433 L448	A426-V430 VanDerWaalsContact O-CG2 3.31Å; A426-V430 WeakPolarHBondContact O-CG2 3.34Å; A426-V430 PolarHBondContact O-N 3.05Å; A426-V430 VanDerWaalsContact O-N 3.09Å; L427-V430 PolarHBondContact O-N 2.9Å; K428-V430 VanDerWaalsContact C-N 3.29Å; K428-V430 PolarHBondContact O-N 3.29Å; V430-S433 PolarHBondContact O-N 3.07Å; V430-S433 PolarHBondContact O-OG 2.92Å; V430-L448 HydrophobicContact CB-CD2 4.3Å; V430-L448 HydrophobicContact CG1-CD1 3.36Å; V430-L448 HydrophobicContact CG1-CD2 3.58Å; V430-L448 HydrophobicContact CG1-CG 4.11Å; V430-L448 HydrophobicContact CG2-CD2 4.33Å
431	L	81.9	Confident	85.5	Confident	33 Å²	33	71.1 Å²	71.1	17%	0.173	35%	0.349	C	S	.	.	H	α-helix	trans	-66.6	-39.5	179	-65	-179.1	0	0	0	112.7	L427 K428 S433 V434 L451 I468	L427-L431 HydrophobicContact CD2-CD1 3.55Å; L427-L431 HydrophobicContact CD2-CG 4.22Å; L427-L431 HydrophobicContact CG-CD1 4.42Å; L427-L431 WeakPolarHBondContact O-CG 3.49Å; L427-L431 PolarHBondContact O-N 3.01Å; K428-L431 PolarHBondContact O-N 3.48Å; L431-S433 VanDerWaalsContact C-N 3.29Å; L431-S433 PolarHBondContact O-N 3.07Å; L431-V434 PolarHBondContact O-N 3.28Å; L431-L451 HydrophobicContact CD2-CD2 4Å; L431-I468 HydrophobicContact CD2-CD1 4Å; L431-I468 HydrophobicContact CD2-CG1 4.15Å
432	Q	83.8	Confident	85.7	Confident	152 Å²	152	65.3 Å²	65.3	71%	0.71	32%	0.322	S	S	*	.	H	α-helix	trans	-70	-25.8	179.8	-75.2	175.5	-14.6	0	0	113.6	K428 V434	K428-Q432 VanDerWaalsContact O-CB 3.29Å; K428-Q432 WeakPolarHBondContact O-CB 3.09Å; K428-Q432 VanDerWaalsContact O-CG 3.23Å; K428-Q432 WeakPolarHBondContact O-CG 3.34Å; K428-Q432 PolarHBondContact O-N 2.96Å; Q432-V434 PolarHBondContact O-N 3.19Å
433	S	79.3	Confident	85.9	Confident	36 Å²	36	61.4 Å²	61.4	25%	0.252	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-18.6	177.6	76	0	0	0	0	113.3	F67 H429 V430 L431 K435	F67-S433 WeakPolarHBondContact CE2-OG 3.44Å; F67-S433 WeakPolarHBondContact CZ-OG 3.05Å; H429-S433 WeakPolarHBondContact O-CB 3.49Å; H429-S433 PolarHBondContact O-N 3.35Å; H429-S433 VanDerWaalsContact O-N 3.15Å; V430-S433 PolarHBondContact O-N 3.07Å; V430-S433 PolarHBondContact O-OG 2.92Å; L431-S433 VanDerWaalsContact C-N 3.29Å; L431-S433 PolarHBondContact O-N 3.07Å; S433-K435 PolarHBondContact O-N 2.82Å
434	V	82	Confident	86.2	Confident	22 Å²	22	61.2 Å²	61.2	13%	0.133	30%	0.303	C	S	.	.	S	Bend	trans	-80.6	118.1	176.5	-176.9	0	0	0	0	108.5	L431 Q432 L436 L455 Y465 I468	L431-V434 PolarHBondContact O-N 3.28Å; Q432-V434 PolarHBondContact O-N 3.19Å; V434-L436 HydrophobicContact CG1-CD2 4.46Å; V434-L436 PolarHBondContact O-N 2.97Å; V434-L436 VanDerWaalsContact O-N 3.15Å; V434-L455 HydrophobicContact CG1-CD1 3.88Å; V434-L455 HydrophobicContact CG2-CD1 4.15Å; V434-Y465 HydrophobicContact CG1-CE2 3.65Å; V434-I468 HydrophobicContact CB-CD1 3.54Å; V434-I468 HydrophobicContact CG1-CD1 3.85Å; V434-I468 HydrophobicContact CG2-CD1 3.57Å
435	K	83.9	Confident	86.1	Confident	178 Å²	178	59.6 Å²	59.6	77%	0.774	29%	0.292	S	S	*	.			trans	-65.7	114.1	173.4	-66	-178.2	-179.4	178.6	0	109.6	S433 Y465	S433-K435 PolarHBondContact O-N 2.82Å; K435-Y465 WeakPolarHBondContact O-CE2 3.36Å; K435-Y465 PolarHBondContact O-OH 3.32Å
436	L	88.6	Confident	85.8	Confident	91 Å²	91	57.4 Å²	57.4	48%	0.476	28%	0.282	S	S	.	.			trans	-92.2	147.5	175.6	-59.6	174.5	0	0	0	110.1	V434 Y465 I468	V434-L436 HydrophobicContact CG1-CD2 4.46Å; V434-L436 PolarHBondContact O-N 2.97Å; V434-L436 VanDerWaalsContact O-N 3.15Å; L436-Y465 HydrophobicContact CD2-CD2 3.93Å; L436-Y465 HydrophobicContact CD2-CE2 4.12Å; L436-I468 HydrophobicContact CD2-CD1 4.48Å; L436-I468 HydrophobicContact CD2-CG1 4.26Å; L436-I468 HydrophobicContact CD2-CG2 4.03Å
437	S	88.2	Confident	85.6	Confident	56 Å²	56	57.6 Å²	57.6	39%	0.392	28%	0.281	S	S	.	.			trans	-95.1	157.1	172.8	-60.4	0	0	0	0	110.5	R439 Y465 F466	S437-R439 WeakPolarHBondContact CB-O 3.46Å; S437-R439 PolarHBondContact O-N 3.24Å; S437-Y465 PolarHBondContact N-O 2.89Å; S437-F466 VanDerWaalsContact O-CA 3.29Å; S437-F466 WeakPolarHBondContact O-CA 3.45Å; S437-F466 VanDerWaalsContact O-CB 3.28Å; S437-F466 WeakPolarHBondContact O-CB 3.38Å
438	E	86	Confident	85.4	Confident	167 Å²	167	56.7 Å²	56.7	78%	0.78	28%	0.276	S	S	*	.	S	Bend	trans	-68.5	-24.5	175.6	-64.7	-171.2	169.6	0	0	113.4	R487	E438-R487 PolarHBondContact O-NH1 2.69Å; E438-R487 VanDerWaalsContact O-NH1 3.13Å
439	R	88.3	Confident	84.7	Confident	136 Å²	136	51.4 Å²	51.4	51%	0.513	25%	0.253	S	S	.	.	S	Bend	trans	-126.8	147.1	176.6	-62.1	-175.7	-176.8	-171.2	-1.4	108.9	S437 P464 M484 L491	S437-R439 WeakPolarHBondContact CB-O 3.46Å; S437-R439 PolarHBondContact O-N 3.24Å; R439-P464 WeakPolarHBondContact O-CB 3.35Å; R439-M484 HydrophobicContact CB-SD 4.2Å; R439-M484 HydrophobicContact CG-SD 4.37Å; R439-L491 HydrophobicContact CB-CD1 4.1Å
440	G	91.3	Very high	84.3	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.23	C	C	.	.			trans	158.9	-175.9	177	0	0	0	0	0	113.6	P464 F466 L491	G440-P464 CarbonylContact C-O 3.45Å; G440-P464 WeakPolarHBondContact CA-O 3.32Å; G440-F466 WeakPolarHBondContact O-CD1 3.47Å; G440-L491 VanDerWaalsContact O-O 3.1Å
441	V	93.2	Very high	84.5	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	156.4	171.7	-60.4	0	0	0	0	111.4	V443 L458 I463 P464 Y465 F466 L491 V493 L495 F529	V441-V443 HydrophobicContact CG2-CG2 4.05Å; V441-L458 HydrophobicContact CG2-CD1 4.23Å; V441-I463 HydrophobicContact CG1-CG2 4.17Å; V441-I463 HydrophobicContact CG2-CG2 4.07Å; V441-P464 PolarHBondContact N-O 3.13Å; V441-Y465 VanDerWaalsContact O-CA 3.28Å; V441-Y465 WeakPolarHBondContact O-CA 3.44Å; V441-Y465 WeakPolarHBondContact O-CB 3.21Å; V441-F466 WeakPolarHBondContact O-CD1 3Å; V441-F466 PolarHBondContact O-N 2.86Å; V441-F466 VanDerWaalsContact O-N 3.09Å; V441-L491 HydrophobicContact CG1-CD2 4.36Å; V441-V493 HydrophobicContact CG1-CB 4.33Å; V441-L495 HydrophobicContact CB-CD1 4.33Å; V441-L495 HydrophobicContact CB-CG 4.44Å; V441-L495 HydrophobicContact CG2-CD1 3.82Å; V441-L495 HydrophobicContact CG2-CG 4.4Å; V441-F529 HydrophobicContact CG1-CE2 3.76Å; V441-F529 HydrophobicContact CG1-CZ 3.65Å
442	Y	94.8	Very high	84.2	Confident	4 Å²	4	46.7 Å²	46.7	2%	0.016	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	132.2	170.5	-162.8	-92.4	0	0	0	109.7	F466 D477 K480 V493 I494 L495	Y442-F466 AromaticContact CD2-CE1 3.87Å; Y442-F466 HydrophobicContact CD2-CE1 3.87Å; Y442-F466 HydrophobicContact CD2-CE2 4.1Å; Y442-F466 AromaticContact CD2-CZ 3.56Å; Y442-F466 HydrophobicContact CD2-CZ 3.56Å; Y442-F466 HydrophobicContact CE2-CZ 4.48Å; Y442-F466 HydrophobicContact CG-CE1 4.33Å; Y442-F466 HydrophobicContact CG-CZ 4.33Å; Y442-D477 HydrophobicContact CD1-CB 4.33Å; Y442-D477 HydrophobicContact CE1-CB 3.66Å; Y442-D477 PolarHBondContact OH-OD1 3.39Å; Y442-K480 HydrophobicContact CD2-CB 4.4Å; Y442-K480 HydrophobicContact CE2-CB 4.15Å; Y442-K480 HydrophobicContact CE2-CD 3.88Å; Y442-V493 PolarHBondContact N-O 2.82Å; Y442-I494 HydrophobicContact CD1-CG1 4.38Å; Y442-I494 HydrophobicContact CD1-CG2 4.45Å; Y442-I494 CarbonylContact O-C 3.56Å; Y442-I494 WeakPolarHBondContact O-CA 2.98Å; Y442-L495 PolarHBondContact O-N 2.96Å
443	V	93.9	Very high	83.6	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	128.1	-172.7	-174.3	0	0	0	0	111.1	V441 L451 L454 L455 L458 G467 I468 N469	V441-V443 HydrophobicContact CG2-CG2 4.05Å; V443-L451 HydrophobicContact CB-CD1 4.42Å; V443-L451 HydrophobicContact CG1-CD1 3.77Å; V443-L454 HydrophobicContact CG1-CD2 3.35Å; V443-L454 HydrophobicContact CG1-CG 3.88Å; V443-L455 HydrophobicContact CG2-CD2 4.34Å; V443-L458 HydrophobicContact CG2-CD1 3.57Å; V443-G467 PolarHBondContact N-O 3.16Å; V443-I468 HydrophobicContact CB-CG2 4.3Å; V443-I468 WeakPolarHBondContact O-CA 3.46Å; V443-N469 PolarHBondContact O-N 2.93Å
444	Q	92.2	Very high	83.7	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.005	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	134.4	176.3	-160.8	76.5	0.1	0	0	110.3	N469 G471 P472 V473 L495 F497 V499	Q444-N469 VanDerWaalsContact OE1-CB 3.26Å; Q444-N469 PolarHBondContact OE1-O 3.1Å; Q444-G471 WeakPolarHBondContact CG-O 3.43Å; Q444-G471 PolarHBondContact NE2-O 2.79Å; Q444-P472 PolarHBondContact NE2-O 2.73Å; Q444-P472 VanDerWaalsContact NE2-O 3.12Å; Q444-V473 HydrophobicContact CB-CG2 4.06Å; Q444-V473 HydrophobicContact CG-CG2 3.88Å; Q444-L495 PolarHBondContact N-O 2.93Å; Q444-L495 VanDerWaalsContact O-O 3.14Å; Q444-F497 PolarHBondContact O-N 2.9Å; Q444-V499 HydrophobicContact CB-CG2 4.22Å; Q444-V499 HydrophobicContact CG-CG1 4.42Å; Q444-V499 HydrophobicContact CG-CG2 3.96Å
445	A	86.5	Confident	83.9	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	158.8	176.5	0	0	0	0	0	112.8	L451 N469 V470 G471 F497	A445-L451 HydrophobicContact CB-CB 3.9Å; A445-L451 HydrophobicContact CB-CD1 4.25Å; A445-N469 PolarHBondContact N-O 3.35Å; A445-V470 WeakPolarHBondContact O-CA 3.44Å; A445-V470 WeakPolarHBondContact O-CG1 3.42Å; A445-G471 PolarHBondContact O-N 3.38Å; A445-F497 WeakPolarHBondContact CA-O 3.49Å; A445-F497 HydrophobicContact CB-CB 4.49Å; A445-F497 HydrophobicContact CB-CD1 4.5Å
446	S	80.4	Confident	83.7	Confident	26 Å²	26	35.6 Å²	35.6	18%	0.182	18%	0.181	C	C	.	.	S	Bend	trans	-71.9	-37.8	-177.3	62.4	0	0	0	0	113	F497 D498 V499	S446-F497 PolarHBondContact N-O 2.72Å; S446-D498 VanDerWaalsContact CB-O 3.26Å; S446-D498 WeakPolarHBondContact CB-O 3.29Å; S446-D498 WeakPolarHBondContact CB-OD2 3.42Å; S446-D498 PolarHBondContact OG-OD2 3.29Å; S446-V499 VanDerWaalsContact CA-CG1 3.49Å
447	T	76	Confident	83.2	Confident	26 Å²	26	33.3 Å²	33.3	16%	0.16	17%	0.167	C	C	.	.	B	Isolated β-bridge	trans	-127.4	157.1	179.2	79.1	0	0	0	0	110.2	A403 G449 S450 L451	A403-T447 HydrophobicContact CB-CG2 3.65Å; T447-G449 PolarHBondContact O-N 3.3Å; T447-G449 PolarHBondContact OG1-N 3.34Å; T447-S450 WeakPolarHBondContact CA-OG 3.15Å; T447-S450 PolarHBondContact N-OG 3.27Å; T447-S450 PolarHBondContact O-N 2.84Å; T447-S450 PolarHBondContact O-OG 2.86Å; T447-S450 PolarHBondContact OG1-N 3.15Å; T447-S450 PolarHBondContact OG1-OG 3.27Å; T447-L451 PolarHBondContact O-N 3.37Å
448	L	77.8	Confident	83.2	Confident	20 Å²	20	30.9 Å²	30.9	11%	0.105	15%	0.149	C	C	.	.	H	α-helix	trans	-68	-21.3	174.1	150.1	79	0	0	0	112.1	L405 V430 L451 E452 V470	L405-L448 HydrophobicContact CD2-CD2 4.18Å; V430-L448 HydrophobicContact CB-CD2 4.3Å; V430-L448 HydrophobicContact CG1-CD1 3.36Å; V430-L448 HydrophobicContact CG1-CD2 3.58Å; V430-L448 HydrophobicContact CG1-CG 4.11Å; V430-L448 HydrophobicContact CG2-CD2 4.33Å; L448-L451 HydrophobicContact CD1-CD2 4.44Å; L448-L451 PolarHBondContact O-N 3.44Å; L448-E452 HydrophobicContact CD1-CG 4.46Å; L448-E452 WeakPolarHBondContact O-CG 3.41Å; L448-E452 PolarHBondContact O-N 2.97Å; L448-V470 HydrophobicContact CB-CG2 4.32Å
449	G	69.7	Low	83.2	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-72.2	-41.3	174	0	0	0	0	0	112.4	R175 T447 L451 E452 A453	R175-G449 VanDerWaalsContact NH1-N 3.13Å; T447-G449 PolarHBondContact O-N 3.3Å; T447-G449 PolarHBondContact OG1-N 3.34Å; G449-L451 VanDerWaalsContact C-N 3.32Å; G449-E452 PolarHBondContact O-N 3.47Å; G449-A453 PolarHBondContact O-N 2.75Å; G449-A453 VanDerWaalsContact O-N 3.1Å
450	S	74.7	Confident	82.9	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-66.8	-33.9	171.3	44.5	0	0	0	0	112.7	T447 A453 L454 F497	T447-S450 WeakPolarHBondContact CA-OG 3.15Å; T447-S450 PolarHBondContact N-OG 3.27Å; T447-S450 PolarHBondContact O-N 2.84Å; T447-S450 PolarHBondContact O-OG 2.86Å; T447-S450 PolarHBondContact OG1-N 3.15Å; T447-S450 PolarHBondContact OG1-OG 3.27Å; S450-A453 PolarHBondContact O-N 3.16Å; S450-L454 WeakPolarHBondContact O-CB 3.45Å; S450-L454 PolarHBondContact O-N 2.66Å; S450-F497 VanDerWaalsContact CB-CD1 3.47Å
451	L	82.6	Confident	82.5	Confident	2 Å²	2	29.5 Å²	29.5	1%	0.01	16%	0.157	C	C	.	.	H	α-helix	trans	-62.2	-47.8	173.8	-175.7	63.2	0	0	0	110.9	L431 V443 A445 T447 L448 G449 A453 L454 L455 I468 V470	L431-L451 HydrophobicContact CD2-CD2 4Å; V443-L451 HydrophobicContact CB-CD1 4.42Å; V443-L451 HydrophobicContact CG1-CD1 3.77Å; A445-L451 HydrophobicContact CB-CB 3.9Å; A445-L451 HydrophobicContact CB-CD1 4.25Å; T447-L451 PolarHBondContact O-N 3.37Å; L448-L451 HydrophobicContact CD1-CD2 4.44Å; L448-L451 PolarHBondContact O-N 3.44Å; G449-L451 VanDerWaalsContact C-N 3.32Å; L451-A453 VanDerWaalsContact C-N 3.34Å; L451-A453 PolarHBondContact O-N 3.44Å; L451-L454 PolarHBondContact O-N 3.37Å; L451-L455 HydrophobicContact CD1-CD1 4.19Å; L451-L455 HydrophobicContact CD1-CG 4.25Å; L451-L455 HydrophobicContact CG-CD1 3.9Å; L451-L455 HydrophobicContact CG-CG 4.36Å; L451-L455 WeakPolarHBondContact O-CB 3.36Å; L451-L455 WeakPolarHBondContact O-CG 3.12Å; L451-L455 PolarHBondContact O-N 3.25Å; L451-I468 HydrophobicContact CD1-CB 4.27Å; L451-I468 HydrophobicContact CD2-CB 4.37Å; L451-I468 HydrophobicContact CD2-CD1 4.33Å; L451-V470 HydrophobicContact CD2-CG2 3.8Å
452	E	74.5	Confident	82.2	Confident	64 Å²	64	38.5 Å²	38.5	30%	0.299	20%	0.196	S	C	.	.	H	α-helix	trans	-56.7	-47.1	175.8	-74.2	170.7	-173.3	0	0	111.9	S174 L448 G449 L455 E456	S174-E452 VanDerWaalsContact CB-OE2 3.25Å; S174-E452 WeakPolarHBondContact CB-OE2 3.37Å; S174-E452 PolarHBondContact OG-OE2 3.42Å; L448-E452 HydrophobicContact CD1-CG 4.46Å; L448-E452 WeakPolarHBondContact O-CG 3.41Å; L448-E452 PolarHBondContact O-N 2.97Å; G449-E452 PolarHBondContact O-N 3.47Å; E452-L455 PolarHBondContact O-N 2.68Å; E452-E456 WeakPolarHBondContact O-CB 3.49Å; E452-E456 PolarHBondContact O-N 3.43Å
453	A	71.6	Confident	81.8	Confident	35 Å²	35	38.6 Å²	38.6	29%	0.289	20%	0.197	S	C	.	.	H	α-helix	trans	-61.5	-45.9	180	0	0	0	0	0	111.8	G449 S450 L451 F457 I522	G449-A453 PolarHBondContact O-N 2.75Å; G449-A453 VanDerWaalsContact O-N 3.1Å; S450-A453 PolarHBondContact O-N 3.16Å; L451-A453 VanDerWaalsContact C-N 3.34Å; L451-A453 PolarHBondContact O-N 3.44Å; A453-F457 VanDerWaalsContact O-CB 3.3Å; A453-F457 WeakPolarHBondContact O-CB 3.33Å; A453-F457 PolarHBondContact O-N 3Å; A453-F457 VanDerWaalsContact O-N 3.08Å; A453-I522 HydrophobicContact CB-CD1 3.79Å
454	L	82	Confident	81.7	Confident	4 Å²	4	40.8 Å²	40.8	2%	0.021	21%	0.211	C	C	.	.	H	α-helix	trans	-65.6	-39.6	177.8	-178.8	55.7	0	0	0	111.9	V443 S450 L451 F457 L458 F497 I522 L525	V443-L454 HydrophobicContact CG1-CD2 3.35Å; V443-L454 HydrophobicContact CG1-CG 3.88Å; S450-L454 WeakPolarHBondContact O-CB 3.45Å; S450-L454 PolarHBondContact O-N 2.66Å; L451-L454 PolarHBondContact O-N 3.37Å; L454-F457 WeakPolarHBondContact O-CB 3.42Å; L454-F457 PolarHBondContact O-N 3.33Å; L454-L458 HydrophobicContact CD1-CD1 4.47Å; L454-L458 HydrophobicContact CD1-CG 4.37Å; L454-L458 HydrophobicContact CG-CD1 4.28Å; L454-L458 VanDerWaalsContact O-CG 3.26Å; L454-L458 WeakPolarHBondContact O-CG 3.4Å; L454-L458 PolarHBondContact O-N 3.36Å; L454-F497 HydrophobicContact CD2-CB 3.89Å; L454-I522 HydrophobicContact CD1-CG2 4.12Å; L454-L525 HydrophobicContact CD1-CD2 4Å; L454-L525 HydrophobicContact CD2-CD2 3.95Å
455	L	86.9	Confident	81.7	Confident	5 Å²	5	41.4 Å²	41.4	3%	0.026	21%	0.213	C	C	.	.	H	α-helix	trans	-67.8	-42.6	178.3	-70.6	173.1	0	0	0	112.7	V434 V443 L451 E452 F457 L458 R459 Y465 I468	V434-L455 HydrophobicContact CG1-CD1 3.88Å; V434-L455 HydrophobicContact CG2-CD1 4.15Å; V443-L455 HydrophobicContact CG2-CD2 4.34Å; L451-L455 HydrophobicContact CD1-CD1 4.19Å; L451-L455 HydrophobicContact CD1-CG 4.25Å; L451-L455 HydrophobicContact CG-CD1 3.9Å; L451-L455 HydrophobicContact CG-CG 4.36Å; L451-L455 WeakPolarHBondContact O-CB 3.36Å; L451-L455 WeakPolarHBondContact O-CG 3.12Å; L451-L455 PolarHBondContact O-N 3.25Å; E452-L455 PolarHBondContact O-N 2.68Å; L455-F457 PolarHBondContact O-N 3.04Å; L455-L458 PolarHBondContact O-N 3.48Å; L455-R459 WeakPolarHBondContact O-CG 3.39Å; L455-R459 PolarHBondContact O-N 3.02Å; L455-Y465 HydrophobicContact CD2-CD1 3.81Å; L455-Y465 HydrophobicContact CD2-CD2 3.84Å; L455-Y465 HydrophobicContact CD2-CE1 3.85Å; L455-Y465 HydrophobicContact CD2-CE2 3.92Å; L455-Y465 HydrophobicContact CD2-CG 3.81Å; L455-I468 HydrophobicContact CD1-CD1 4.37Å; L455-I468 HydrophobicContact CD1-CG2 4.26Å; L455-I468 HydrophobicContact CD2-CG2 3.76Å
456	E	79.3	Confident	82	Confident	111 Å²	111	43.4 Å²	43.4	52%	0.519	22%	0.222	S	C	.	.	H	α-helix	trans	-61.9	-40	176.3	-169.9	60.2	-165.1	0	0	110.8	E452 R459 A460	E452-E456 WeakPolarHBondContact O-CB 3.49Å; E452-E456 PolarHBondContact O-N 3.43Å; E456-R459 PolarHBondContact O-N 3.2Å; E456-R459 IonicContact OE2-CZ 2.74Å; E456-R459 IonicContact OE2-NH1 3.98Å; E456-R459 PolarHBondContact OE2-NH1 2.92Å; E456-A460 PolarHBondContact O-N 3.29Å
457	F	78.3	Confident	82.5	Confident	43 Å²	43	42.5 Å²	42.5	19%	0.189	22%	0.217	C	C	.	.	H	α-helix	trans	-60.9	-48.6	174.5	-167.9	-86.1	0	0	0	112.7	A453 L454 L455 R459 A460 Q461 I522 Y523 E526	A453-F457 VanDerWaalsContact O-CB 3.3Å; A453-F457 WeakPolarHBondContact O-CB 3.33Å; A453-F457 PolarHBondContact O-N 3Å; A453-F457 VanDerWaalsContact O-N 3.08Å; L454-F457 WeakPolarHBondContact O-CB 3.42Å; L454-F457 PolarHBondContact O-N 3.33Å; L455-F457 PolarHBondContact O-N 3.04Å; F457-R459 VanDerWaalsContact C-N 3.28Å; F457-R459 PolarHBondContact O-N 3.3Å; F457-A460 WeakPolarHBondContact O-CB 3.16Å; F457-A460 PolarHBondContact O-N 2.91Å; F457-A460 VanDerWaalsContact O-N 3.16Å; F457-Q461 HydrophobicContact CD1-CG 4.41Å; F457-Q461 HydrophobicContact CE1-CG 3.66Å; F457-Q461 HydrophobicContact CZ-CG 3.97Å; F457-Q461 PolarHBondContact O-N 2.94Å; F457-I522 HydrophobicContact CB-CG2 4.42Å; F457-I522 HydrophobicContact CD1-CG2 4.4Å; F457-I522 HydrophobicContact CG-CG2 4.14Å; F457-Y523 HydrophobicContact CE2-CE1 4.32Å; F457-E526 HydrophobicContact CE1-CB 3.92Å; F457-E526 HydrophobicContact CE1-CG 3.61Å; F457-E526 WeakPolarHBondContact CE1-OE1 3.38Å; F457-E526 WeakPolarHBondContact CE1-OE2 3.47Å; F457-E526 HydrophobicContact CZ-CG 4.1Å; F457-E526 WeakPolarHBondContact CZ-OE1 3.4Å; F457-E526 WeakPolarHBondContact CZ-OE2 3.47Å
458	L	86.9	Confident	83.3	Confident	5 Å²	5	42.1 Å²	42.1	3%	0.026	21%	0.214	C	C	.	.	H	α-helix	trans	-61.1	-36.1	177.4	-70.3	170.8	0	0	0	112.5	V441 V443 L454 L455 Q461 K462 I463 Y465 L495	V441-L458 HydrophobicContact CG2-CD1 4.23Å; V443-L458 HydrophobicContact CG2-CD1 3.57Å; L454-L458 HydrophobicContact CD1-CD1 4.47Å; L454-L458 HydrophobicContact CD1-CG 4.37Å; L454-L458 HydrophobicContact CG-CD1 4.28Å; L454-L458 VanDerWaalsContact O-CG 3.26Å; L454-L458 WeakPolarHBondContact O-CG 3.4Å; L454-L458 PolarHBondContact O-N 3.36Å; L455-L458 PolarHBondContact O-N 3.48Å; L458-Q461 CarbonylContact O-C 3.58Å; L458-Q461 PolarHBondContact O-N 3.45Å; L458-K462 PolarHBondContact O-N 3.49Å; L458-I463 HydrophobicContact CB-CB 4.41Å; L458-I463 HydrophobicContact CD2-CB 3.94Å; L458-I463 HydrophobicContact CD2-CD1 3.84Å; L458-I463 HydrophobicContact CD2-CG2 3.94Å; L458-I463 PolarHBondContact O-N 3.4Å; L458-Y465 HydrophobicContact CB-CD1 4.26Å; L458-Y465 HydrophobicContact CD1-CD1 4.37Å; L458-L495 HydrophobicContact CD1-CD1 4.12Å; L458-L495 HydrophobicContact CD2-CD1 3.77Å
459	R	86.8	Confident	83.9	Confident	115 Å²	115	43.2 Å²	43.2	43%	0.434	22%	0.22	S	C	.	.	H	α-helix	trans	-64.1	-43.9	174.2	-70.9	175.6	-165.1	149.7	3.2	112	L455 E456 F457 Q461 K462 Y465	L455-R459 WeakPolarHBondContact O-CG 3.39Å; L455-R459 PolarHBondContact O-N 3.02Å; E456-R459 PolarHBondContact O-N 3.2Å; E456-R459 IonicContact OE2-CZ 2.74Å; E456-R459 IonicContact OE2-NH1 3.98Å; E456-R459 PolarHBondContact OE2-NH1 2.92Å; F457-R459 VanDerWaalsContact C-N 3.28Å; F457-R459 PolarHBondContact O-N 3.3Å; R459-Q461 PolarHBondContact O-N 3.33Å; R459-K462 PolarHBondContact O-N 3.2Å; R459-Y465 HydrophobicContact CG-CE1 4.01Å; R459-Y465 PolarHBondContact NE-OH 3.23Å; R459-Y465 PolarHBondContact NH2-OH 3.41Å
460	A	82.2	Confident	84.6	Confident	76 Å²	76	43.7 Å²	43.7	63%	0.628	22%	0.223	S	C	*	.	H	α-helix	trans	-58.4	-39.6	177.5	0	0	0	0	0	111.4	E456 F457 K462	E456-A460 PolarHBondContact O-N 3.29Å; F457-A460 WeakPolarHBondContact O-CB 3.16Å; F457-A460 PolarHBondContact O-N 2.91Å; F457-A460 VanDerWaalsContact O-N 3.16Å; A460-K462 VanDerWaalsContact C-N 3.27Å; A460-K462 PolarHBondContact O-N 3.47Å
461	Q	83.2	Confident	85.1	Confident	82 Å²	82	44 Å²	44	38%	0.383	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	5.4	176.7	-62.9	-58.9	-15.8	0	0	114.7	F457 L458 R459 I463 E526	F457-Q461 HydrophobicContact CD1-CG 4.41Å; F457-Q461 HydrophobicContact CE1-CG 3.66Å; F457-Q461 HydrophobicContact CZ-CG 3.97Å; F457-Q461 PolarHBondContact O-N 2.94Å; L458-Q461 CarbonylContact O-C 3.58Å; L458-Q461 PolarHBondContact O-N 3.45Å; R459-Q461 PolarHBondContact O-N 3.33Å; Q461-I463 HydrophobicContact CB-CD1 3.75Å; Q461-I463 HydrophobicContact CB-CG1 4Å; Q461-I463 PolarHBondContact O-N 3.41Å; Q461-E526 PolarHBondContact NE2-OE1 3.38Å
462	K	86.2	Confident	85.5	Confident	189 Å²	189	45.9 Å²	45.9	82%	0.822	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.5	32	-176.6	-55.6	177.9	-179.6	176	0	113.1	L458 R459 A460 P464	L458-K462 PolarHBondContact O-N 3.49Å; R459-K462 PolarHBondContact O-N 3.2Å; A460-K462 VanDerWaalsContact C-N 3.27Å; A460-K462 PolarHBondContact O-N 3.47Å; K462-P464 WeakPolarHBondContact O-CD 3.44Å
463	I	87.3	Confident	86.3	Confident	6 Å²	6	42.8 Å²	42.8	3%	0.031	22%	0.224	C	C	.	.			trans	-90.2	115.5	175.7	-61.3	163.2	0	0	0	107.9	V441 L458 Q461 F529	V441-I463 HydrophobicContact CG1-CG2 4.17Å; V441-I463 HydrophobicContact CG2-CG2 4.07Å; L458-I463 HydrophobicContact CB-CB 4.41Å; L458-I463 HydrophobicContact CD2-CB 3.94Å; L458-I463 HydrophobicContact CD2-CD1 3.84Å; L458-I463 HydrophobicContact CD2-CG2 3.94Å; L458-I463 PolarHBondContact O-N 3.4Å; Q461-I463 HydrophobicContact CB-CD1 3.75Å; Q461-I463 HydrophobicContact CB-CG1 4Å; Q461-I463 PolarHBondContact O-N 3.41Å; I463-F529 HydrophobicContact CD1-CD1 3.84Å; I463-F529 HydrophobicContact CD1-CE1 3.61Å; I463-F529 HydrophobicContact CG1-CE1 4.09Å; I463-F529 HydrophobicContact CG2-CE1 3.91Å; I463-F529 HydrophobicContact CG2-CZ 4.23Å
464	P	91.4	Very high	87.3	Confident	47 Å²	47	43 Å²	43	31%	0.305	22%	0.219	S	C	.	.			trans	-75	148.6	179.2	32.8	-34.8	0	0	0	110.2	R439 G440 V441 K462 L491	R439-P464 WeakPolarHBondContact O-CB 3.35Å; G440-P464 CarbonylContact C-O 3.45Å; G440-P464 WeakPolarHBondContact CA-O 3.32Å; V441-P464 PolarHBondContact N-O 3.13Å; K462-P464 WeakPolarHBondContact O-CD 3.44Å; P464-L491 HydrophobicContact CG-CD1 4.42Å; P464-L491 HydrophobicContact CG-CD2 4.47Å
465	Y	92.4	Very high	87.8	Confident	13 Å²	13	47.2 Å²	47.2	5%	0.051	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	137.5	176.2	51.3	-97.7	0	0	0	109.3	V434 K435 L436 S437 V441 L455 L458 R459 I468	V434-Y465 HydrophobicContact CG1-CE2 3.65Å; K435-Y465 WeakPolarHBondContact O-CE2 3.36Å; K435-Y465 PolarHBondContact O-OH 3.32Å; L436-Y465 HydrophobicContact CD2-CD2 3.93Å; L436-Y465 HydrophobicContact CD2-CE2 4.12Å; S437-Y465 PolarHBondContact N-O 2.89Å; V441-Y465 VanDerWaalsContact O-CA 3.28Å; V441-Y465 WeakPolarHBondContact O-CA 3.44Å; V441-Y465 WeakPolarHBondContact O-CB 3.21Å; L455-Y465 HydrophobicContact CD2-CD1 3.81Å; L455-Y465 HydrophobicContact CD2-CD2 3.84Å; L455-Y465 HydrophobicContact CD2-CE1 3.85Å; L455-Y465 HydrophobicContact CD2-CE2 3.92Å; L455-Y465 HydrophobicContact CD2-CG 3.81Å; L458-Y465 HydrophobicContact CB-CD1 4.26Å; L458-Y465 HydrophobicContact CD1-CD1 4.37Å; R459-Y465 HydrophobicContact CG-CE1 4.01Å; R459-Y465 PolarHBondContact NE-OH 3.23Å; R459-Y465 PolarHBondContact NH2-OH 3.41Å; Y465-I468 HydrophobicContact CD2-CG2 4.19Å
466	F	92.2	Very high	88.1	Confident	42 Å²	42	56.7 Å²	56.7	18%	0.184	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	-20.8	-176.4	84.3	-79.6	0	0	0	113.2	S437 G440 V441 Y442 K480 M484	S437-F466 VanDerWaalsContact O-CA 3.29Å; S437-F466 WeakPolarHBondContact O-CA 3.45Å; S437-F466 VanDerWaalsContact O-CB 3.28Å; S437-F466 WeakPolarHBondContact O-CB 3.38Å; G440-F466 WeakPolarHBondContact O-CD1 3.47Å; V441-F466 WeakPolarHBondContact O-CD1 3Å; V441-F466 PolarHBondContact O-N 2.86Å; V441-F466 VanDerWaalsContact O-N 3.09Å; Y442-F466 AromaticContact CD2-CE1 3.87Å; Y442-F466 HydrophobicContact CD2-CE1 3.87Å; Y442-F466 HydrophobicContact CD2-CE2 4.1Å; Y442-F466 AromaticContact CD2-CZ 3.56Å; Y442-F466 HydrophobicContact CD2-CZ 3.56Å; Y442-F466 HydrophobicContact CE2-CZ 4.48Å; Y442-F466 HydrophobicContact CG-CE1 4.33Å; Y442-F466 HydrophobicContact CG-CZ 4.33Å; F466-K480 HydrophobicContact CE2-CB 4.25Å; F466-K480 HydrophobicContact CZ-CB 4.3Å; F466-K480 VanDerWaalsContact CZ-O 3.3Å; F466-K480 WeakPolarHBondContact CZ-O 3.25Å; F466-M484 HydrophobicContact CB-CE 4Å; F466-M484 HydrophobicContact CD1-CE 3.64Å; F466-M484 HydrophobicContact CD2-CE 4.09Å; F466-M484 HydrophobicContact CE1-CE 4.04Å; F466-M484 HydrophobicContact CE2-CE 4.49Å; F466-M484 HydrophobicContact CG-CE 3.62Å; F466-M484 HydrophobicContact CZ-CE 4.45Å
467	G	90.7	Very high	88.7	Confident	8 Å²	8	51.6 Å²	51.6	8%	0.082	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	142.4	-177	0	0	0	0	0	111.3	V443	V443-G467 PolarHBondContact N-O 3.16Å
468	I	92	Very high	89.5	Confident	17 Å²	17	49.5 Å²	49.5	9%	0.087	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	143.7	-180	65	176.1	0	0	0	109.2	L431 V434 L436 V443 L451 L455 Y465	L431-I468 HydrophobicContact CD2-CD1 4Å; L431-I468 HydrophobicContact CD2-CG1 4.15Å; V434-I468 HydrophobicContact CB-CD1 3.54Å; V434-I468 HydrophobicContact CG1-CD1 3.85Å; V434-I468 HydrophobicContact CG2-CD1 3.57Å; L436-I468 HydrophobicContact CD2-CD1 4.48Å; L436-I468 HydrophobicContact CD2-CG1 4.26Å; L436-I468 HydrophobicContact CD2-CG2 4.03Å; V443-I468 HydrophobicContact CB-CG2 4.3Å; V443-I468 WeakPolarHBondContact O-CA 3.46Å; L451-I468 HydrophobicContact CD1-CB 4.27Å; L451-I468 HydrophobicContact CD2-CB 4.37Å; L451-I468 HydrophobicContact CD2-CD1 4.33Å; L455-I468 HydrophobicContact CD1-CD1 4.37Å; L455-I468 HydrophobicContact CD1-CG2 4.26Å; L455-I468 HydrophobicContact CD2-CG2 3.76Å; Y465-I468 HydrophobicContact CD2-CG2 4.19Å
469	N	90.2	Very high	89.8	Confident	43 Å²	43	54.5 Å²	54.5	23%	0.23	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	168.3	170.9	-162.5	5.8	0	0	0	110.7	V443 Q444 A445	V443-N469 PolarHBondContact O-N 2.93Å; Q444-N469 VanDerWaalsContact OE1-CB 3.26Å; Q444-N469 PolarHBondContact OE1-O 3.1Å; A445-N469 PolarHBondContact N-O 3.35Å
470	V	86.1	Confident	90	Very high	11 Å²	11	53.9 Å²	53.9	7%	0.067	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	135.7	-177.7	-173.3	0	0	0	0	109.6	L402 A445 L448 L451	L402-V470 HydrophobicContact CD2-CB 4.48Å; L402-V470 HydrophobicContact CD2-CG1 3.89Å; A445-V470 WeakPolarHBondContact O-CA 3.44Å; A445-V470 WeakPolarHBondContact O-CG1 3.42Å; L448-V470 HydrophobicContact CB-CG2 4.32Å; L451-V470 HydrophobicContact CD2-CG2 3.8Å
471	G	85	Confident	90.5	Very high	7 Å²	7	50.3 Å²	50.3	7%	0.072	24%	0.235	C	C	.	.	S	Bend	trans	111.2	-169.2	-179	0	0	0	0	0	113.2	Q444 A445 V499	Q444-G471 WeakPolarHBondContact CG-O 3.43Å; Q444-G471 PolarHBondContact NE2-O 2.79Å; A445-G471 PolarHBondContact O-N 3.38Å; G471-V499 VanDerWaalsContact O-CG1 3.25Å; G471-V499 WeakPolarHBondContact O-CG1 3.49Å
472	P	89.6	Confident	91	Very high	40 Å²	40	47.4 Å²	47.4	26%	0.26	22%	0.224	S	C	.	.	S	Bend	trans	-63.7	157.8	-179.1	25.5	-30.5	0	0	0	112.3	Q444 H474 K500	Q444-P472 PolarHBondContact NE2-O 2.73Å; Q444-P472 VanDerWaalsContact NE2-O 3.12Å; P472-H474 PolarHBondContact O-CE1 3.12Å; P472-H474 VanDerWaalsContact O-CE1 3.23Å; P472-H474 PolarHBondContact O-ND1 2.86Å; P472-K500 WeakPolarHBondContact CA-O 3.46Å; P472-K500 VanDerWaalsContact CB-O 3.25Å; P472-K500 WeakPolarHBondContact CB-O 3.31Å
473	V	92.8	Very high	91.2	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.208	C	C	.	.	B	Isolated β-bridge	trans	-81.7	121.6	177.3	-178.3	0	0	0	0	109.3	Q444 D477 V478 I494 A496 V499 K500 I501 E502 A505	Q444-V473 HydrophobicContact CB-CG2 4.06Å; Q444-V473 HydrophobicContact CG-CG2 3.88Å; V473-D477 HydrophobicContact CG1-CB 4.3Å; V473-V478 HydrophobicContact CG1-CG2 4.27Å; V473-I494 HydrophobicContact CG1-CD1 4.25Å; V473-I494 HydrophobicContact CG1-CG2 4.48Å; V473-I494 HydrophobicContact CG2-CG2 4.32Å; V473-A496 HydrophobicContact CG2-CB 4.03Å; V473-V499 HydrophobicContact CG2-CG2 4.19Å; V473-K500 PolarHBondContact N-O 2.68Å; V473-I501 HydrophobicContact CB-CG1 4.39Å; V473-I501 HydrophobicContact CB-CG2 4.33Å; V473-I501 HydrophobicContact CG2-CG1 4.26Å; V473-E502 PolarHBondContact O-N 3.2Å; V473-E502 VanDerWaalsContact O-N 3.16Å; V473-A505 HydrophobicContact CG1-CB 4.3Å; V473-A505 WeakPolarHBondContact O-CB 3.29Å
474	H	92.2	Very high	91.4	Very high	39 Å²	39	41.2 Å²	41.2	18%	0.181	21%	0.208	C	C	.	.			trans	-107.7	168	179.2	-56.2	84.7	0	0	0	111.7	P472 R476 D477 V478 E502	P472-H474 PolarHBondContact O-CE1 3.12Å; P472-H474 VanDerWaalsContact O-CE1 3.23Å; P472-H474 PolarHBondContact O-ND1 2.86Å; H474-R476 PolarHBondContact O-N 2.75Å; H474-R476 VanDerWaalsContact O-N 3.13Å; H474-D477 PolarHBondContact N-OD2 3.26Å; H474-D477 IonicContact ND1-OD2 3.34Å; H474-D477 WeakPolarHBondContact O-CB 3.48Å; H474-D477 PolarHBondContact O-N 3.38Å; H474-V478 PolarHBondContact O-N 3.45Å; H474-E502 IonicContact CD2-OE1 2.93Å; H474-E502 IonicContact CD2-OE2 3.67Å; H474-E502 PolarHBondContact CD2-OE2 2.88Å; H474-E502 IonicContact CG-OE2 2.99Å; H474-E502 IonicContact NE2-OE1 3.42Å
475	K	92.9	Very high	91.2	Very high	93 Å²	93	41.5 Å²	41.5	40%	0.404	21%	0.207	S	C	.	.	H	α-helix	trans	-52.2	-37	174.6	-66.1	-168.5	-170.6	179.4	0	113.4	D477 V478 M479 D504 L508	K475-D477 PolarHBondContact O-N 3.05Å; K475-V478 PolarHBondContact O-N 3.42Å; K475-M479 VanDerWaalsContact O-CG 3.3Å; K475-M479 WeakPolarHBondContact O-CG 3.07Å; K475-M479 PolarHBondContact O-N 3.4Å; K475-D504 HydrophobicContact CD-CB 4.37Å; K475-D504 WeakPolarHBondContact CE-O 3.45Å; K475-D504 WeakPolarHBondContact CE-OD2 3.3Å; K475-D504 HydrophobicContact CG-CB 4.24Å; K475-D504 IonicContact NZ-OD2 2.67Å; K475-D504 PolarHBondContact NZ-OD2 2.87Å; K475-L508 HydrophobicContact CB-CD2 4Å; K475-L508 HydrophobicContact CG-CD2 4.28Å
476	R	92.1	Very high	90.7	Very high	203 Å²	203	49.8 Å²	49.8	77%	0.766	25%	0.246	S	C	*	.	H	α-helix	trans	-63.6	-32.3	-179.5	-63	-179.9	-175.1	173.2	2.2	112.2	H474 K480	H474-R476 PolarHBondContact O-N 2.75Å; H474-R476 VanDerWaalsContact O-N 3.13Å; R476-K480 WeakPolarHBondContact O-CG 3.35Å; R476-K480 PolarHBondContact O-N 3.24Å
477	D	93.1	Very high	90.2	Very high	4 Å²	4	54.7 Å²	54.7	2%	0.021	26%	0.263	C	S	.	.	H	α-helix	trans	-74.8	-40.6	-180	-53.6	-41.2	0	0	0	109.8	Y442 V473 H474 K475 K480 A481	Y442-D477 HydrophobicContact CD1-CB 4.33Å; Y442-D477 HydrophobicContact CE1-CB 3.66Å; Y442-D477 PolarHBondContact OH-OD1 3.39Å; V473-D477 HydrophobicContact CG1-CB 4.3Å; H474-D477 PolarHBondContact N-OD2 3.26Å; H474-D477 IonicContact ND1-OD2 3.34Å; H474-D477 WeakPolarHBondContact O-CB 3.48Å; H474-D477 PolarHBondContact O-N 3.38Å; K475-D477 PolarHBondContact O-N 3.05Å; D477-K480 WeakPolarHBondContact O-CB 3.31Å; D477-K480 PolarHBondContact O-N 2.95Å; D477-A481 PolarHBondContact O-N 3Å
478	V	94.5	Very high	89.7	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-61.6	-43.6	172.5	-177.3	0	0	0	0	112	V473 H474 K475 K480 A481 S482 I494 A505 L508 A509 L512 V514 I516	V473-V478 HydrophobicContact CG1-CG2 4.27Å; H474-V478 PolarHBondContact O-N 3.45Å; K475-V478 PolarHBondContact O-N 3.42Å; V478-K480 VanDerWaalsContact C-N 3.27Å; V478-K480 PolarHBondContact O-N 3.43Å; V478-A481 PolarHBondContact O-N 3.15Å; V478-A481 VanDerWaalsContact O-N 3.15Å; V478-S482 PolarHBondContact O-N 2.82Å; V478-I494 HydrophobicContact CB-CD1 4.38Å; V478-I494 HydrophobicContact CG2-CD1 3.84Å; V478-A505 HydrophobicContact CG2-CB 3.95Å; V478-L508 HydrophobicContact CB-CD2 4.2Å; V478-L508 HydrophobicContact CG1-CB 4.34Å; V478-L508 HydrophobicContact CG1-CD2 4.15Å; V478-L508 HydrophobicContact CG1-CG 4.01Å; V478-A509 HydrophobicContact CG1-CB 3.83Å; V478-A509 HydrophobicContact CG2-CB 4.3Å; V478-L512 HydrophobicContact CG1-CD1 4.47Å; V478-V514 HydrophobicContact CG1-CB 4.42Å; V478-V514 HydrophobicContact CG1-CG2 4.44Å; V478-I516 HydrophobicContact CG2-CD1 4.5Å
479	M	92.7	Very high	89.1	Confident	110 Å²	110	58 Å²	58	54%	0.542	28%	0.283	S	S	.	.	H	α-helix	trans	-61.9	-32.7	175.5	-71.7	-70.5	-70.3	0	0	113.1	K475 S482 L508 L512	K475-M479 VanDerWaalsContact O-CG 3.3Å; K475-M479 WeakPolarHBondContact O-CG 3.07Å; K475-M479 PolarHBondContact O-N 3.4Å; M479-S482 PolarHBondContact O-OG 3.41Å; M479-L508 HydrophobicContact CG-CD2 3.99Å; M479-L508 HydrophobicContact SD-CD2 4.12Å; M479-L512 HydrophobicContact SD-CD1 4.33Å
480	K	91.6	Very high	88.7	Confident	102 Å²	102	57.8 Å²	57.8	44%	0.443	28%	0.281	S	S	.	.	H	α-helix	trans	-71.7	-42	174.2	-71.4	170.5	-173.9	171.5	0	110.8	Y442 F466 R476 D477 V478 S482 A483	Y442-K480 HydrophobicContact CD2-CB 4.4Å; Y442-K480 HydrophobicContact CE2-CB 4.15Å; Y442-K480 HydrophobicContact CE2-CD 3.88Å; F466-K480 HydrophobicContact CE2-CB 4.25Å; F466-K480 HydrophobicContact CZ-CB 4.3Å; F466-K480 VanDerWaalsContact CZ-O 3.3Å; F466-K480 WeakPolarHBondContact CZ-O 3.25Å; R476-K480 WeakPolarHBondContact O-CG 3.35Å; R476-K480 PolarHBondContact O-N 3.24Å; D477-K480 WeakPolarHBondContact O-CB 3.31Å; D477-K480 PolarHBondContact O-N 2.95Å; V478-K480 VanDerWaalsContact C-N 3.27Å; V478-K480 PolarHBondContact O-N 3.43Å; K480-S482 VanDerWaalsContact C-N 3.34Å; K480-A483 PolarHBondContact O-N 3.28Å
481	A	92.9	Very high	88.6	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-66.9	-34.1	178.2	0	0	0	0	0	112.5	D477 V478 A483 M484 I494 V514	D477-A481 PolarHBondContact O-N 3Å; V478-A481 PolarHBondContact O-N 3.15Å; V478-A481 VanDerWaalsContact O-N 3.15Å; A481-A483 VanDerWaalsContact C-N 3.29Å; A481-A483 PolarHBondContact O-N 3.09Å; A481-M484 VanDerWaalsContact O-CB 3.25Å; A481-M484 WeakPolarHBondContact O-CB 3.45Å; A481-M484 PolarHBondContact O-N 3.04Å; A481-I494 HydrophobicContact CB-CD1 3.94Å; A481-I494 HydrophobicContact CB-CG1 3.69Å; A481-V514 HydrophobicContact CB-CG1 3.73Å
482	S	92.6	Very high	88.9	Confident	22 Å²	22	58.1 Å²	58.1	15%	0.154	28%	0.28	C	S	.	.	H	α-helix	trans	-65.3	-31.2	178	67.9	0	0	0	0	112.9	V478 M479 K480 M484 L485	V478-S482 PolarHBondContact O-N 2.82Å; M479-S482 PolarHBondContact O-OG 3.41Å; K480-S482 VanDerWaalsContact C-N 3.34Å; S482-M484 PolarHBondContact O-N 3.4Å; S482-M484 VanDerWaalsContact O-N 3.07Å; S482-L485 VanDerWaalsContact O-CB 3.25Å; S482-L485 WeakPolarHBondContact O-CB 3.47Å; S482-L485 WeakPolarHBondContact O-CG 3.4Å; S482-L485 PolarHBondContact O-N 3.2Å
483	A	90.8	Very high	89.1	Confident	60 Å²	60	56.2 Å²	56.2	50%	0.496	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-18.6	172.9	0	0	0	0	0	113.2	K480 A481	K480-A483 PolarHBondContact O-N 3.28Å; A481-A483 VanDerWaalsContact C-N 3.29Å; A481-A483 PolarHBondContact O-N 3.09Å
484	M	90.7	Very high	89.2	Confident	4 Å²	4	56.2 Å²	56.2	2%	0.02	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-21	174.6	-160.4	59.6	61.9	0	0	112.7	R439 F466 A481 S482 E486 R487 D488 L491 A492	R439-M484 HydrophobicContact CB-SD 4.2Å; R439-M484 HydrophobicContact CG-SD 4.37Å; F466-M484 HydrophobicContact CB-CE 4Å; F466-M484 HydrophobicContact CD1-CE 3.64Å; F466-M484 HydrophobicContact CD2-CE 4.09Å; F466-M484 HydrophobicContact CE1-CE 4.04Å; F466-M484 HydrophobicContact CE2-CE 4.49Å; F466-M484 HydrophobicContact CG-CE 3.62Å; F466-M484 HydrophobicContact CZ-CE 4.45Å; A481-M484 VanDerWaalsContact O-CB 3.25Å; A481-M484 WeakPolarHBondContact O-CB 3.45Å; A481-M484 PolarHBondContact O-N 3.04Å; S482-M484 PolarHBondContact O-N 3.4Å; S482-M484 VanDerWaalsContact O-N 3.07Å; M484-E486 VanDerWaalsContact C-N 3.26Å; M484-E486 PolarHBondContact O-N 3.06Å; M484-R487 PolarHBondContact O-N 3.09Å; M484-R487 HydrophobicContact SD-CB 4.05Å; M484-D488 CarbonylContact O-C 3.4Å; M484-D488 PolarHBondContact O-N 3.2Å; M484-L491 HydrophobicContact CG-CB 3.81Å; M484-L491 HydrophobicContact SD-CB 4.47Å; M484-A492 HydrophobicContact CB-CB 4.15Å
485	L	87.2	Confident	89.3	Confident	54 Å²	54	54.5 Å²	54.5	28%	0.283	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-39.1	-178.6	-71.9	164.4	0	0	0	112.2	S482 R487 A492 L512 V514	S482-L485 VanDerWaalsContact O-CB 3.25Å; S482-L485 WeakPolarHBondContact O-CB 3.47Å; S482-L485 WeakPolarHBondContact O-CG 3.4Å; S482-L485 PolarHBondContact O-N 3.2Å; L485-R487 VanDerWaalsContact C-N 3.33Å; L485-A492 HydrophobicContact CB-CB 4.32Å; L485-A492 HydrophobicContact CD2-CB 3.33Å; L485-A492 HydrophobicContact CG-CB 3.61Å; L485-L512 WeakPolarHBondContact CD1-O 3.36Å; L485-V514 HydrophobicContact CD1-CG2 3.91Å; L485-V514 HydrophobicContact CG-CG2 4.43Å
486	E	83.2	Confident	89.3	Confident	187 Å²	187	50 Å²	50	87%	0.874	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-28.6	178.4	-64.2	-177.5	173.2	0	0	112.8	M484	M484-E486 VanDerWaalsContact C-N 3.26Å; M484-E486 PolarHBondContact O-N 3.06Å
487	R	81.2	Confident	89.1	Confident	144 Å²	144	40.5 Å²	40.5	54%	0.543	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-50.8	-175.7	-64.5	-178.2	177	-160.6	-4.7	111.7	E438 M484 L485	E438-R487 PolarHBondContact O-NH1 2.69Å; E438-R487 VanDerWaalsContact O-NH1 3.13Å; M484-R487 PolarHBondContact O-N 3.09Å; M484-R487 HydrophobicContact SD-CB 4.05Å; L485-R487 VanDerWaalsContact C-N 3.33Å
488	D	79.3	Confident	88.5	Confident	43 Å²	43	43.9 Å²	43.9	23%	0.23	22%	0.223	C	C	.	.			trans	-158	102.6	-177.6	-169.9	-21.6	0	0	0	109.8	M484 H490 L491 A492	M484-D488 CarbonylContact O-C 3.4Å; M484-D488 PolarHBondContact O-N 3.2Å; D488-H490 PolarHBondContact O-N 3.41Å; D488-H490 VanDerWaalsContact O-N 3.14Å; D488-H490 VanDerWaalsContact OD1-CB 3.22Å; D488-H490 WeakPolarHBondContact OD1-CB 3.27Å; D488-H490 IonicContact OD1-CD2 3.56Å; D488-H490 PolarHBondContact OD1-CD2 3.01Å; D488-H490 IonicContact OD1-CG 2.82Å; D488-H490 PolarHBondContact OD1-N 3.24Å; D488-L491 HydrophobicContact CB-CB 4.23Å; D488-L491 HydrophobicContact CB-CD1 4.02Å; D488-L491 HydrophobicContact CB-CG 4.19Å; D488-L491 PolarHBondContact O-N 3.3Å; D488-L491 WeakPolarHBondContact OD2-CD1 3.39Å; D488-A492 PolarHBondContact O-N 3Å
489	S	80.5	Confident	88.1	Confident	51 Å²	51	44.2 Å²	44.2	36%	0.357	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-20.9	179.9	62	0	0	0	0	113.7	L491	S489-L491 VanDerWaalsContact C-N 3.3Å
490	H	80.8	Confident	87.9	Confident	40 Å²	40	47.1 Å²	47.1	19%	0.185	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-28.1	175.8	-52.9	-73.5	0	0	0	112.2	D488 L536 K540	D488-H490 PolarHBondContact O-N 3.41Å; D488-H490 VanDerWaalsContact O-N 3.14Å; D488-H490 VanDerWaalsContact OD1-CB 3.22Å; D488-H490 WeakPolarHBondContact OD1-CB 3.27Å; D488-H490 IonicContact OD1-CD2 3.56Å; D488-H490 PolarHBondContact OD1-CD2 3.01Å; D488-H490 IonicContact OD1-CG 2.82Å; D488-H490 PolarHBondContact OD1-N 3.24Å; H490-L536 HydrophobicContact CB-CD1 4.42Å; H490-L536 WeakPolarHBondContact ND1-CD1 3.48Å; H490-K540 VanDerWaalsContact CE1-CE 3.46Å; H490-K540 WeakPolarHBondContact CE1-CE 3.38Å; H490-K540 WeakPolarHBondContact NE2-CE 3.28Å; H490-K540 PolarHBondContact NE2-NZ 3.49Å
491	L	85.3	Confident	87.9	Confident	23 Å²	23	44 Å²	44	12%	0.12	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-7.9	-176.1	-62.4	177.8	0	0	0	112.9	R439 G440 V441 P464 M484 D488 S489 V493	R439-L491 HydrophobicContact CB-CD1 4.1Å; G440-L491 VanDerWaalsContact O-O 3.1Å; V441-L491 HydrophobicContact CG1-CD2 4.36Å; P464-L491 HydrophobicContact CG-CD1 4.42Å; P464-L491 HydrophobicContact CG-CD2 4.47Å; M484-L491 HydrophobicContact CG-CB 3.81Å; M484-L491 HydrophobicContact SD-CB 4.47Å; D488-L491 HydrophobicContact CB-CB 4.23Å; D488-L491 HydrophobicContact CB-CD1 4.02Å; D488-L491 HydrophobicContact CB-CG 4.19Å; D488-L491 PolarHBondContact O-N 3.3Å; D488-L491 WeakPolarHBondContact OD2-CD1 3.39Å; S489-L491 VanDerWaalsContact C-N 3.3Å; L491-V493 PolarHBondContact O-N 3.48Å
492	A	90.4	Very high	87.9	Confident	1 Å²	1	47.8 Å²	47.8	1%	0.008	24%	0.24	C	C	.	.			trans	-73.1	63.1	176	0	0	0	0	0	112.6	M484 L485 D488 R515	M484-A492 HydrophobicContact CB-CB 4.15Å; L485-A492 HydrophobicContact CB-CB 4.32Å; L485-A492 HydrophobicContact CD2-CB 3.33Å; L485-A492 HydrophobicContact CG-CB 3.61Å; D488-A492 PolarHBondContact O-N 3Å; A492-R515 PolarHBondContact O-N 2.95Å
493	V	93.6	Very high	88	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	139.8	-170.2	175.3	0	0	0	0	110.2	V441 Y442 L491 L495 R515 F517 F529 Y532	V441-V493 HydrophobicContact CG1-CB 4.33Å; Y442-V493 PolarHBondContact N-O 2.82Å; L491-V493 PolarHBondContact O-N 3.48Å; V493-L495 HydrophobicContact CG1-CD2 3.92Å; V493-L495 HydrophobicContact CG1-CG 4.45Å; V493-R515 CarbonylContact C-O 3.5Å; V493-R515 VanDerWaalsContact CA-O 3.31Å; V493-R515 WeakPolarHBondContact CA-O 3.3Å; V493-R515 HydrophobicContact CG2-CB 4.35Å; V493-F517 HydrophobicContact CB-CE2 4.42Å; V493-F517 HydrophobicContact CG1-CD2 3.26Å; V493-F517 HydrophobicContact CG1-CE2 3.34Å; V493-F517 HydrophobicContact CG2-CE2 4.19Å; V493-F529 HydrophobicContact CB-CE2 4.18Å; V493-F529 HydrophobicContact CG1-CD2 4Å; V493-F529 HydrophobicContact CG1-CE2 4.07Å; V493-F529 HydrophobicContact CG2-CE2 4.12Å; V493-Y532 HydrophobicContact CG2-CD1 4.32Å; V493-Y532 HydrophobicContact CG2-CE1 3.74Å
494	I	95.5	Very high	88.1	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	123.5	168.3	-62.2	171.3	0	0	0	109.2	Y442 V473 V478 A481 V514 R515 I516 F517	Y442-I494 HydrophobicContact CD1-CG1 4.38Å; Y442-I494 HydrophobicContact CD1-CG2 4.45Å; Y442-I494 CarbonylContact O-C 3.56Å; Y442-I494 WeakPolarHBondContact O-CA 2.98Å; V473-I494 HydrophobicContact CG1-CD1 4.25Å; V473-I494 HydrophobicContact CG1-CG2 4.48Å; V473-I494 HydrophobicContact CG2-CG2 4.32Å; V478-I494 HydrophobicContact CB-CD1 4.38Å; V478-I494 HydrophobicContact CG2-CD1 3.84Å; A481-I494 HydrophobicContact CB-CD1 3.94Å; A481-I494 HydrophobicContact CB-CG1 3.69Å; I494-V514 HydrophobicContact CD1-CG1 4.17Å; I494-V514 HydrophobicContact CG1-CG1 4.19Å; I494-R515 PolarHBondContact N-O 3.08Å; I494-I516 HydrophobicContact CB-CG1 4.23Å; I494-I516 HydrophobicContact CB-CG2 4.21Å; I494-I516 HydrophobicContact CD1-CD1 4.46Å; I494-I516 HydrophobicContact CD1-CG1 4.25Å; I494-I516 HydrophobicContact CG2-CG2 4.21Å; I494-F517 PolarHBondContact O-N 3.16Å
495	L	94.5	Very high	88.3	Confident	3 Å²	3	58 Å²	58	2%	0.016	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	103.7	172.3	-61.3	-175.8	0	0	0	108.9	V441 Y442 Q444 L458 V493 F517 L525 F529	V441-L495 HydrophobicContact CB-CD1 4.33Å; V441-L495 HydrophobicContact CB-CG 4.44Å; V441-L495 HydrophobicContact CG2-CD1 3.82Å; V441-L495 HydrophobicContact CG2-CG 4.4Å; Y442-L495 PolarHBondContact O-N 2.96Å; Q444-L495 PolarHBondContact N-O 2.93Å; Q444-L495 VanDerWaalsContact O-O 3.14Å; L458-L495 HydrophobicContact CD1-CD1 4.12Å; L458-L495 HydrophobicContact CD2-CD1 3.77Å; V493-L495 HydrophobicContact CG1-CD2 3.92Å; V493-L495 HydrophobicContact CG1-CG 4.45Å; L495-F517 HydrophobicContact CD2-CB 4.11Å; L495-F517 HydrophobicContact CD2-CD2 3.95Å; L495-F517 HydrophobicContact CD2-CG 4.36Å; L495-L525 HydrophobicContact CB-CD2 3.94Å; L495-L525 HydrophobicContact CB-CG 4.49Å; L495-L525 HydrophobicContact CD2-CG 4.31Å; L495-F529 HydrophobicContact CD2-CB 4.16Å; L495-F529 HydrophobicContact CD2-CD2 4Å; L495-F529 HydrophobicContact CD2-CG 4.19Å
496	A	93.4	Very high	88.6	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	102.4	-175.9	0	0	0	0	0	110.9	V473 V499 I516 F517 Q518 A519	V473-A496 HydrophobicContact CG2-CB 4.03Å; A496-V499 HydrophobicContact CB-CG2 3.57Å; A496-I516 HydrophobicContact CB-CG2 4.23Å; A496-F517 WeakPolarHBondContact CA-O 3.37Å; A496-F517 WeakPolarHBondContact CB-O 3.47Å; A496-F517 PolarHBondContact N-O 2.89Å; A496-Q518 WeakPolarHBondContact O-CA 3.35Å; A496-A519 PolarHBondContact O-N 2.97Å
497	F	86.4	Confident	89.2	Confident	3 Å²	3	55.2 Å²	55.2	1%	0.013	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	117.3	-179.1	178.9	-100	0	0	0	112.2	Q444 A445 S446 S450 L454 V499 A519 D520 I522 L525	Q444-F497 PolarHBondContact O-N 2.9Å; A445-F497 WeakPolarHBondContact CA-O 3.49Å; A445-F497 HydrophobicContact CB-CB 4.49Å; A445-F497 HydrophobicContact CB-CD1 4.5Å; S446-F497 PolarHBondContact N-O 2.72Å; S450-F497 VanDerWaalsContact CB-CD1 3.47Å; L454-F497 HydrophobicContact CD2-CB 3.89Å; F497-V499 WeakPolarHBondContact O-CG1 3.36Å; F497-V499 PolarHBondContact O-N 2.87Å; F497-V499 VanDerWaalsContact O-N 3.14Å; F497-A519 WeakPolarHBondContact CA-O 3.36Å; F497-A519 WeakPolarHBondContact CD2-O 3.28Å; F497-D520 VanDerWaalsContact CE2-C 3.45Å; F497-D520 WeakPolarHBondContact CE2-O 3.39Å; F497-D520 WeakPolarHBondContact CZ-O 3.31Å; F497-I522 HydrophobicContact CD2-CG1 3.75Å; F497-I522 HydrophobicContact CE1-CG1 4.36Å; F497-I522 HydrophobicContact CE2-CB 4.28Å; F497-I522 HydrophobicContact CE2-CD1 4.41Å; F497-I522 HydrophobicContact CE2-CG1 3.34Å; F497-I522 HydrophobicContact CG-CG1 4.41Å; F497-I522 HydrophobicContact CZ-CD1 4.3Å; F497-I522 HydrophobicContact CZ-CG1 3.67Å; F497-L525 HydrophobicContact CB-CD2 4.21Å
498	D	80.3	Confident	89.9	Confident	75 Å²	75	49.9 Å²	49.9	40%	0.401	24%	0.239	S	C	.	.	S	Bend	trans	55.5	28	177.1	-175.9	44	0	0	0	113.5	S446 A519	S446-D498 VanDerWaalsContact CB-O 3.26Å; S446-D498 WeakPolarHBondContact CB-O 3.29Å; S446-D498 WeakPolarHBondContact CB-OD2 3.42Å; S446-D498 PolarHBondContact OG-OD2 3.29Å; D498-A519 PolarHBondContact N-O 2.85Å
499	V	86.5	Confident	90.6	Very high	7 Å²	7	47.8 Å²	47.8	4%	0.042	23%	0.228	C	C	.	.			trans	-120.2	147.7	-178.2	-68.2	0	0	0	0	112	Q444 S446 G471 V473 A496 F497 Q518	Q444-V499 HydrophobicContact CB-CG2 4.22Å; Q444-V499 HydrophobicContact CG-CG1 4.42Å; Q444-V499 HydrophobicContact CG-CG2 3.96Å; S446-V499 VanDerWaalsContact CA-CG1 3.49Å; G471-V499 VanDerWaalsContact O-CG1 3.25Å; G471-V499 WeakPolarHBondContact O-CG1 3.49Å; V473-V499 HydrophobicContact CG2-CG2 4.19Å; A496-V499 HydrophobicContact CB-CG2 3.57Å; F497-V499 WeakPolarHBondContact O-CG1 3.36Å; F497-V499 PolarHBondContact O-N 2.87Å; F497-V499 VanDerWaalsContact O-N 3.14Å; V499-Q518 PolarHBondContact O-NE2 3.5Å
500	K	88.4	Confident	91.2	Very high	170 Å²	170	50.3 Å²	50.3	74%	0.739	24%	0.237	S	C	*	.	P	Polyproline II helix	trans	-77.5	142	171.2	-64.5	-179.9	-178.3	175.2	0	110	P472 V473	P472-K500 WeakPolarHBondContact CA-O 3.46Å; P472-K500 VanDerWaalsContact CB-O 3.25Å; P472-K500 WeakPolarHBondContact CB-O 3.31Å; V473-K500 PolarHBondContact N-O 2.68Å
501	I	93.2	Very high	91.8	Very high	36 Å²	36	55.9 Å²	55.9	19%	0.185	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-98	126.2	172	-56.3	163.9	0	0	0	107.4	V473 A505 Q506 I516 Q518	V473-I501 HydrophobicContact CB-CG1 4.39Å; V473-I501 HydrophobicContact CB-CG2 4.33Å; V473-I501 HydrophobicContact CG2-CG1 4.26Å; I501-A505 HydrophobicContact CG2-CB 4.29Å; I501-Q506 HydrophobicContact CG2-CB 4.06Å; I501-I516 HydrophobicContact CD1-CB 4.41Å; I501-I516 HydrophobicContact CD1-CG2 3.57Å; I501-I516 HydrophobicContact CG1-CG2 4.29Å; I501-I516 HydrophobicContact CG2-CD1 4.11Å; I501-Q518 HydrophobicContact CD1-CB 4.09Å; I501-Q518 HydrophobicContact CD1-CG 4.41Å
502	E	92.7	Very high	92.1	Very high	81 Å²	81	58 Å²	58	38%	0.379	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-65.7	140.9	172.9	-68.3	-164.6	143.1	0	0	110.3	V473 H474 D504 A505 Q506	V473-E502 PolarHBondContact O-N 3.2Å; V473-E502 VanDerWaalsContact O-N 3.16Å; H474-E502 IonicContact CD2-OE1 2.93Å; H474-E502 IonicContact CD2-OE2 3.67Å; H474-E502 PolarHBondContact CD2-OE2 2.88Å; H474-E502 IonicContact CG-OE2 2.99Å; H474-E502 IonicContact NE2-OE1 3.42Å; E502-D504 PolarHBondContact O-N 3.19Å; E502-D504 VanDerWaalsContact O-N 3.15Å; E502-A505 HydrophobicContact CB-CB 4.23Å; E502-A505 WeakPolarHBondContact O-CA 3.43Å; E502-A505 WeakPolarHBondContact O-CB 3.23Å; E502-A505 PolarHBondContact O-N 3.04Å; E502-Q506 PolarHBondContact O-N 2.68Å
503	R	93.3	Very high	92.1	Very high	218 Å²	218	60.2 Å²	60.2	82%	0.823	30%	0.298	S	S	*	.	H	α-helix	trans	-52.2	-42.6	179.2	-67	-177.7	177.9	174.4	-0.8	111.8	A505 Q506 L507	R503-A505 VanDerWaalsContact C-N 3.3Å; R503-A505 PolarHBondContact O-N 3.21Å; R503-Q506 PolarHBondContact O-N 2.76Å; R503-L507 WeakPolarHBondContact O-CG 3.47Å; R503-L507 PolarHBondContact O-N 3.14Å
504	D	94.1	Very high	92	Very high	82 Å²	82	60.5 Å²	60.5	44%	0.439	30%	0.3	S	S	.	.	H	α-helix	trans	-62.5	-33.1	178.3	-100.7	35.5	0	0	0	113.4	K475 E502	K475-D504 HydrophobicContact CD-CB 4.37Å; K475-D504 WeakPolarHBondContact CE-O 3.45Å; K475-D504 WeakPolarHBondContact CE-OD2 3.3Å; K475-D504 HydrophobicContact CG-CB 4.24Å; K475-D504 IonicContact NZ-OD2 2.67Å; K475-D504 PolarHBondContact NZ-OD2 2.87Å; E502-D504 PolarHBondContact O-N 3.19Å; E502-D504 VanDerWaalsContact O-N 3.15Å
505	A	93.9	Very high	91.9	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-77.6	-40.8	174	0	0	0	0	0	111.3	V473 V478 I501 E502 R503 L508 A509	V473-A505 HydrophobicContact CG1-CB 4.3Å; V473-A505 WeakPolarHBondContact O-CB 3.29Å; V478-A505 HydrophobicContact CG2-CB 3.95Å; I501-A505 HydrophobicContact CG2-CB 4.29Å; E502-A505 HydrophobicContact CB-CB 4.23Å; E502-A505 WeakPolarHBondContact O-CA 3.43Å; E502-A505 WeakPolarHBondContact O-CB 3.23Å; E502-A505 PolarHBondContact O-N 3.04Å; R503-A505 VanDerWaalsContact C-N 3.3Å; R503-A505 PolarHBondContact O-N 3.21Å; A505-L508 PolarHBondContact O-N 3.06Å; A505-A509 WeakPolarHBondContact O-CB 3.39Å; A505-A509 PolarHBondContact O-N 2.98Å
506	Q	94.3	Very high	91.9	Very high	65 Å²	65	68.1 Å²	68.1	30%	0.304	33%	0.33	S	S	.	.	H	α-helix	trans	-60.7	-48.6	177.3	-176.1	60	47	0	0	111.7	I501 E502 R503 L508 A509 D510	I501-Q506 HydrophobicContact CG2-CB 4.06Å; E502-Q506 PolarHBondContact O-N 2.68Å; R503-Q506 PolarHBondContact O-N 2.76Å; Q506-L508 VanDerWaalsContact C-N 3.31Å; Q506-L508 PolarHBondContact O-N 3.06Å; Q506-A509 PolarHBondContact O-N 3.26Å; Q506-A509 VanDerWaalsContact O-N 3.14Å; Q506-D510 PolarHBondContact NE2-OD1 3.46Å; Q506-D510 PolarHBondContact NE2-OD2 2.7Å; Q506-D510 PolarHBondContact O-N 2.91Å
507	L	95.7	Very high	91.9	Very high	118 Å²	118	69.1 Å²	69.1	62%	0.618	33%	0.334	S	S	*	.	H	α-helix	trans	-57.9	-43.5	178.2	-70.7	171.8	0	0	0	112	R503 D510 E511	R503-L507 WeakPolarHBondContact O-CG 3.47Å; R503-L507 PolarHBondContact O-N 3.14Å; L507-D510 PolarHBondContact O-N 3.16Å; L507-E511 WeakPolarHBondContact O-CB 3.43Å; L507-E511 PolarHBondContact O-N 3.36Å
508	L	94.8	Very high	92.2	Very high	31 Å²	31	74.2 Å²	74.2	16%	0.162	36%	0.358	C	S	.	.	H	α-helix	trans	-67.3	-36.8	178.1	-176.1	64.5	0	0	0	112.1	K475 V478 M479 A505 Q506 E511 L512	K475-L508 HydrophobicContact CB-CD2 4Å; K475-L508 HydrophobicContact CG-CD2 4.28Å; V478-L508 HydrophobicContact CB-CD2 4.2Å; V478-L508 HydrophobicContact CG1-CB 4.34Å; V478-L508 HydrophobicContact CG1-CD2 4.15Å; V478-L508 HydrophobicContact CG1-CG 4.01Å; M479-L508 HydrophobicContact CG-CD2 3.99Å; M479-L508 HydrophobicContact SD-CD2 4.12Å; A505-L508 PolarHBondContact O-N 3.06Å; Q506-L508 VanDerWaalsContact C-N 3.31Å; Q506-L508 PolarHBondContact O-N 3.06Å; L508-E511 PolarHBondContact O-N 2.99Å; L508-L512 HydrophobicContact CD1-CD1 3.8Å; L508-L512 HydrophobicContact CD1-CG 4.07Å; L508-L512 HydrophobicContact CD2-CD1 4.48Å; L508-L512 HydrophobicContact CG-CD1 3.84Å; L508-L512 HydrophobicContact CG-CG 4.39Å; L508-L512 WeakPolarHBondContact O-CB 3.06Å; L508-L512 WeakPolarHBondContact O-CG 3.38Å; L508-L512 PolarHBondContact O-N 3.44Å
509	A	94.2	Very high	92.4	Very high	0 Å²	0	71.4 Å²	71.4	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-66.7	-41	178.3	0	0	0	0	0	111.5	V478 A505 Q506 G513 V514 I516	V478-A509 HydrophobicContact CG1-CB 3.83Å; V478-A509 HydrophobicContact CG2-CB 4.3Å; A505-A509 WeakPolarHBondContact O-CB 3.39Å; A505-A509 PolarHBondContact O-N 2.98Å; Q506-A509 PolarHBondContact O-N 3.26Å; Q506-A509 VanDerWaalsContact O-N 3.14Å; A509-G513 PolarHBondContact O-N 3.15Å; A509-V514 HydrophobicContact CB-CB 4.36Å; A509-V514 PolarHBondContact O-N 3.41Å; A509-I516 HydrophobicContact CB-CD1 3.57Å; A509-I516 HydrophobicContact CB-CG1 3.92Å
510	D	93.4	Very high	91.8	Very high	103 Å²	103	76.3 Å²	76.3	55%	0.551	37%	0.371	S	S	*	.	H	α-helix	trans	-66.5	-37.7	175.8	-65.8	-32.8	0	0	0	111.9	Q506 L507	Q506-D510 PolarHBondContact NE2-OD1 3.46Å; Q506-D510 PolarHBondContact NE2-OD2 2.7Å; Q506-D510 PolarHBondContact O-N 2.91Å; L507-D510 PolarHBondContact O-N 3.16Å
511	E	93.9	Very high	91	Very high	158 Å²	158	72.3 Å²	72.3	74%	0.738	36%	0.357	S	S	*	.	H	α-helix	trans	-67.1	-43.6	176	-175.4	178.8	-175.5	0	0	112.6	L507 L508	L507-E511 WeakPolarHBondContact O-CB 3.43Å; L507-E511 PolarHBondContact O-N 3.36Å; L508-E511 PolarHBondContact O-N 2.99Å
512	L	92.2	Very high	89.9	Confident	66 Å²	66	71.9 Å²	71.9	35%	0.346	35%	0.354	S	S	.	.	H	α-helix	trans	-84.1	-13.3	-177.5	-64	177.3	0	0	0	113.5	V478 M479 L485 L508 V514	V478-L512 HydrophobicContact CG1-CD1 4.47Å; M479-L512 HydrophobicContact SD-CD1 4.33Å; L485-L512 WeakPolarHBondContact CD1-O 3.36Å; L508-L512 HydrophobicContact CD1-CD1 3.8Å; L508-L512 HydrophobicContact CD1-CG 4.07Å; L508-L512 HydrophobicContact CD2-CD1 4.48Å; L508-L512 HydrophobicContact CG-CD1 3.84Å; L508-L512 HydrophobicContact CG-CG 4.39Å; L508-L512 WeakPolarHBondContact O-CB 3.06Å; L508-L512 WeakPolarHBondContact O-CG 3.38Å; L508-L512 PolarHBondContact O-N 3.44Å; L512-V514 HydrophobicContact CB-CG2 4.25Å
513	G	89.2	Confident	88.9	Confident	49 Å²	49	73.6 Å²	73.6	51%	0.505	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.5	22.6	-175.3	0	0	0	0	0	114.3	A509	A509-G513 PolarHBondContact O-N 3.15Å
514	V	92.6	Very high	88.2	Confident	5 Å²	5	68.5 Å²	68.5	3%	0.03	34%	0.344	C	S	.	.			trans	-82.9	123.3	174.2	177.8	0	0	0	0	109.2	V478 A481 L485 I494 A509 L512	V478-V514 HydrophobicContact CG1-CB 4.42Å; V478-V514 HydrophobicContact CG1-CG2 4.44Å; A481-V514 HydrophobicContact CB-CG1 3.73Å; L485-V514 HydrophobicContact CD1-CG2 3.91Å; L485-V514 HydrophobicContact CG-CG2 4.43Å; I494-V514 HydrophobicContact CD1-CG1 4.17Å; I494-V514 HydrophobicContact CG1-CG1 4.19Å; A509-V514 HydrophobicContact CB-CB 4.36Å; A509-V514 PolarHBondContact O-N 3.41Å; L512-V514 HydrophobicContact CB-CG2 4.25Å
515	R	92.1	Very high	87.7	Confident	139 Å²	139	64.8 Å²	64.8	53%	0.525	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	126.6	179.7	-164.7	67.1	176.8	-180	0.6	110.9	A492 V493 I494 F517 Y532	A492-R515 PolarHBondContact O-N 2.95Å; V493-R515 CarbonylContact C-O 3.5Å; V493-R515 VanDerWaalsContact CA-O 3.31Å; V493-R515 WeakPolarHBondContact CA-O 3.3Å; V493-R515 HydrophobicContact CG2-CB 4.35Å; I494-R515 PolarHBondContact N-O 3.08Å; R515-F517 HydrophobicContact CB-CE2 4.2Å; R515-F517 HydrophobicContact CG-CD2 4.35Å; R515-F517 HydrophobicContact CG-CE1 4.35Å; R515-F517 HydrophobicContact CG-CE2 3.63Å; R515-F517 HydrophobicContact CG-CZ 3.61Å; R515-Y532 HydrophobicContact CG-CE2 4.36Å
516	I	94.5	Very high	87	Confident	24 Å²	24	66.1 Å²	66.1	12%	0.123	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	126	171.7	-49.8	-179.9	0	0	0	109	V478 I494 A496 I501 A509	V478-I516 HydrophobicContact CG2-CD1 4.5Å; I494-I516 HydrophobicContact CB-CG1 4.23Å; I494-I516 HydrophobicContact CB-CG2 4.21Å; I494-I516 HydrophobicContact CD1-CD1 4.46Å; I494-I516 HydrophobicContact CD1-CG1 4.25Å; I494-I516 HydrophobicContact CG2-CG2 4.21Å; A496-I516 HydrophobicContact CB-CG2 4.23Å; I501-I516 HydrophobicContact CD1-CB 4.41Å; I501-I516 HydrophobicContact CD1-CG2 3.57Å; I501-I516 HydrophobicContact CG1-CG2 4.29Å; I501-I516 HydrophobicContact CG2-CD1 4.11Å; A509-I516 HydrophobicContact CB-CD1 3.57Å; A509-I516 HydrophobicContact CB-CG1 3.92Å
517	F	93.6	Very high	86.4	Confident	22 Å²	22	67.4 Å²	67.4	10%	0.096	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	124.3	168.4	-63.9	-84.4	0	0	0	108.7	V493 I494 L495 A496 R515 L525 A528 F529 Y532	V493-F517 HydrophobicContact CB-CE2 4.42Å; V493-F517 HydrophobicContact CG1-CD2 3.26Å; V493-F517 HydrophobicContact CG1-CE2 3.34Å; V493-F517 HydrophobicContact CG2-CE2 4.19Å; I494-F517 PolarHBondContact O-N 3.16Å; L495-F517 HydrophobicContact CD2-CB 4.11Å; L495-F517 HydrophobicContact CD2-CD2 3.95Å; L495-F517 HydrophobicContact CD2-CG 4.36Å; A496-F517 WeakPolarHBondContact CA-O 3.37Å; A496-F517 WeakPolarHBondContact CB-O 3.47Å; A496-F517 PolarHBondContact N-O 2.89Å; R515-F517 HydrophobicContact CB-CE2 4.2Å; R515-F517 HydrophobicContact CG-CD2 4.35Å; R515-F517 HydrophobicContact CG-CE1 4.35Å; R515-F517 HydrophobicContact CG-CE2 3.63Å; R515-F517 HydrophobicContact CG-CZ 3.61Å; F517-L525 HydrophobicContact CB-CD1 3.72Å; F517-L525 VanDerWaalsContact O-CD1 3.31Å; F517-L525 WeakPolarHBondContact O-CD1 3.26Å; F517-A528 HydrophobicContact CD1-CB 3.74Å; F517-A528 HydrophobicContact CE1-CB 4.14Å; F517-F529 HydrophobicContact CD2-CD2 4.42Å; F517-F529 HydrophobicContact CE2-CD2 4.14Å; F517-Y532 HydrophobicContact CE1-CG 4.49Å; F517-Y532 HydrophobicContact CE2-CD1 4.05Å; F517-Y532 HydrophobicContact CE2-CG 4.28Å; F517-Y532 VanDerWaalsContact CZ-CB 3.5Å; F517-Y532 AromaticContact CZ-CD1 3.78Å; F517-Y532 HydrophobicContact CZ-CD1 3.78Å; F517-Y532 HydrophobicContact CZ-CD2 4.11Å; F517-Y532 AromaticContact CZ-CG 3.54Å; F517-Y532 HydrophobicContact CZ-CG 3.54Å
518	Q	92.4	Very high	86.1	Confident	110 Å²	110	63.7 Å²	63.7	51%	0.514	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	129.7	176	-171.4	-175.1	-8.6	0	0	109.4	A496 V499 I501	A496-Q518 WeakPolarHBondContact O-CA 3.35Å; V499-Q518 PolarHBondContact O-NE2 3.5Å; I501-Q518 HydrophobicContact CD1-CB 4.09Å; I501-Q518 HydrophobicContact CD1-CG 4.41Å
519	A	85.2	Confident	85.8	Confident	15 Å²	15	62.4 Å²	62.4	12%	0.124	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	151.6	170.9	0	0	0	0	0	111.4	A496 F497 D498 H524 L525	A496-A519 PolarHBondContact O-N 2.97Å; F497-A519 WeakPolarHBondContact CA-O 3.36Å; F497-A519 WeakPolarHBondContact CD2-O 3.28Å; D498-A519 PolarHBondContact N-O 2.85Å; A519-H524 HydrophobicContact CB-CB 4.17Å; A519-L525 HydrophobicContact CB-CB 3.96Å; A519-L525 HydrophobicContact CB-CD1 3.91Å
520	D	75.1	Confident	85.5	Confident	110 Å²	110	65.3 Å²	65.3	59%	0.588	33%	0.333	S	S	*	.	S	Bend	trans	-91.5	-9.1	177.1	-51.2	-28.2	0	0	0	111.8	F497	F497-D520 VanDerWaalsContact CE2-C 3.45Å; F497-D520 WeakPolarHBondContact CE2-O 3.39Å; F497-D520 WeakPolarHBondContact CZ-O 3.31Å
521	I	70.2	Confident	85.3	Confident	86 Å²	86	66.6 Å²	66.6	44%	0.441	33%	0.334	S	S	.	.	S	Bend	trans	-124.4	128.6	179.9	-59.2	174.5	0	0	0	108.7	Y523 H524 L525	I521-Y523 VanDerWaalsContact C-N 3.31Å; I521-Y523 HydrophobicContact CG2-CD2 4.14Å; I521-Y523 PolarHBondContact O-N 3.23Å; I521-H524 PolarHBondContact O-N 3Å; I521-L525 PolarHBondContact O-N 2.91Å
522	I	70.5	Confident	85.1	Confident	27 Å²	27	61.2 Å²	61.2	14%	0.138	31%	0.307	C	S	.	.	H	α-helix	trans	-58.3	-42.8	-173.2	-62.9	179.4	0	0	0	111.2	A453 L454 F457 F497 H524 L525 E526	A453-I522 HydrophobicContact CB-CD1 3.79Å; L454-I522 HydrophobicContact CD1-CG2 4.12Å; F457-I522 HydrophobicContact CB-CG2 4.42Å; F457-I522 HydrophobicContact CD1-CG2 4.4Å; F457-I522 HydrophobicContact CG-CG2 4.14Å; F497-I522 HydrophobicContact CD2-CG1 3.75Å; F497-I522 HydrophobicContact CE1-CG1 4.36Å; F497-I522 HydrophobicContact CE2-CB 4.28Å; F497-I522 HydrophobicContact CE2-CD1 4.41Å; F497-I522 HydrophobicContact CE2-CG1 3.34Å; F497-I522 HydrophobicContact CG-CG1 4.41Å; F497-I522 HydrophobicContact CZ-CD1 4.3Å; F497-I522 HydrophobicContact CZ-CG1 3.67Å; I522-H524 PolarHBondContact O-N 3.13Å; I522-L525 VanDerWaalsContact O-CB 3.29Å; I522-L525 WeakPolarHBondContact O-CB 3.42Å; I522-L525 PolarHBondContact O-N 3.18Å; I522-E526 PolarHBondContact O-N 2.85Å
523	Y	71.9	Confident	84.8	Confident	118 Å²	118	64.2 Å²	64.2	46%	0.463	31%	0.314	S	S	.	.	H	α-helix	trans	-62.8	-37.7	-179.8	-57.1	-66	0	0	0	113.3	F457 I521 L525 E526 D527	F457-Y523 HydrophobicContact CE2-CE1 4.32Å; I521-Y523 VanDerWaalsContact C-N 3.31Å; I521-Y523 HydrophobicContact CG2-CD2 4.14Å; I521-Y523 PolarHBondContact O-N 3.23Å; Y523-L525 VanDerWaalsContact C-N 3.31Å; Y523-L525 PolarHBondContact O-N 3.12Å; Y523-E526 WeakPolarHBondContact O-CB 3.37Å; Y523-E526 PolarHBondContact O-N 2.95Å; Y523-D527 WeakPolarHBondContact O-CB 3.46Å; Y523-D527 PolarHBondContact O-N 2.85Å
524	H	79.4	Confident	84.6	Confident	111 Å²	111	67.3 Å²	67.3	51%	0.514	32%	0.316	S	S	.	.	H	α-helix	trans	-69.1	-34	177	-65.3	-33	0	0	0	112.2	A519 I521 I522 E526 A528	A519-H524 HydrophobicContact CB-CB 4.17Å; I521-H524 PolarHBondContact O-N 3Å; I522-H524 PolarHBondContact O-N 3.13Å; H524-E526 VanDerWaalsContact C-N 3.34Å; H524-A528 VanDerWaalsContact O-CB 3.26Å; H524-A528 WeakPolarHBondContact O-CB 3.23Å; H524-A528 PolarHBondContact O-N 3.25Å; H524-A528 VanDerWaalsContact O-N 3.08Å
525	L	82.2	Confident	84.4	Confident	4 Å²	4	71 Å²	71	2%	0.021	33%	0.332	C	S	.	.	H	α-helix	trans	-63.6	-44.7	173.8	-162.1	71.8	0	0	0	110.7	L454 L495 F497 F517 A519 I521 I522 Y523 F529	L454-L525 HydrophobicContact CD1-CD2 4Å; L454-L525 HydrophobicContact CD2-CD2 3.95Å; L495-L525 HydrophobicContact CB-CD2 3.94Å; L495-L525 HydrophobicContact CB-CG 4.49Å; L495-L525 HydrophobicContact CD2-CG 4.31Å; F497-L525 HydrophobicContact CB-CD2 4.21Å; F517-L525 HydrophobicContact CB-CD1 3.72Å; F517-L525 VanDerWaalsContact O-CD1 3.31Å; F517-L525 WeakPolarHBondContact O-CD1 3.26Å; A519-L525 HydrophobicContact CB-CB 3.96Å; A519-L525 HydrophobicContact CB-CD1 3.91Å; I521-L525 PolarHBondContact O-N 2.91Å; I522-L525 VanDerWaalsContact O-CB 3.29Å; I522-L525 WeakPolarHBondContact O-CB 3.42Å; I522-L525 PolarHBondContact O-N 3.18Å; Y523-L525 VanDerWaalsContact C-N 3.31Å; Y523-L525 PolarHBondContact O-N 3.12Å; L525-F529 WeakPolarHBondContact O-CB 3.33Å; L525-F529 PolarHBondContact O-N 2.94Å
526	E	78.6	Confident	84.1	Confident	28 Å²	28	65.7 Å²	65.7	13%	0.131	31%	0.314	C	S	.	.	H	α-helix	trans	-61.6	-55.6	175.5	175.6	-167.5	-161	0	0	111.5	F457 Q461 I522 Y523 H524 A528 F529 L530	F457-E526 HydrophobicContact CE1-CB 3.92Å; F457-E526 HydrophobicContact CE1-CG 3.61Å; F457-E526 WeakPolarHBondContact CE1-OE1 3.38Å; F457-E526 WeakPolarHBondContact CE1-OE2 3.47Å; F457-E526 HydrophobicContact CZ-CG 4.1Å; F457-E526 WeakPolarHBondContact CZ-OE1 3.4Å; F457-E526 WeakPolarHBondContact CZ-OE2 3.47Å; Q461-E526 PolarHBondContact NE2-OE1 3.38Å; I522-E526 PolarHBondContact O-N 2.85Å; Y523-E526 WeakPolarHBondContact O-CB 3.37Å; Y523-E526 PolarHBondContact O-N 2.95Å; H524-E526 VanDerWaalsContact C-N 3.34Å; E526-A528 PolarHBondContact O-N 3.05Å; E526-F529 CarbonylContact O-C 3.56Å; E526-F529 WeakPolarHBondContact O-CA 3.25Å; E526-F529 WeakPolarHBondContact O-CB 3.22Å; E526-F529 PolarHBondContact O-N 3.36Å; E526-L530 HydrophobicContact CG-CD1 3.68Å; E526-L530 HydrophobicContact CG-CG 4.03Å; E526-L530 PolarHBondContact O-N 3.41Å
527	D	83.6	Confident	83.5	Confident	91 Å²	91	68.8 Å²	68.8	49%	0.487	33%	0.325	S	S	.	.	H	α-helix	trans	-55.3	-43.2	-177.2	-71.3	-26.2	0	0	0	110.7	Y523 K531	Y523-D527 WeakPolarHBondContact O-CB 3.46Å; Y523-D527 PolarHBondContact O-N 2.85Å; D527-K531 WeakPolarHBondContact O-CB 3.33Å; D527-K531 PolarHBondContact O-N 2.99Å
528	A	89.2	Confident	83.2	Confident	40 Å²	40	72.2 Å²	72.2	33%	0.331	34%	0.341	S	S	.	.	H	α-helix	trans	-64	-41	176.6	0	0	0	0	0	112.2	F517 H524 E526 Y532	F517-A528 HydrophobicContact CD1-CB 3.74Å; F517-A528 HydrophobicContact CE1-CB 4.14Å; H524-A528 VanDerWaalsContact O-CB 3.26Å; H524-A528 WeakPolarHBondContact O-CB 3.23Å; H524-A528 PolarHBondContact O-N 3.25Å; H524-A528 VanDerWaalsContact O-N 3.08Å; E526-A528 PolarHBondContact O-N 3.05Å; A528-Y532 WeakPolarHBondContact O-CB 3.38Å; A528-Y532 PolarHBondContact O-N 2.84Å
529	F	88.5	Confident	83	Confident	5 Å²	5	73.1 Å²	73.1	2%	0.022	34%	0.343	C	S	.	.	H	α-helix	trans	-69.8	-45	177.9	178.1	-106	0	0	0	112.7	V441 I463 V493 L495 F517 L525 E526 Y532 R533	V441-F529 HydrophobicContact CG1-CE2 3.76Å; V441-F529 HydrophobicContact CG1-CZ 3.65Å; I463-F529 HydrophobicContact CD1-CD1 3.84Å; I463-F529 HydrophobicContact CD1-CE1 3.61Å; I463-F529 HydrophobicContact CG1-CE1 4.09Å; I463-F529 HydrophobicContact CG2-CE1 3.91Å; I463-F529 HydrophobicContact CG2-CZ 4.23Å; V493-F529 HydrophobicContact CB-CE2 4.18Å; V493-F529 HydrophobicContact CG1-CD2 4Å; V493-F529 HydrophobicContact CG1-CE2 4.07Å; V493-F529 HydrophobicContact CG2-CE2 4.12Å; L495-F529 HydrophobicContact CD2-CB 4.16Å; L495-F529 HydrophobicContact CD2-CD2 4Å; L495-F529 HydrophobicContact CD2-CG 4.19Å; F517-F529 HydrophobicContact CD2-CD2 4.42Å; F517-F529 HydrophobicContact CE2-CD2 4.14Å; L525-F529 WeakPolarHBondContact O-CB 3.33Å; L525-F529 PolarHBondContact O-N 2.94Å; E526-F529 CarbonylContact O-C 3.56Å; E526-F529 WeakPolarHBondContact O-CA 3.25Å; E526-F529 WeakPolarHBondContact O-CB 3.22Å; E526-F529 PolarHBondContact O-N 3.36Å; F529-Y532 WeakPolarHBondContact O-CB 3.25Å; F529-Y532 PolarHBondContact O-N 2.99Å; F529-R533 WeakPolarHBondContact O-CB 3.43Å; F529-R533 PolarHBondContact O-N 3Å
530	L	86.9	Confident	83	Confident	60 Å²	60	74.6 Å²	74.6	31%	0.314	35%	0.347	S	S	.	.	H	α-helix	trans	-62.7	-44.6	177.7	-72.3	179.2	0	0	0	111	E526 Y532 R533 E534	E526-L530 HydrophobicContact CG-CD1 3.68Å; E526-L530 HydrophobicContact CG-CG 4.03Å; E526-L530 PolarHBondContact O-N 3.41Å; L530-Y532 PolarHBondContact O-N 2.94Å; L530-R533 PolarHBondContact O-N 3.33Å; L530-E534 PolarHBondContact O-N 3.06Å
531	K	90.2	Very high	83.5	Confident	131 Å²	131	72.7 Å²	72.7	57%	0.57	33%	0.331	S	S	*	.	H	α-helix	trans	-59.4	-45.9	174.7	-174.9	-179.7	179.3	-175.7	0	111.6	D527 R533 E534 E535	D527-K531 WeakPolarHBondContact O-CB 3.33Å; D527-K531 PolarHBondContact O-N 2.99Å; K531-R533 VanDerWaalsContact C-N 3.34Å; K531-R533 PolarHBondContact O-N 2.73Å; K531-E534 PolarHBondContact O-N 2.92Å; K531-E535 VanDerWaalsContact CE-OE1 3.23Å; K531-E535 WeakPolarHBondContact CE-OE1 3.34Å; K531-E535 WeakPolarHBondContact O-CG 3.31Å; K531-E535 PolarHBondContact O-N 2.96Å
532	Y	89.4	Confident	84.4	Confident	44 Å²	44	75.6 Å²	75.6	17%	0.173	34%	0.343	C	S	.	.	H	α-helix	trans	-60.1	-43.1	176.4	172.1	-108.7	0	0	0	112.6	V493 R515 F517 A528 F529 L530 E534 E535 L536	V493-Y532 HydrophobicContact CG2-CD1 4.32Å; V493-Y532 HydrophobicContact CG2-CE1 3.74Å; R515-Y532 HydrophobicContact CG-CE2 4.36Å; F517-Y532 HydrophobicContact CE1-CG 4.49Å; F517-Y532 HydrophobicContact CE2-CD1 4.05Å; F517-Y532 HydrophobicContact CE2-CG 4.28Å; F517-Y532 VanDerWaalsContact CZ-CB 3.5Å; F517-Y532 AromaticContact CZ-CD1 3.78Å; F517-Y532 HydrophobicContact CZ-CD1 3.78Å; F517-Y532 HydrophobicContact CZ-CD2 4.11Å; F517-Y532 AromaticContact CZ-CG 3.54Å; F517-Y532 HydrophobicContact CZ-CG 3.54Å; A528-Y532 WeakPolarHBondContact O-CB 3.38Å; A528-Y532 PolarHBondContact O-N 2.84Å; F529-Y532 WeakPolarHBondContact O-CB 3.25Å; F529-Y532 PolarHBondContact O-N 2.99Å; L530-Y532 PolarHBondContact O-N 2.94Å; Y532-E534 VanDerWaalsContact C-N 3.31Å; Y532-E534 PolarHBondContact O-N 3.49Å; Y532-E535 PolarHBondContact O-N 3.36Å; Y532-L536 HydrophobicContact CD1-CD1 4.16Å; Y532-L536 HydrophobicContact CD2-CG 4.42Å; Y532-L536 HydrophobicContact CE1-CD1 3.47Å; Y532-L536 VanDerWaalsContact CE1-CD1 3.47Å; Y532-L536 HydrophobicContact CE1-CG 4.2Å; Y532-L536 HydrophobicContact CE2-CD1 4.08Å; Y532-L536 HydrophobicContact CE2-CD2 4.28Å; Y532-L536 HydrophobicContact CE2-CG 4.01Å; Y532-L536 VanDerWaalsContact CZ-CD1 3.44Å; Y532-L536 PolarHBondContact O-N 2.9Å
533	R	84.7	Confident	85.2	Confident	130 Å²	130	80.2 Å²	80.2	49%	0.491	36%	0.364	S	S	.	.	H	α-helix	trans	-61.5	-41.5	176.6	179.7	-178.9	156.5	-176.1	-6.5	111.4	F529 L530 K531 R537	F529-R533 WeakPolarHBondContact O-CB 3.43Å; F529-R533 PolarHBondContact O-N 3Å; L530-R533 PolarHBondContact O-N 3.33Å; K531-R533 VanDerWaalsContact C-N 3.34Å; K531-R533 PolarHBondContact O-N 2.73Å; R533-R537 WeakPolarHBondContact O-CB 3.28Å; R533-R537 PolarHBondContact O-N 3.27Å
534	E	85.8	Confident	85.9	Confident	114 Å²	114	77.3 Å²	77.3	53%	0.533	35%	0.354	S	S	.	.	H	α-helix	trans	-65.7	-44.8	176.5	-166.1	179.3	175.4	0	0	111.9	L530 K531 Y532 L536 R537 Q538	L530-E534 PolarHBondContact O-N 3.06Å; K531-E534 PolarHBondContact O-N 2.92Å; Y532-E534 VanDerWaalsContact C-N 3.31Å; Y532-E534 PolarHBondContact O-N 3.49Å; E534-L536 PolarHBondContact O-N 3Å; E534-R537 WeakPolarHBondContact O-CB 3.3Å; E534-R537 PolarHBondContact O-N 3.25Å; E534-R537 VanDerWaalsContact O-N 3.17Å; E534-Q538 WeakPolarHBondContact O-CG 3.38Å; E534-Q538 PolarHBondContact O-N 3.15Å; E534-Q538 PolarHBondContact OE1-NE2 3.46Å
535	E	88.7	Confident	86.2	Confident	81 Å²	81	74.5 Å²	74.5	38%	0.379	35%	0.35	S	S	.	.	H	α-helix	trans	-59.1	-43.8	175.8	-73.9	176.8	-172.2	0	0	112	K531 Y532 Q538 K539	K531-E535 VanDerWaalsContact CE-OE1 3.23Å; K531-E535 WeakPolarHBondContact CE-OE1 3.34Å; K531-E535 WeakPolarHBondContact O-CG 3.31Å; K531-E535 PolarHBondContact O-N 2.96Å; Y532-E535 PolarHBondContact O-N 3.36Å; E535-Q538 PolarHBondContact O-N 3.12Å; E535-K539 WeakPolarHBondContact O-CG 3.39Å; E535-K539 PolarHBondContact O-N 2.83Å
536	L	84.7	Confident	86.3	Confident	29 Å²	29	81.1 Å²	81.1	15%	0.152	38%	0.381	C	S	.	.	H	α-helix	trans	-64	-41.7	174.9	-75.2	-174.6	0	0	0	112.2	H490 Y532 E534 Q538 K539 K540	H490-L536 HydrophobicContact CB-CD1 4.42Å; H490-L536 WeakPolarHBondContact ND1-CD1 3.48Å; Y532-L536 HydrophobicContact CD1-CD1 4.16Å; Y532-L536 HydrophobicContact CD2-CG 4.42Å; Y532-L536 HydrophobicContact CE1-CD1 3.47Å; Y532-L536 VanDerWaalsContact CE1-CD1 3.47Å; Y532-L536 HydrophobicContact CE1-CG 4.2Å; Y532-L536 HydrophobicContact CE2-CD1 4.08Å; Y532-L536 HydrophobicContact CE2-CD2 4.28Å; Y532-L536 HydrophobicContact CE2-CG 4.01Å; Y532-L536 VanDerWaalsContact CZ-CD1 3.44Å; Y532-L536 PolarHBondContact O-N 2.9Å; E534-L536 PolarHBondContact O-N 3Å; L536-Q538 VanDerWaalsContact C-N 3.3Å; L536-Q538 PolarHBondContact O-N 2.76Å; L536-K539 PolarHBondContact O-N 3.04Å; L536-K540 PolarHBondContact O-N 3.44Å
537	R	83.3	Confident	86.6	Confident	89 Å²	89	82.5 Å²	82.5	34%	0.336	39%	0.389	S	S	.	.	H	α-helix	trans	-60.2	-43.3	176.4	-173.7	-176.8	-177.9	-174.3	2.9	110.7	R533 E534 R541 E660	R533-R537 WeakPolarHBondContact O-CB 3.28Å; R533-R537 PolarHBondContact O-N 3.27Å; E534-R537 WeakPolarHBondContact O-CB 3.3Å; E534-R537 PolarHBondContact O-N 3.25Å; E534-R537 VanDerWaalsContact O-N 3.17Å; R537-R541 WeakPolarHBondContact O-CB 3.42Å; R537-R541 VanDerWaalsContact O-CG 3.3Å; R537-R541 WeakPolarHBondContact O-CG 3.42Å; R537-R541 PolarHBondContact O-N 2.98Å; R537-E660 IonicContact CZ-OE1 2.74Å; R537-E660 VanDerWaalsContact CZ-OE1 3.25Å; R537-E660 IonicContact CZ-OE2 3.09Å; R537-E660 IonicContact NH1-OE1 3.61Å; R537-E660 PolarHBondContact NH1-OE1 2.78Å; R537-E660 IonicContact NH1-OE2 3.24Å; R537-E660 IonicContact NH2-OE1 2.64Å; R537-E660 PolarHBondContact NH2-OE1 3.01Å; R537-E660 IonicContact NH2-OE2 2.85Å; R537-E660 PolarHBondContact NH2-OE2 2.97Å
538	Q	87.4	Confident	86.8	Confident	93 Å²	93	78.8 Å²	78.8	44%	0.435	37%	0.37	S	S	.	.	H	α-helix	trans	-65.8	-42.7	177.6	-70	178.8	14.3	0	0	112.2	E534 E535 L536 R541 Q542	E534-Q538 WeakPolarHBondContact O-CG 3.38Å; E534-Q538 PolarHBondContact O-N 3.15Å; E534-Q538 PolarHBondContact OE1-NE2 3.46Å; E535-Q538 PolarHBondContact O-N 3.12Å; L536-Q538 VanDerWaalsContact C-N 3.3Å; L536-Q538 PolarHBondContact O-N 2.76Å; Q538-R541 WeakPolarHBondContact O-CB 3.38Å; Q538-R541 PolarHBondContact O-N 2.73Å; Q538-Q542 WeakPolarHBondContact O-CG 3.34Å; Q538-Q542 PolarHBondContact O-N 2.9Å
539	K	87.8	Confident	86.8	Confident	129 Å²	129	78.2 Å²	78.2	56%	0.561	36%	0.362	S	S	*	.	H	α-helix	trans	-59.2	-47.7	175.3	-75.6	176	-179.6	176.1	0	112	E535 L536 R541 Q542 E543	E535-K539 WeakPolarHBondContact O-CG 3.39Å; E535-K539 PolarHBondContact O-N 2.83Å; L536-K539 PolarHBondContact O-N 3.04Å; K539-R541 PolarHBondContact O-N 3.35Å; K539-Q542 WeakPolarHBondContact O-CB 3.42Å; K539-Q542 PolarHBondContact O-N 3.42Å; K539-E543 PolarHBondContact O-N 2.82Å
540	K	84.4	Confident	86.9	Confident	47 Å²	47	78.3 Å²	78.3	20%	0.204	36%	0.362	C	S	.	.	H	α-helix	trans	-63.1	-41	175.6	-73.1	-164	171.9	-175.7	0	112.2	H490 L536 Q542 E543 F544 Y657	H490-K540 VanDerWaalsContact CE1-CE 3.46Å; H490-K540 WeakPolarHBondContact CE1-CE 3.38Å; H490-K540 WeakPolarHBondContact NE2-CE 3.28Å; H490-K540 PolarHBondContact NE2-NZ 3.49Å; L536-K540 PolarHBondContact O-N 3.44Å; K540-Q542 VanDerWaalsContact C-N 3.26Å; K540-Q542 PolarHBondContact O-N 3.17Å; K540-E543 PolarHBondContact O-N 2.67Å; K540-F544 HydrophobicContact CB-CD2 4.41Å; K540-F544 VanDerWaalsContact O-CD2 3.28Å; K540-F544 WeakPolarHBondContact O-CD2 3.35Å; K540-F544 PolarHBondContact O-N 3.05Å; K540-Y657 HydrophobicContact CB-CD1 3.96Å; K540-Y657 HydrophobicContact CB-CE1 3.62Å; K540-Y657 HydrophobicContact CD-CE1 3.51Å; K540-Y657 HydrophobicContact CG-CE1 4.22Å
541	R	86.8	Confident	87.3	Confident	70 Å²	70	75.5 Å²	75.5	26%	0.264	35%	0.347	S	S	.	.	H	α-helix	trans	-57.4	-39.6	173.6	-77.1	178.1	81.2	-178.7	7.3	112	R537 Q538 K539 A545 F658 D661	R537-R541 WeakPolarHBondContact O-CB 3.42Å; R537-R541 VanDerWaalsContact O-CG 3.3Å; R537-R541 WeakPolarHBondContact O-CG 3.42Å; R537-R541 PolarHBondContact O-N 2.98Å; Q538-R541 WeakPolarHBondContact O-CB 3.38Å; Q538-R541 PolarHBondContact O-N 2.73Å; K539-R541 PolarHBondContact O-N 3.35Å; R541-A545 WeakPolarHBondContact O-CA 3.31Å; R541-A545 WeakPolarHBondContact O-CB 3.31Å; R541-A545 PolarHBondContact O-N 3.03Å; R541-A545 VanDerWaalsContact O-N 3.09Å; R541-F658 HydrophobicContact CB-CE1 4.41Å; R541-F658 HydrophobicContact CB-CZ 4.26Å; R541-F658 HydrophobicContact CG-CE1 4.43Å; R541-F658 HydrophobicContact CG-CZ 4.41Å; R541-F658 WeakPolarHBondContact O-CZ 3.5Å; R541-D661 IonicContact CZ-OD2 2.66Å; R541-D661 IonicContact NH2-OD1 3.55Å; R541-D661 PolarHBondContact NH2-OD1 2.83Å; R541-D661 IonicContact NH2-OD2 3.44Å; R541-D661 PolarHBondContact NH2-OD2 3.31Å
542	Q	88.1	Confident	87.4	Confident	146 Å²	146	69.3 Å²	69.3	68%	0.682	32%	0.32	S	S	*	.	H	α-helix	trans	-70	-43.8	176.8	-70	172.3	6.5	0	0	111.9	Q538 K539 K540 F544 A545	Q538-Q542 WeakPolarHBondContact O-CG 3.34Å; Q538-Q542 PolarHBondContact O-N 2.9Å; K539-Q542 WeakPolarHBondContact O-CB 3.42Å; K539-Q542 PolarHBondContact O-N 3.42Å; K540-Q542 VanDerWaalsContact C-N 3.26Å; K540-Q542 PolarHBondContact O-N 3.17Å; Q542-F544 PolarHBondContact O-N 3.44Å; Q542-A545 VanDerWaalsContact O-CB 3.31Å; Q542-A545 WeakPolarHBondContact O-CB 3.23Å; Q542-A545 PolarHBondContact O-N 2.82Å
543	E	87.5	Confident	87.7	Confident	125 Å²	125	69.4 Å²	69.4	58%	0.584	32%	0.322	S	S	*	.	H	α-helix	trans	-59.4	-47.8	178.1	-173.4	176.1	-173.3	0	0	111.5	K539 K540 A545 H546	K539-E543 PolarHBondContact O-N 2.82Å; K540-E543 PolarHBondContact O-N 2.67Å; E543-A545 VanDerWaalsContact C-N 3.34Å; E543-A545 PolarHBondContact O-N 3.25Å; E543-H546 PolarHBondContact O-CE1 3.41Å; E543-H546 PolarHBondContact O-ND1 2.72Å
544	F	86.9	Confident	88.2	Confident	56 Å²	56	63.2 Å²	63.2	25%	0.246	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-88	4.8	-178.8	-67.8	-76.7	0	0	0	114.3	K540 Q542 H546 L547 A548 V653 Y657	K540-F544 HydrophobicContact CB-CD2 4.41Å; K540-F544 VanDerWaalsContact O-CD2 3.28Å; K540-F544 WeakPolarHBondContact O-CD2 3.35Å; K540-F544 PolarHBondContact O-N 3.05Å; Q542-F544 PolarHBondContact O-N 3.44Å; F544-H546 PolarHBondContact O-N 2.64Å; F544-L547 HydrophobicContact CD1-CD1 3.96Å; F544-L547 HydrophobicContact CE1-CD1 4.45Å; F544-L547 PolarHBondContact O-N 3.28Å; F544-A548 PolarHBondContact O-N 3.32Å; F544-V653 HydrophobicContact CB-CG1 3.88Å; F544-V653 HydrophobicContact CD1-CG2 4.19Å; F544-Y657 HydrophobicContact CB-CD2 4.31Å; F544-Y657 HydrophobicContact CD2-CD2 4.15Å; F544-Y657 AromaticContact CD2-CE2 3.69Å; F544-Y657 HydrophobicContact CD2-CE2 3.69Å; F544-Y657 AromaticContact CD2-CZ 3.98Å; F544-Y657 HydrophobicContact CE2-CE2 4.06Å; F544-Y657 HydrophobicContact CG-CD2 4.31Å; F544-Y657 HydrophobicContact CG-CE2 4.09Å
545	A	85.4	Confident	88.7	Confident	53 Å²	53	62.3 Å²	62.3	44%	0.438	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-57.4	-36	-177.5	0	0	0	0	0	112.9	R541 Q542 E543 L547 A548	R541-A545 WeakPolarHBondContact O-CA 3.31Å; R541-A545 WeakPolarHBondContact O-CB 3.31Å; R541-A545 PolarHBondContact O-N 3.03Å; R541-A545 VanDerWaalsContact O-N 3.09Å; Q542-A545 VanDerWaalsContact O-CB 3.31Å; Q542-A545 WeakPolarHBondContact O-CB 3.23Å; Q542-A545 PolarHBondContact O-N 2.82Å; E543-A545 VanDerWaalsContact C-N 3.34Å; E543-A545 PolarHBondContact O-N 3.25Å; A545-L547 VanDerWaalsContact C-N 3.31Å; A545-L547 PolarHBondContact O-N 2.86Å; A545-A548 WeakPolarHBondContact O-CB 3.46Å; A545-A548 PolarHBondContact O-N 2.85Å
546	H	83.8	Confident	88.9	Confident	143 Å²	143	58.5 Å²	58.5	66%	0.662	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-71.5	-22.7	180	66.9	-78.2	0	0	0	113.7	E543 F544	E543-H546 PolarHBondContact O-CE1 3.41Å; E543-H546 PolarHBondContact O-ND1 2.72Å; F544-H546 PolarHBondContact O-N 2.64Å
547	L	86.6	Confident	89.3	Confident	57 Å²	57	58.1 Å²	58.1	30%	0.298	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-92.5	-10.5	175.2	-67	169.9	0	0	0	112.4	F544 A545 I549 T650 V653	F544-L547 HydrophobicContact CD1-CD1 3.96Å; F544-L547 HydrophobicContact CE1-CD1 4.45Å; F544-L547 PolarHBondContact O-N 3.28Å; A545-L547 VanDerWaalsContact C-N 3.31Å; A545-L547 PolarHBondContact O-N 2.86Å; L547-I549 PolarHBondContact O-N 2.93Å; L547-T650 WeakPolarHBondContact O-CB 3.27Å; L547-T650 VanDerWaalsContact O-CG2 3.26Å; L547-T650 WeakPolarHBondContact O-CG2 3.24Å; L547-V653 HydrophobicContact CB-CG1 4.47Å; L547-V653 HydrophobicContact CB-CG2 4.25Å
548	A	86.5	Confident	89.5	Confident	13 Å²	13	57.3 Å²	57.3	11%	0.107	28%	0.276	C	S	.	.			trans	-79.6	81.1	-177.8	0	0	0	0	0	111.4	F544 A545 F550 V653 F658	F544-A548 PolarHBondContact O-N 3.32Å; A545-A548 WeakPolarHBondContact O-CB 3.46Å; A545-A548 PolarHBondContact O-N 2.85Å; A548-F550 HydrophobicContact CB-CE2 4.11Å; A548-F550 VanDerWaalsContact O-CD2 3.3Å; A548-F550 WeakPolarHBondContact O-CD2 3.29Å; A548-F550 WeakPolarHBondContact O-CE2 3.39Å; A548-V653 HydrophobicContact CB-CG1 4.29Å; A548-F658 HydrophobicContact CB-CD2 3.72Å; A548-F658 HydrophobicContact CB-CE1 4.26Å; A548-F658 HydrophobicContact CB-CE2 3.38Å; A548-F658 HydrophobicContact CB-CG 4.3Å; A548-F658 HydrophobicContact CB-CZ 3.68Å
549	I	90.1	Very high	89.4	Confident	28 Å²	28	61.6 Å²	61.6	14%	0.144	30%	0.296	C	S	.	.			trans	-85.7	115.6	175.5	-58.7	174.4	0	0	0	109.3	L547 V583 P584 R645 T650	L547-I549 PolarHBondContact O-N 2.93Å; I549-V583 HydrophobicContact CG2-CG1 4.26Å; I549-P584 HydrophobicContact CD1-CG 3.49Å; I549-P584 VanDerWaalsContact CD1-CG 3.49Å; I549-P584 HydrophobicContact CG1-CG 4.31Å; I549-P584 HydrophobicContact CG2-CG 4.45Å; I549-R645 WeakPolarHBondContact CD1-O 3.36Å; I549-T650 HydrophobicContact CB-CG2 4.22Å; I549-T650 HydrophobicContact CD1-CG2 3.56Å; I549-T650 HydrophobicContact CG1-CG2 3.91Å
550	F	91	Very high	89.5	Confident	6 Å²	6	59.3 Å²	59.3	3%	0.026	29%	0.288	C	S	.	.			trans	-81.4	139.6	177.2	-70.2	-101.1	0	0	0	110.3	A548 C552 I578 K580 S644 F658 D661 L662	A548-F550 HydrophobicContact CB-CE2 4.11Å; A548-F550 VanDerWaalsContact O-CD2 3.3Å; A548-F550 WeakPolarHBondContact O-CD2 3.29Å; A548-F550 WeakPolarHBondContact O-CE2 3.39Å; F550-C552 PolarHBondContact O-N 3.46Å; F550-I578 HydrophobicContact CB-CB 4.43Å; F550-I578 HydrophobicContact CD1-CD1 4.2Å; F550-K580 HydrophobicContact CD2-CD 3.68Å; F550-K580 HydrophobicContact CE2-CD 3.96Å; F550-K580 HydrophobicContact CG-CD 4.15Å; F550-S644 WeakPolarHBondContact O-CB 3.2Å; F550-F658 HydrophobicContact CZ-CB 4.17Å; F550-F658 AromaticContact CZ-CD1 3.95Å; F550-F658 HydrophobicContact CZ-CD1 3.95Å; F550-F658 HydrophobicContact CZ-CG 4.2Å; F550-D661 HydrophobicContact CE1-CB 3.89Å; F550-D661 HydrophobicContact CZ-CB 4.38Å; F550-L662 HydrophobicContact CD1-CD2 3.88Å; F550-L662 HydrophobicContact CD1-CG 4.31Å; F550-L662 HydrophobicContact CE1-CD2 4.38Å; F550-L662 HydrophobicContact CE1-CG 4.31Å
551	P	93.3	Very high	89.8	Confident	2 Å²	2	59 Å²	59	1%	0.013	29%	0.289	C	S	.	.			trans	-70.2	130.4	-179.1	32.7	-37.2	0	0	0	110.1	G577 I578 S644 I646 L662 D666 L669 V670 L673	P551-G577 CarbonylContact O-C 3.55Å; P551-G577 VanDerWaalsContact O-CA 3.3Å; P551-G577 WeakPolarHBondContact O-CA 3.48Å; P551-I578 PolarHBondContact O-N 3.39Å; P551-S644 WeakPolarHBondContact CA-OG 3.28Å; P551-I646 HydrophobicContact CB-CD1 3.83Å; P551-L662 HydrophobicContact CG-CD2 3.89Å; P551-D666 HydrophobicContact CG-CB 4.11Å; P551-L669 HydrophobicContact CB-CB 4.47Å; P551-L669 HydrophobicContact CB-CD2 3.94Å; P551-L669 HydrophobicContact CB-CG 4.14Å; P551-V670 HydrophobicContact CB-CG2 3.78Å; P551-V670 HydrophobicContact CG-CG2 3.71Å; P551-L673 HydrophobicContact CB-CD1 4.21Å
552	C	94.3	Very high	90	Very high	0 Å²	0	63 Å²	63	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	146.8	173	71.2	0	0	0	0	112	F550 L554 D576 V643 S644	F550-C552 PolarHBondContact O-N 3.46Å; C552-L554 HydrophobicContact CB-CD2 4.37Å; C552-D576 WeakPolarHBondContact CA-O 3.43Å; C552-V643 CarbonylContact O-C 3.53Å; C552-V643 VanDerWaalsContact O-CA 3.3Å; C552-V643 WeakPolarHBondContact O-CA 3.48Å; C552-S644 PolarHBondContact N-OG 3.3Å; C552-S644 PolarHBondContact O-N 3.06Å
553	K	94.8	Very high	90.2	Very high	47 Å²	47	60.3 Å²	60.3	20%	0.204	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	120.8	172.2	-173.5	172.2	-173.4	171.1	0	108.6	E575 D576 F641 V643 L669 E672	K553-E575 PolarHBondContact O-N 3.49Å; K553-D576 HydrophobicContact CB-CB 4.2Å; K553-D576 PolarHBondContact N-O 2.93Å; K553-D576 PolarHBondContact O-N 3.35Å; K553-F641 HydrophobicContact CG-CD1 4.5Å; K553-V643 HydrophobicContact CG-CG1 4.24Å; K553-L669 HydrophobicContact CB-CD1 4.18Å; K553-L669 HydrophobicContact CB-CD2 4.4Å; K553-L669 HydrophobicContact CD-CD1 4.37Å; K553-E672 IonicContact NZ-OE1 2.76Å; K553-E672 PolarHBondContact NZ-OE1 3.28Å
554	L	95.6	Very high	90.2	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	146.6	-173	-43.7	173.5	0	0	0	110.2	C552 V572 S573 V574 L579 L585 I619 L642	C552-L554 HydrophobicContact CB-CD2 4.37Å; L554-V572 HydrophobicContact CB-CB 4.35Å; L554-V572 HydrophobicContact CD1-CG2 4.48Å; L554-S573 WeakPolarHBondContact CA-O 3.22Å; L554-V574 HydrophobicContact CD2-CB 4.19Å; L554-V574 HydrophobicContact CD2-CG1 4.12Å; L554-V574 HydrophobicContact CD2-CG2 3.84Å; L554-L579 HydrophobicContact CD1-CD1 3.87Å; L554-L579 HydrophobicContact CD1-CD2 4.14Å; L554-L579 HydrophobicContact CD2-CB 4.36Å; L554-L579 HydrophobicContact CD2-CD1 4.25Å; L554-L579 HydrophobicContact CD2-CD2 3.93Å; L554-L579 HydrophobicContact CD2-CG 4.42Å; L554-L585 HydrophobicContact CD1-CD1 3.97Å; L554-L585 HydrophobicContact CD1-CD2 3.89Å; L554-I619 HydrophobicContact CD1-CD1 4.17Å; L554-L642 HydrophobicContact CB-CB 4.14Å; L554-L642 HydrophobicContact CD1-CB 4.44Å; L554-L642 PolarHBondContact N-O 2.96Å; L554-L642 PolarHBondContact O-N 3.16Å
555	R	95	Very high	90.2	Very high	95 Å²	95	61.6 Å²	61.6	36%	0.358	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	131	171.1	-177.8	170.9	58.4	97.2	3.5	109.5	V572 S573 E575 F641	R555-V572 CarbonylContact O-C 3.34Å; R555-V572 VanDerWaalsContact O-CA 3.26Å; R555-V572 WeakPolarHBondContact O-CA 3.1Å; R555-S573 PolarHBondContact N-O 3.37Å; R555-S573 PolarHBondContact O-N 2.77Å; R555-E575 HydrophobicContact CB-CG 3.88Å; R555-E575 IonicContact CZ-OE1 3.43Å; R555-E575 IonicContact NE-OE1 2.82Å; R555-E575 PolarHBondContact NE-OE1 2.85Å; R555-E575 IonicContact NH2-OE1 3.14Å; R555-E575 PolarHBondContact NH2-OE1 2.82Å; R555-E575 VanDerWaalsContact NH2-OE1 3.14Å; R555-F641 HydrophobicContact CB-CD1 4.29Å; R555-F641 HydrophobicContact CB-CE1 4.17Å; R555-F641 HydrophobicContact CG-CE1 4.36Å
556	I	94	Very high	90.2	Very high	1 Å²	1	62.1 Å²	62.1	1%	0.005	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	134.8	178.2	-58.8	170.3	0	0	0	109.3	V561 V570 V572 Y632 F636 L642	I556-V561 HydrophobicContact CG2-CG2 4.38Å; I556-V570 HydrophobicContact CG2-CB 4.44Å; I556-V572 HydrophobicContact CG1-CG1 4.27Å; I556-Y632 HydrophobicContact CD1-CD2 4.34Å; I556-Y632 HydrophobicContact CD1-CE2 3.99Å; I556-Y632 HydrophobicContact CG2-CE2 4.08Å; I556-F636 HydrophobicContact CD1-CD2 3.81Å; I556-F636 HydrophobicContact CD1-CE2 3.66Å; I556-L642 HydrophobicContact CD1-CD1 4.02Å; I556-L642 HydrophobicContact CD1-CD2 4.05Å; I556-L642 HydrophobicContact CD1-CG 4.11Å; I556-L642 HydrophobicContact CG1-CD1 3.93Å; I556-L642 HydrophobicContact CG1-CG 4.09Å
557	L	93	Very high	90.6	Very high	20 Å²	20	56.6 Å²	56.6	11%	0.105	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	120.6	176.5	-63.5	174.8	0	0	0	109.7	Q559 H560 G571 E616	L557-Q559 PolarHBondContact O-N 2.87Å; L557-H560 HydrophobicContact CB-CB 3.99Å; L557-H560 PolarHBondContact O-N 2.83Å; L557-G571 PolarHBondContact N-O 2.82Å; L557-E616 HydrophobicContact CD1-CB 4.41Å; L557-E616 HydrophobicContact CD1-CG 4.44Å
558	P	86.7	Confident	90.9	Very high	72 Å²	72	54.1 Å²	54.1	47%	0.468	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.3	-26	-165.7	-27.7	33.2	0	0	0	116.9	Y638	P558-Y638 HydrophobicContact CB-CD1 4.4Å; P558-Y638 HydrophobicContact CB-CD2 3.97Å; P558-Y638 HydrophobicContact CB-CE2 4.46Å; P558-Y638 HydrophobicContact CB-CG 3.94Å; P558-Y638 HydrophobicContact CG-CD2 3.65Å; P558-Y638 HydrophobicContact CG-CE2 4.26Å; P558-Y638 HydrophobicContact CG-CG 4.01Å
559	Q	86.5	Confident	91.2	Very high	183 Å²	183	55.7 Å²	55.7	86%	0.855	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.6	5.1	-177.2	-64.1	-178.8	1.4	0	0	113.6	L557	L557-Q559 PolarHBondContact O-N 2.87Å
560	H	89.5	Confident	91.4	Very high	82 Å²	82	54.4 Å²	54.4	38%	0.38	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	51.2	-173.5	-60.8	84.5	0	0	0	111.3	L557 Y562 V570 G571	L557-H560 HydrophobicContact CB-CB 3.99Å; L557-H560 PolarHBondContact O-N 2.83Å; H560-Y562 HydrophobicContact CB-CE2 4.42Å; H560-V570 CarbonylContact O-C 3.52Å; H560-V570 WeakPolarHBondContact O-CA 3.41Å; H560-G571 PolarHBondContact O-N 3.43Å
561	V	89.8	Confident	91.6	Very high	39 Å²	39	54.3 Å²	54.3	24%	0.236	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	102	175.8	-179	0	0	0	0	108.4	I556 V570 Y632	I556-V561 HydrophobicContact CG2-CG2 4.38Å; V561-V570 HydrophobicContact CB-CG1 4.34Å; V561-V570 HydrophobicContact CG1-CG1 3.96Å; V561-V570 HydrophobicContact CG2-CG1 4.04Å; V561-Y632 HydrophobicContact CB-CD1 4.44Å; V561-Y632 HydrophobicContact CB-CE1 4.27Å; V561-Y632 HydrophobicContact CG1-CD1 3.72Å; V561-Y632 HydrophobicContact CG1-CE1 4.05Å; V561-Y632 HydrophobicContact CG1-CG 4.07Å; V561-Y632 HydrophobicContact CG2-CD1 4.18Å; V561-Y632 HydrophobicContact CG2-CE1 3.68Å; V561-Y632 HydrophobicContact CG2-CE2 4.08Å
562	Y	91	Very high	91.7	Very high	156 Å²	156	54.2 Å²	54.2	61%	0.612	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.5	-30	-174.8	-59.8	-79.4	0	0	0	112.5	H560 I569	H560-Y562 HydrophobicContact CB-CE2 4.42Å; Y562-I569 HydrophobicContact CD2-CG2 4Å; Y562-I569 HydrophobicContact CG-CG2 4.33Å; Y562-I569 PolarHBondContact N-O 3.34Å
563	K	92.2	Very high	91.7	Very high	89 Å²	89	54.8 Å²	54.8	39%	0.387	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	122.2	177.8	-170.3	170.2	168	-179.8	0	111	R565 P567 I568 I569	K563-R565 WeakPolarHBondContact CE-O 3.45Å; K563-R565 WeakPolarHBondContact CG-O 2.9Å; K563-P567 HydrophobicContact CD-CG 4.48Å; K563-P567 WeakPolarHBondContact CD-O 3.29Å; K563-P567 WeakPolarHBondContact CE-O 3.48Å; K563-P567 WeakPolarHBondContact CG-O 2.88Å; K563-P567 VanDerWaalsContact NZ-CD 3.34Å; K563-I568 WeakPolarHBondContact O-CA 3.15Å; K563-I569 HydrophobicContact CB-CB 3.89Å; K563-I569 HydrophobicContact CB-CD1 4.07Å; K563-I569 HydrophobicContact CB-CG1 3.94Å; K563-I569 HydrophobicContact CD-CD1 4.27Å; K563-I569 PolarHBondContact N-O 2.94Å; K563-I569 VanDerWaalsContact N-O 3.16Å; K563-I569 PolarHBondContact O-N 3.13Å
564	S	88.5	Confident	91.7	Very high	58 Å²	58	52.5 Å²	52.5	41%	0.406	25%	0.252	S	S	.	.	S	Bend	trans	-88.5	-11.4	-171	-45	0	0	0	0	115.1	M631 Y632	S564-M631 WeakPolarHBondContact O-CA 3.35Å; S564-Y632 PolarHBondContact O-N 2.99Å
565	R	86.7	Confident	91.6	Very high	149 Å²	149	55.6 Å²	55.6	56%	0.562	27%	0.266	S	S	*	.	B	Isolated β-bridge	trans	-137.4	146	-177.3	-174.1	179.1	-177.9	-176.8	0.1	110	K563 P567	K563-R565 WeakPolarHBondContact CE-O 3.45Å; K563-R565 WeakPolarHBondContact CG-O 2.9Å; R565-P567 CarbonylContact O-C 3.5Å
566	D	86.2	Confident	91.5	Very high	64 Å²	64	52.8 Å²	52.8	34%	0.342	26%	0.258	S	S	.	.	S	Bend	trans	-26.1	122.3	-177.2	-168.9	39.8	0	0	0	116.9	N623 P629	D566-N623 PolarHBondContact OD1-N 3.28Å; D566-P629 HydrophobicContact CB-CB 3.73Å; D566-P629 HydrophobicContact CB-CG 4.46Å
567	P	91	Very high	91.4	Very high	27 Å²	27	52.8 Å²	52.8	18%	0.175	26%	0.258	C	S	.	.	S	Bend	cis	-62.8	134.1	-15.4	24.1	-36.3	0	0	0	111.8	K563 R565 K620 I621 E622	K563-P567 HydrophobicContact CD-CG 4.48Å; K563-P567 WeakPolarHBondContact CD-O 3.29Å; K563-P567 WeakPolarHBondContact CE-O 3.48Å; K563-P567 WeakPolarHBondContact CG-O 2.88Å; K563-P567 VanDerWaalsContact NZ-CD 3.34Å; R565-P567 CarbonylContact O-C 3.5Å; P567-K620 HydrophobicContact CB-CD 4.23Å; P567-K620 VanDerWaalsContact CB-CE 3.46Å; P567-K620 HydrophobicContact CB-CG 3.72Å; P567-I621 CarbonylContact C-O 3.45Å; P567-I621 WeakPolarHBondContact CA-O 3.34Å; P567-E622 HydrophobicContact CB-CG 3.88Å
568	I	92.4	Very high	91.4	Very high	5 Å²	5	52 Å²	52	3%	0.026	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	127.7	173.7	-59	173.3	0	0	0	108	K563 V570 I595 K620 I621 F636	K563-I568 WeakPolarHBondContact O-CA 3.15Å; I568-V570 HydrophobicContact CG2-CG1 3.8Å; I568-V570 HydrophobicContact CG2-CG2 4.49Å; I568-I595 HydrophobicContact CD1-CG2 3.71Å; I568-K620 CarbonylContact O-C 3.52Å; I568-K620 WeakPolarHBondContact O-CA 3.26Å; I568-I621 HydrophobicContact CB-CB 4.25Å; I568-I621 PolarHBondContact N-O 2.89Å; I568-I621 PolarHBondContact O-N 2.69Å; I568-F636 HydrophobicContact CD1-CE1 3.98Å; I568-F636 HydrophobicContact CD1-CZ 3.89Å; I568-F636 HydrophobicContact CG2-CZ 4.42Å
569	I	94.4	Very high	91.7	Very high	47 Å²	47	48.6 Å²	48.6	24%	0.241	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	113	-180	-55.5	174.6	0	0	0	108.2	Y562 K563 C618 I619 K620	Y562-I569 HydrophobicContact CD2-CG2 4Å; Y562-I569 HydrophobicContact CG-CG2 4.33Å; Y562-I569 PolarHBondContact N-O 3.34Å; K563-I569 HydrophobicContact CB-CB 3.89Å; K563-I569 HydrophobicContact CB-CD1 4.07Å; K563-I569 HydrophobicContact CB-CG1 3.94Å; K563-I569 HydrophobicContact CD-CD1 4.27Å; K563-I569 PolarHBondContact N-O 2.94Å; K563-I569 VanDerWaalsContact N-O 3.16Å; K563-I569 PolarHBondContact O-N 3.13Å; I569-C618 VanDerWaalsContact CG2-SG 3.56Å; I569-I619 WeakPolarHBondContact CA-O 3.44Å; I569-K620 HydrophobicContact CG1-CG 4.24Å
570	V	94	Very high	92	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	141.9	-173.7	-69	0	0	0	0	111.4	I556 H560 V561 I568 V572 I619 I621	I556-V570 HydrophobicContact CG2-CB 4.44Å; H560-V570 CarbonylContact O-C 3.52Å; H560-V570 WeakPolarHBondContact O-CA 3.41Å; V561-V570 HydrophobicContact CB-CG1 4.34Å; V561-V570 HydrophobicContact CG1-CG1 3.96Å; V561-V570 HydrophobicContact CG2-CG1 4.04Å; I568-V570 HydrophobicContact CG2-CG1 3.8Å; I568-V570 HydrophobicContact CG2-CG2 4.49Å; V570-V572 HydrophobicContact CG2-CG1 4.01Å; V570-I619 HydrophobicContact CG2-CD1 4.22Å; V570-I619 HydrophobicContact CG2-CG1 3.78Å; V570-I619 PolarHBondContact N-O 3.31Å; V570-I619 VanDerWaalsContact N-O 3.1Å; V570-I619 PolarHBondContact O-N 2.72Å; V570-I621 HydrophobicContact CG2-CD1 4.18Å
571	G	94.7	Very high	92.1	Very high	5 Å²	5	41.4 Å²	41.4	5%	0.052	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	129	165.7	0	0	0	0	0	109.9	L557 H560	L557-G571 PolarHBondContact N-O 2.82Å; H560-G571 PolarHBondContact O-N 3.43Å
572	V	95.1	Very high	92.2	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	146.9	-179.5	-63.9	0	0	0	0	111	L554 R555 I556 V570 E616 V617 I619	L554-V572 HydrophobicContact CB-CB 4.35Å; L554-V572 HydrophobicContact CD1-CG2 4.48Å; R555-V572 CarbonylContact O-C 3.34Å; R555-V572 VanDerWaalsContact O-CA 3.26Å; R555-V572 WeakPolarHBondContact O-CA 3.1Å; I556-V572 HydrophobicContact CG1-CG1 4.27Å; V570-V572 HydrophobicContact CG2-CG1 4.01Å; V572-E616 WeakPolarHBondContact O-CA 3.49Å; V572-V617 HydrophobicContact CG2-CG2 4.02Å; V572-V617 WeakPolarHBondContact CG2-O 3.13Å; V572-V617 PolarHBondContact N-O 2.91Å; V572-V617 PolarHBondContact O-N 3.34Å; V572-I619 HydrophobicContact CB-CD1 4.46Å; V572-I619 HydrophobicContact CG1-CD1 3.74Å; V572-I619 HydrophobicContact CG1-CG1 3.95Å; V572-I619 HydrophobicContact CG2-CB 4.48Å; V572-I619 HydrophobicContact CG2-CD1 3.87Å; V572-I619 HydrophobicContact CG2-CG1 3.89Å; V572-I619 HydrophobicContact CG2-CG2 3.83Å
573	S	95.4	Very high	92.3	Very high	11 Å²	11	34.6 Å²	34.6	8%	0.077	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	128.4	165.5	174.1	0	0	0	0	108.9	L554 R555 E575	L554-S573 WeakPolarHBondContact CA-O 3.22Å; R555-S573 PolarHBondContact N-O 3.37Å; R555-S573 PolarHBondContact O-N 2.77Å; S573-E575 PolarHBondContact O-N 3.33Å; S573-E575 PolarHBondContact OG-OE1 3.24Å
574	V	94.8	Very high	92.3	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	103.1	172.2	-172.2	0	0	0	0	108.5	L554 L579 V611 K613 G614 S615	L554-V574 HydrophobicContact CD2-CB 4.19Å; L554-V574 HydrophobicContact CD2-CG1 4.12Å; L554-V574 HydrophobicContact CD2-CG2 3.84Å; V574-L579 HydrophobicContact CG2-CB 4.24Å; V574-L579 HydrophobicContact CG2-CD2 4.24Å; V574-V611 HydrophobicContact CG2-CG1 4Å; V574-K613 CarbonylContact O-C 3.59Å; V574-K613 WeakPolarHBondContact O-CA 3.3Å; V574-G614 PolarHBondContact O-N 2.99Å; V574-S615 PolarHBondContact N-O 3.42Å
575	E	92.7	Very high	92.6	Very high	65 Å²	65	28.6 Å²	28.6	30%	0.304	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	-36.6	-179	-65.9	-66.8	156.4	0	0	111.6	K553 R555 S573 K613	K553-E575 PolarHBondContact O-N 3.49Å; R555-E575 HydrophobicContact CB-CG 3.88Å; R555-E575 IonicContact CZ-OE1 3.43Å; R555-E575 IonicContact NE-OE1 2.82Å; R555-E575 PolarHBondContact NE-OE1 2.85Å; R555-E575 IonicContact NH2-OE1 3.14Å; R555-E575 PolarHBondContact NH2-OE1 2.82Å; R555-E575 VanDerWaalsContact NH2-OE1 3.14Å; S573-E575 PolarHBondContact O-N 3.33Å; S573-E575 PolarHBondContact OG-OE1 3.24Å; E575-K613 VanDerWaalsContact O-CD 3.25Å; E575-K613 WeakPolarHBondContact O-CD 3.4Å; E575-K613 WeakPolarHBondContact O-CE 3.37Å; E575-K613 VanDerWaalsContact O-CG 3.3Å; E575-K613 WeakPolarHBondContact O-CG 3.39Å; E575-K613 PolarHBondContact O-NZ 3.48Å
576	D	92.1	Very high	92.9	Very high	35 Å²	35	21.5 Å²	21.5	19%	0.187	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	154.8	176.7	-145.6	-5.4	0	0	0	113	C552 K553 K613 L669	C552-D576 WeakPolarHBondContact CA-O 3.43Å; K553-D576 HydrophobicContact CB-CB 4.2Å; K553-D576 PolarHBondContact N-O 2.93Å; K553-D576 PolarHBondContact O-N 3.35Å; D576-K613 IonicContact OD1-NZ 3.88Å; D576-L669 HydrophobicContact CB-CD1 4.45Å; D576-L669 HydrophobicContact CB-CD2 4.04Å
577	G	91.7	Very high	93.3	Very high	1 Å²	1	18.5 Å²	18.5	1%	0.01	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	76.5	-154.1	178.2	0	0	0	0	0	115.7	P551 K613	P551-G577 CarbonylContact O-C 3.55Å; P551-G577 VanDerWaalsContact O-CA 3.3Å; P551-G577 WeakPolarHBondContact O-CA 3.48Å; G577-K613 PolarHBondContact O-N 3.08Å
578	I	93.1	Very high	93.2	Very high	5 Å²	5	19 Å²	19	3%	0.026	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	117.1	-173.8	-45.7	174.6	0	0	0	109.5	F550 P551 K580 V611 R612	F550-I578 HydrophobicContact CB-CB 4.43Å; F550-I578 HydrophobicContact CD1-CD1 4.2Å; P551-I578 PolarHBondContact O-N 3.39Å; I578-K580 HydrophobicContact CG2-CG 4.25Å; I578-V611 WeakPolarHBondContact CA-O 3.48Å; I578-R612 VanDerWaalsContact CD1-CZ 3.45Å; I578-R612 VanDerWaalsContact CD1-NH1 3.3Å; I578-R612 HydrophobicContact CG1-CG 4.28Å; I578-R612 HydrophobicContact CG2-CG 4.39Å
579	L	93.7	Very high	93	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	127.8	172.6	-175	60.7	0	0	0	109.9	L554 V574 V598 I601 S610 V611 V617 I619	L554-L579 HydrophobicContact CD1-CD1 3.87Å; L554-L579 HydrophobicContact CD1-CD2 4.14Å; L554-L579 HydrophobicContact CD2-CB 4.36Å; L554-L579 HydrophobicContact CD2-CD1 4.25Å; L554-L579 HydrophobicContact CD2-CD2 3.93Å; L554-L579 HydrophobicContact CD2-CG 4.42Å; V574-L579 HydrophobicContact CG2-CB 4.24Å; V574-L579 HydrophobicContact CG2-CD2 4.24Å; L579-V598 HydrophobicContact CD1-CG2 4.16Å; L579-I601 HydrophobicContact CD2-CD1 4.23Å; L579-I601 HydrophobicContact CG-CD1 3.89Å; L579-S610 CarbonylContact O-C 3.58Å; L579-S610 VanDerWaalsContact O-CA 3.23Å; L579-S610 WeakPolarHBondContact O-CA 3.33Å; L579-V611 HydrophobicContact CB-CB 4.5Å; L579-V611 PolarHBondContact N-O 2.98Å; L579-V611 PolarHBondContact O-N 3.05Å; L579-V617 HydrophobicContact CD2-CG2 4.23Å; L579-I619 HydrophobicContact CD2-CG2 3.83Å
580	K	92.5	Very high	92.6	Very high	60 Å²	60	24.9 Å²	24.9	26%	0.261	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	156.1	174.4	-69.1	-168.4	178	173.5	0	111	F550 I578 V583 Q609	F550-K580 HydrophobicContact CD2-CD 3.68Å; F550-K580 HydrophobicContact CE2-CD 3.96Å; F550-K580 HydrophobicContact CG-CD 4.15Å; I578-K580 HydrophobicContact CG2-CG 4.25Å; K580-V583 HydrophobicContact CB-CG2 4.05Å; K580-V583 WeakPolarHBondContact O-CB 3.4Å; K580-V583 VanDerWaalsContact O-CG2 3.27Å; K580-V583 WeakPolarHBondContact O-CG2 3.47Å; K580-V583 PolarHBondContact O-N 3.05Å; K580-Q609 WeakPolarHBondContact CA-O 3.48Å
581	V	92.7	Very high	92.2	Very high	53 Å²	53	33.9 Å²	33.9	32%	0.321	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	138.7	168.5	-179.5	0	0	0	0	109.3	A599 I601 Q609	V581-A599 WeakPolarHBondContact CG1-O 3.32Å; V581-I601 HydrophobicContact CG2-CD1 4.07Å; V581-I601 HydrophobicContact CG2-CG1 4.11Å; V581-Q609 PolarHBondContact N-O 3.31Å
582	G	91.3	Very high	91.7	Very high	48 Å²	48	36.6 Å²	36.6	50%	0.495	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	90.9	-9.2	-177.2	0	0	0	0	0	115.2	P584 V598	G582-P584 WeakPolarHBondContact O-CD 3.44Å; G582-V598 WeakPolarHBondContact CA-O 3.37Å; G582-V598 PolarHBondContact N-O 3.03Å
583	V	92.5	Very high	91.5	Very high	5 Å²	5	38.2 Å²	38.2	3%	0.03	21%	0.212	C	C	.	.			trans	-66.4	126	-179.1	172.2	0	0	0	0	110.7	I549 K580 L585 T597 V598	I549-V583 HydrophobicContact CG2-CG1 4.26Å; K580-V583 HydrophobicContact CB-CG2 4.05Å; K580-V583 WeakPolarHBondContact O-CB 3.4Å; K580-V583 VanDerWaalsContact O-CG2 3.27Å; K580-V583 WeakPolarHBondContact O-CG2 3.47Å; K580-V583 PolarHBondContact O-N 3.05Å; V583-L585 HydrophobicContact CG1-CD2 4.2Å; V583-T597 WeakPolarHBondContact O-CA 3.44Å; V583-V598 PolarHBondContact O-N 2.85Å
584	P	93.4	Very high	91.3	Very high	20 Å²	20	38.8 Å²	38.8	13%	0.13	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	133	171.2	27.1	-30.7	0	0	0	110.9	I549 G582 F594 T597 S644 R645	I549-P584 HydrophobicContact CD1-CG 3.49Å; I549-P584 VanDerWaalsContact CD1-CG 3.49Å; I549-P584 HydrophobicContact CG1-CG 4.31Å; I549-P584 HydrophobicContact CG2-CG 4.45Å; G582-P584 WeakPolarHBondContact O-CD 3.44Å; P584-F594 HydrophobicContact CB-CE2 3.66Å; P584-F594 HydrophobicContact CB-CZ 4.41Å; P584-T597 HydrophobicContact CB-CG2 3.98Å; P584-S644 CarbonylContact O-C 3.38Å; P584-S644 WeakPolarHBondContact O-CA 3.38Å; P584-R645 HydrophobicContact CB-CB 4.11Å; P584-R645 HydrophobicContact CG-CB 4.11Å; P584-R645 PolarHBondContact O-N 3.45Å
585	L	94.3	Very high	91.1	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	141.5	-178.5	-64.1	177.3	0	0	0	111.9	L554 V583 F594 I595 G596 V598 I619 I621 L642 V643	L554-L585 HydrophobicContact CD1-CD1 3.97Å; L554-L585 HydrophobicContact CD1-CD2 3.89Å; V583-L585 HydrophobicContact CG1-CD2 4.2Å; L585-F594 WeakPolarHBondContact O-CD2 3.15Å; L585-I595 PolarHBondContact O-N 2.84Å; L585-G596 PolarHBondContact N-O 2.99Å; L585-V598 HydrophobicContact CD1-CG2 3.55Å; L585-V598 HydrophobicContact CG-CG2 3.94Å; L585-I619 HydrophobicContact CD1-CD1 3.89Å; L585-I621 HydrophobicContact CD1-CD1 3.95Å; L585-I621 HydrophobicContact CD1-CG1 4.24Å; L585-L642 HydrophobicContact CD1-CD1 4.32Å; L585-V643 WeakPolarHBondContact CA-O 3.13Å
586	C	93.2	Very high	91.1	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.007	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	164.2	173	59.8	0	0	0	0	112.4	L593 V643 F677	C586-L593 CarbonylContact C-O 3.58Å; C586-L593 WeakPolarHBondContact CA-O 3.19Å; C586-L593 VanDerWaalsContact CB-O 3.31Å; C586-L593 WeakPolarHBondContact CB-O 3.34Å; C586-V643 PolarHBondContact N-O 3.29Å; C586-V643 PolarHBondContact O-N 3.47Å; C586-F677 VanDerWaalsContact SG-CE1 3.53Å; C586-F677 WeakPolarHBondContact SG-CZ 3.19Å
587	V	93.3	Very high	91.1	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	107.6	178.8	-177.2	0	0	0	0	109.8	S589 K590 N592 L593 I595 F636 D640 L642	V587-S589 VanDerWaalsContact C-N 3.33Å; V587-S589 WeakPolarHBondContact CG1-OG 3.35Å; V587-S589 PolarHBondContact O-N 3.35Å; V587-K590 HydrophobicContact CB-CB 4.38Å; V587-K590 HydrophobicContact CB-CG 4.47Å; V587-K590 HydrophobicContact CG1-CB 4.07Å; V587-K590 HydrophobicContact CG1-CG 3.74Å; V587-K590 PolarHBondContact O-N 2.74Å; V587-N592 CarbonylContact O-C 3.49Å; V587-N592 VanDerWaalsContact O-CA 3.24Å; V587-N592 WeakPolarHBondContact O-CA 3.12Å; V587-N592 PolarHBondContact O-N 3.08Å; V587-L593 HydrophobicContact CB-CB 4.31Å; V587-L593 PolarHBondContact N-O 3.39Å; V587-L593 PolarHBondContact O-N 3.28Å; V587-L593 VanDerWaalsContact O-N 3.15Å; V587-I595 HydrophobicContact CG2-CD1 3.27Å; V587-I595 HydrophobicContact CG2-CG1 3.87Å; V587-F636 HydrophobicContact CG2-CB 3.91Å; V587-F636 HydrophobicContact CG2-CG 4.26Å; V587-D640 HydrophobicContact CG1-CB 3.66Å; V587-L642 HydrophobicContact CG2-CD2 3.73Å
588	P	88.9	Confident	91.2	Very high	38 Å²	38	35.5 Å²	35.5	25%	0.247	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-61.4	-37.5	-178.7	-28.7	39.1	0	0	0	114.3	K590 N592 F641 V643 V676	P588-K590 PolarHBondContact O-N 2.92Å; P588-N592 WeakPolarHBondContact CA-OD1 3Å; P588-F641 WeakPolarHBondContact CD-O 3.44Å; P588-V643 HydrophobicContact CG-CB 4.3Å; P588-V643 HydrophobicContact CG-CG1 3.9Å; P588-V643 HydrophobicContact CG-CG2 3.4Å; P588-V643 VanDerWaalsContact CG-CG2 3.4Å; P588-V676 HydrophobicContact CB-CG1 3.66Å; P588-V676 HydrophobicContact CG-CG1 4.02Å
589	S	88.5	Confident	91.3	Very high	76 Å²	76	36.9 Å²	36.9	53%	0.531	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-66.7	-15.6	-177.5	47	0	0	0	0	114.2	V587 D640	V587-S589 VanDerWaalsContact C-N 3.33Å; V587-S589 WeakPolarHBondContact CG1-OG 3.35Å; V587-S589 PolarHBondContact O-N 3.35Å; S589-D640 PolarHBondContact OG-OD1 3.25Å
590	K	86.4	Confident	91.3	Very high	99 Å²	99	38.1 Å²	38.1	43%	0.43	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-118.6	53.7	-175.5	-56.5	-65.4	-176.3	-177.4	0	110.5	V587 P588 N592 L593 D640	V587-K590 HydrophobicContact CB-CB 4.38Å; V587-K590 HydrophobicContact CB-CG 4.47Å; V587-K590 HydrophobicContact CG1-CB 4.07Å; V587-K590 HydrophobicContact CG1-CG 3.74Å; V587-K590 PolarHBondContact O-N 2.74Å; P588-K590 PolarHBondContact O-N 2.92Å; K590-N592 VanDerWaalsContact C-N 3.3Å; K590-N592 PolarHBondContact O-N 3.25Å; K590-L593 HydrophobicContact CB-CB 3.96Å; K590-L593 VanDerWaalsContact O-CB 3.26Å; K590-L593 WeakPolarHBondContact O-CB 3.42Å; K590-L593 PolarHBondContact O-N 3.47Å; K590-L593 VanDerWaalsContact O-N 3.08Å; K590-D640 WeakPolarHBondContact CE-OD2 3.29Å
591	E	85.5	Confident	91.5	Very high	189 Å²	189	35.3 Å²	35.3	88%	0.883	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.6	41.8	-179.1	-59.3	179.3	173	0	0	113	L593	E591-L593 PolarHBondContact O-N 3.38Å
592	N	85.2	Confident	91.6	Very high	62 Å²	62	36.3 Å²	36.3	33%	0.332	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.2	37.5	-176.6	-64.8	-42.6	0	0	0	113.5	V587 P588 K590 F594 F677	V587-N592 CarbonylContact O-C 3.49Å; V587-N592 VanDerWaalsContact O-CA 3.24Å; V587-N592 WeakPolarHBondContact O-CA 3.12Å; V587-N592 PolarHBondContact O-N 3.08Å; P588-N592 WeakPolarHBondContact CA-OD1 3Å; K590-N592 VanDerWaalsContact C-N 3.3Å; K590-N592 PolarHBondContact O-N 3.25Å; N592-F594 PolarHBondContact O-N 3.48Å; N592-F594 VanDerWaalsContact O-N 3.1Å; N592-F677 HydrophobicContact CB-CD1 4.4Å; N592-F677 HydrophobicContact CB-CE1 4.17Å; N592-F677 WeakPolarHBondContact OD1-CE1 3.29Å
593	L	89.7	Confident	91.6	Very high	34 Å²	34	37.2 Å²	37.2	18%	0.178	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.3	116.3	-179.1	179.6	72	0	0	0	111.4	C586 V587 K590 E591 K630 H635	C586-L593 CarbonylContact C-O 3.58Å; C586-L593 WeakPolarHBondContact CA-O 3.19Å; C586-L593 VanDerWaalsContact CB-O 3.31Å; C586-L593 WeakPolarHBondContact CB-O 3.34Å; V587-L593 HydrophobicContact CB-CB 4.31Å; V587-L593 PolarHBondContact N-O 3.39Å; V587-L593 PolarHBondContact O-N 3.28Å; V587-L593 VanDerWaalsContact O-N 3.15Å; K590-L593 HydrophobicContact CB-CB 3.96Å; K590-L593 VanDerWaalsContact O-CB 3.26Å; K590-L593 WeakPolarHBondContact O-CB 3.42Å; K590-L593 PolarHBondContact O-N 3.47Å; K590-L593 VanDerWaalsContact O-N 3.08Å; E591-L593 PolarHBondContact O-N 3.38Å; L593-K630 HydrophobicContact CD1-CD 3.99Å; L593-K630 HydrophobicContact CD1-CG 4.37Å; L593-H635 HydrophobicContact CD2-CB 3.77Å
594	F	91.1	Very high	91.4	Very high	23 Å²	23	43.9 Å²	43.9	10%	0.101	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	126.3	173.3	-178.4	-107.7	0	0	0	110.9	P584 L585 N592 T597 T625 K630	P584-F594 HydrophobicContact CB-CE2 3.66Å; P584-F594 HydrophobicContact CB-CZ 4.41Å; L585-F594 WeakPolarHBondContact O-CD2 3.15Å; N592-F594 PolarHBondContact O-N 3.48Å; N592-F594 VanDerWaalsContact O-N 3.1Å; F594-T597 HydrophobicContact CZ-CG2 4.39Å; F594-T625 HydrophobicContact CD1-CG2 3.8Å; F594-T625 HydrophobicContact CE1-CG2 3.41Å; F594-T625 VanDerWaalsContact CE1-CG2 3.41Å; F594-T625 HydrophobicContact CZ-CG2 4.26Å; F594-K630 WeakPolarHBondContact O-CG 3.48Å
595	I	91	Very high	91	Very high	3 Å²	3	51.8 Å²	51.8	2%	0.015	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	-36.6	-179.2	-60.5	162.5	0	0	0	111.4	I568 L585 V587 I621 F636 L642	I568-I595 HydrophobicContact CD1-CG2 3.71Å; L585-I595 PolarHBondContact O-N 2.84Å; V587-I595 HydrophobicContact CG2-CD1 3.27Å; V587-I595 HydrophobicContact CG2-CG1 3.87Å; I595-I621 HydrophobicContact CG2-CD1 4.34Å; I595-I621 HydrophobicContact CG2-CG2 4.05Å; I595-F636 HydrophobicContact CD1-CD1 4.18Å; I595-F636 HydrophobicContact CD1-CD2 4.05Å; I595-F636 HydrophobicContact CD1-CE1 4.13Å; I595-F636 HydrophobicContact CD1-CE2 3.97Å; I595-F636 HydrophobicContact CD1-CG 4.15Å; I595-F636 HydrophobicContact CD1-CZ 4.01Å; I595-F636 HydrophobicContact CG1-CD1 4.09Å; I595-F636 HydrophobicContact CG1-CE1 4Å; I595-F636 HydrophobicContact CG1-CZ 4.32Å; I595-F636 HydrophobicContact CG2-CE1 3.76Å; I595-F636 HydrophobicContact CG2-CZ 3.77Å; I595-L642 HydrophobicContact CD1-CD1 4.46Å; I595-L642 HydrophobicContact CD1-CD2 3.35Å; I595-L642 HydrophobicContact CD1-CG 4.44Å
596	G	92.1	Very high	90.9	Very high	0 Å²	0	59 Å²	59	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	147.7	-167.7	-174.4	0	0	0	0	0	112	L585 E622	L585-G596 PolarHBondContact N-O 2.99Å; G596-E622 CarbonylContact C-O 3.51Å; G596-E622 VanDerWaalsContact CA-O 3.24Å; G596-E622 WeakPolarHBondContact CA-O 3.45Å
597	T	93.1	Very high	90.9	Very high	27 Å²	27	66.1 Å²	66.1	17%	0.166	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	145.7	178.5	47.3	0	0	0	0	111.2	V583 P584 F594 A599 I621 E622 T624	V583-T597 WeakPolarHBondContact O-CA 3.44Å; P584-T597 HydrophobicContact CB-CG2 3.98Å; F594-T597 HydrophobicContact CZ-CG2 4.39Å; T597-A599 PolarHBondContact O-N 3.32Å; T597-I621 WeakPolarHBondContact O-CA 3.35Å; T597-E622 PolarHBondContact N-O 3.07Å; T597-E622 PolarHBondContact O-N 3.41Å; T597-T624 HydrophobicContact CG2-CG2 4.35Å; T597-T624 WeakPolarHBondContact CG2-OG1 3.07Å; T597-T624 WeakPolarHBondContact OG1-CG2 3.42Å; T597-T624 PolarHBondContact OG1-OG1 2.66Å
598	V	94.7	Very high	90.8	Very high	2 Å²	2	68.8 Å²	68.8	1%	0.012	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	112.4	176.8	-179.5	0	0	0	0	110	L579 G582 V583 L585 I601 I619 K620	L579-V598 HydrophobicContact CD1-CG2 4.16Å; G582-V598 WeakPolarHBondContact CA-O 3.37Å; G582-V598 PolarHBondContact N-O 3.03Å; V583-V598 PolarHBondContact O-N 2.85Å; L585-V598 HydrophobicContact CD1-CG2 3.55Å; L585-V598 HydrophobicContact CG-CG2 3.94Å; V598-I601 HydrophobicContact CG1-CD1 4.27Å; V598-I601 HydrophobicContact CG1-CG1 3.68Å; V598-I619 HydrophobicContact CG1-CB 4.43Å; V598-I619 HydrophobicContact CG1-CG2 4.4Å; V598-K620 CarbonylContact C-O 3.53Å
599	A	94.1	Very high	90.9	Very high	35 Å²	35	73.6 Å²	73.6	29%	0.289	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	-38.8	179.5	0	0	0	0	0	112.8	V581 T597 K620 E622	V581-A599 WeakPolarHBondContact CG1-O 3.32Å; T597-A599 PolarHBondContact O-N 3.32Å; A599-K620 HydrophobicContact CB-CB 4.48Å; A599-K620 HydrophobicContact CB-CD 4.22Å; A599-K620 HydrophobicContact CB-CG 4.39Å; A599-K620 PolarHBondContact N-O 2.6Å; A599-E622 HydrophobicContact CB-CB 4.31Å; A599-E622 HydrophobicContact CB-CG 3.87Å
600	S	94.9	Very high	91.1	Very high	26 Å²	26	73.1 Å²	73.1	18%	0.182	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	153	175.5	65.5	0	0	0	0	111.4	I619 K620	S600-I619 WeakPolarHBondContact O-CA 3.3Å; S600-K620 PolarHBondContact O-N 3.45Å; S600-K620 VanDerWaalsContact OG-CB 3.31Å; S600-K620 WeakPolarHBondContact OG-CB 3.16Å
601	I	95.6	Very high	91.4	Very high	1 Å²	1	68.8 Å²	68.8	1%	0.005	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	126.6	174.5	-52.5	168.1	0	0	0	107.4	L579 V581 V598 E607 L608 V611 V617 C618 I619	L579-I601 HydrophobicContact CD2-CD1 4.23Å; L579-I601 HydrophobicContact CG-CD1 3.89Å; V581-I601 HydrophobicContact CG2-CD1 4.07Å; V581-I601 HydrophobicContact CG2-CG1 4.11Å; V598-I601 HydrophobicContact CG1-CD1 4.27Å; V598-I601 HydrophobicContact CG1-CG1 3.68Å; I601-E607 WeakPolarHBondContact O-CA 3.34Å; I601-L608 HydrophobicContact CG2-CB 4.46Å; I601-L608 PolarHBondContact O-N 2.78Å; I601-V611 HydrophobicContact CG2-CG2 3.71Å; I601-V617 HydrophobicContact CG2-CB 3.82Å; I601-V617 HydrophobicContact CG2-CG1 4.28Å; I601-V617 HydrophobicContact CG2-CG2 3.73Å; I601-C618 WeakPolarHBondContact CA-O 3.4Å; I601-I619 HydrophobicContact CG1-CG2 4.15Å; I601-I619 HydrophobicContact CG2-CG2 4.29Å
602	E	94.5	Very high	91.7	Very high	73 Å²	73	64.7 Å²	64.7	34%	0.341	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	134.2	-179.4	-72.2	177.6	-152.4	0	0	110.9	K606 E607 C618	E602-K606 WeakPolarHBondContact CA-O 3.46Å; E602-E607 HydrophobicContact CG-CG 4.19Å; E602-C618 PolarHBondContact N-O 3.04Å; E602-C618 PolarHBondContact O-N 2.85Å
603	Q	92.2	Very high	92	Very high	68 Å²	68	68 Å²	68	32%	0.318	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	117.7	170.4	-164.8	176.2	30.4	0	0	108.7	H605 K606 L608 E616 V617	Q603-H605 VanDerWaalsContact C-N 3.31Å; Q603-H605 PolarHBondContact O-N 2.82Å; Q603-K606 PolarHBondContact N-O 3.36Å; Q603-K606 WeakPolarHBondContact O-CB 3.49Å; Q603-K606 PolarHBondContact O-N 2.83Å; Q603-L608 HydrophobicContact CB-CD1 3.65Å; Q603-E616 PolarHBondContact NE2-O 3.48Å; Q603-V617 HydrophobicContact CB-CG1 3.93Å; Q603-V617 HydrophobicContact CG-CG1 4.06Å
604	N	87.5	Confident	92.1	Very high	145 Å²	145	69.5 Å²	69.5	78%	0.775	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	47.3	179.4	-57.7	-35.2	0	0	0	113.3	K606	N604-K606 PolarHBondContact O-N 3.34Å
605	H	85.4	Confident	92.1	Very high	186 Å²	186	70 Å²	70	86%	0.861	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.4	16.6	-176.9	-53.7	-70	0	0	0	115.8	Q603	Q603-H605 VanDerWaalsContact C-N 3.31Å; Q603-H605 PolarHBondContact O-N 2.82Å
606	K	91.6	Very high	92.3	Very high	152 Å²	152	75.3 Å²	75.3	66%	0.661	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.5	125.4	169.3	-64.9	-179.7	-179.7	179.9	0	109.7	E602 Q603 N604	E602-K606 WeakPolarHBondContact CA-O 3.46Å; Q603-K606 PolarHBondContact N-O 3.36Å; Q603-K606 WeakPolarHBondContact O-CB 3.49Å; Q603-K606 PolarHBondContact O-N 2.83Å; N604-K606 PolarHBondContact O-N 3.34Å
607	E	92.9	Very high	92.5	Very high	150 Å²	150	75.6 Å²	75.6	70%	0.701	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.5	132.2	172.3	-68	-177.5	176.6	0	0	110.3	I601 E602	I601-E607 WeakPolarHBondContact O-CA 3.34Å; E602-E607 HydrophobicContact CG-CG 4.19Å
608	L	92	Very high	92.6	Very high	55 Å²	55	75.7 Å²	75.7	29%	0.288	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	143.9	179.1	-63.8	175.7	0	0	0	109.9	I601 Q603 V611	I601-L608 HydrophobicContact CG2-CB 4.46Å; I601-L608 PolarHBondContact O-N 2.78Å; Q603-L608 HydrophobicContact CB-CD1 3.65Å; L608-V611 HydrophobicContact CB-CG2 4.16Å; L608-V611 HydrophobicContact CD1-CG2 3.84Å
609	Q	91.3	Very high	92.6	Very high	140 Å²	140	75.7 Å²	75.7	65%	0.654	39%	0.392	S	S	*	.	S	Bend	trans	-88.2	-28.4	175.9	-66.6	-62.8	-29.3	0	0	112.3	K580 V581	K580-Q609 WeakPolarHBondContact CA-O 3.48Å; V581-Q609 PolarHBondContact N-O 3.31Å
610	S	91.7	Very high	92.7	Very high	65 Å²	65	77 Å²	77	46%	0.455	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	148.9	-178.9	65.6	0	0	0	0	112	L579	L579-S610 CarbonylContact O-C 3.58Å; L579-S610 VanDerWaalsContact O-CA 3.23Å; L579-S610 WeakPolarHBondContact O-CA 3.33Å
611	V	93.5	Very high	92.6	Very high	9 Å²	9	75.8 Å²	75.8	6%	0.055	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	137.3	-177.4	-176.7	0	0	0	0	109.2	V574 I578 L579 I601 L608 V617	V574-V611 HydrophobicContact CG2-CG1 4Å; I578-V611 WeakPolarHBondContact CA-O 3.48Å; L579-V611 HydrophobicContact CB-CB 4.5Å; L579-V611 PolarHBondContact N-O 2.98Å; L579-V611 PolarHBondContact O-N 3.05Å; I601-V611 HydrophobicContact CG2-CG2 3.71Å; L608-V611 HydrophobicContact CB-CG2 4.16Å; L608-V611 HydrophobicContact CD1-CG2 3.84Å; V611-V617 HydrophobicContact CG1-CG1 3.89Å; V611-V617 HydrophobicContact CG1-CG2 4.42Å; V611-V617 HydrophobicContact CG2-CG1 3.98Å; V611-V617 HydrophobicContact CG2-CG2 4.48Å
612	R	92.6	Very high	92.5	Very high	102 Å²	102	79.1 Å²	79.1	39%	0.385	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	169.6	178.3	-71.2	-169.4	174	-94.1	-0.9	111.7	I578 S615 D661 D666	I578-R612 VanDerWaalsContact CD1-CZ 3.45Å; I578-R612 VanDerWaalsContact CD1-NH1 3.3Å; I578-R612 HydrophobicContact CG1-CG 4.28Å; I578-R612 HydrophobicContact CG2-CG 4.39Å; R612-S615 PolarHBondContact O-N 2.76Å; R612-S615 PolarHBondContact O-OG 3.07Å; R612-D661 PolarHBondContact NH2-O 3.49Å; R612-D666 IonicContact NH1-OD2 2.92Å; R612-D666 PolarHBondContact NH1-OD2 3.4Å
613	K	91.6	Very high	92.2	Very high	132 Å²	132	77.4 Å²	77.4	57%	0.574	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-38.4	137.7	172.6	177.7	170.6	-173.9	160	0	114.1	V574 E575 D576 G577	V574-K613 CarbonylContact O-C 3.59Å; V574-K613 WeakPolarHBondContact O-CA 3.3Å; E575-K613 VanDerWaalsContact O-CD 3.25Å; E575-K613 WeakPolarHBondContact O-CD 3.4Å; E575-K613 WeakPolarHBondContact O-CE 3.37Å; E575-K613 VanDerWaalsContact O-CG 3.3Å; E575-K613 WeakPolarHBondContact O-CG 3.39Å; E575-K613 PolarHBondContact O-NZ 3.48Å; D576-K613 IonicContact OD1-NZ 3.88Å; G577-K613 PolarHBondContact O-N 3.08Å
614	G	90.5	Very high	91.7	Very high	65 Å²	65	78.3 Å²	78.3	67%	0.67	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.9	-2.2	176.1	0	0	0	0	0	114.8	V574	V574-G614 PolarHBondContact O-N 2.99Å
615	S	92.3	Very high	91.2	Very high	35 Å²	35	73.3 Å²	73.3	25%	0.245	38%	0.376	C	S	.	.			trans	-95.4	136.4	178.1	-54.8	0	0	0	0	111.2	V574 R612	V574-S615 PolarHBondContact N-O 3.42Å; R612-S615 PolarHBondContact O-N 2.76Å; R612-S615 PolarHBondContact O-OG 3.07Å
616	E	94.3	Very high	90.8	Very high	114 Å²	114	69 Å²	69	53%	0.533	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	122.8	169.9	-63.1	-177.4	166.1	0	0	109.2	L557 V572 Q603	L557-E616 HydrophobicContact CD1-CB 4.41Å; L557-E616 HydrophobicContact CD1-CG 4.44Å; V572-E616 WeakPolarHBondContact O-CA 3.49Å; Q603-E616 PolarHBondContact NE2-O 3.48Å
617	V	95.3	Very high	90.3	Very high	6 Å²	6	67.1 Å²	67.1	4%	0.036	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	152.3	-174.7	-63.8	0	0	0	0	111.2	V572 L579 I601 Q603 V611 I619	V572-V617 HydrophobicContact CG2-CG2 4.02Å; V572-V617 WeakPolarHBondContact CG2-O 3.13Å; V572-V617 PolarHBondContact N-O 2.91Å; V572-V617 PolarHBondContact O-N 3.34Å; L579-V617 HydrophobicContact CD2-CG2 4.23Å; I601-V617 HydrophobicContact CG2-CB 3.82Å; I601-V617 HydrophobicContact CG2-CG1 4.28Å; I601-V617 HydrophobicContact CG2-CG2 3.73Å; Q603-V617 HydrophobicContact CB-CG1 3.93Å; Q603-V617 HydrophobicContact CG-CG1 4.06Å; V611-V617 HydrophobicContact CG1-CG1 3.89Å; V611-V617 HydrophobicContact CG1-CG2 4.42Å; V611-V617 HydrophobicContact CG2-CG1 3.98Å; V611-V617 HydrophobicContact CG2-CG2 4.48Å; V617-I619 HydrophobicContact CG2-CG2 4.25Å
618	C	95.3	Very high	89.9	Confident	29 Å²	29	63.6 Å²	63.6	20%	0.196	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	131.3	170.5	-171.4	0	0	0	0	109.1	I569 I601 E602	I569-C618 VanDerWaalsContact CG2-SG 3.56Å; I601-C618 WeakPolarHBondContact CA-O 3.4Å; E602-C618 PolarHBondContact N-O 3.04Å; E602-C618 PolarHBondContact O-N 2.85Å
619	I	95.9	Very high	89.5	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.005	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	142.2	175.9	60.2	171.4	0	0	0	111.4	L554 I569 V570 V572 L579 L585 V598 S600 I601 V617 I621	L554-I619 HydrophobicContact CD1-CD1 4.17Å; I569-I619 WeakPolarHBondContact CA-O 3.44Å; V570-I619 HydrophobicContact CG2-CD1 4.22Å; V570-I619 HydrophobicContact CG2-CG1 3.78Å; V570-I619 PolarHBondContact N-O 3.31Å; V570-I619 VanDerWaalsContact N-O 3.1Å; V570-I619 PolarHBondContact O-N 2.72Å; V572-I619 HydrophobicContact CB-CD1 4.46Å; V572-I619 HydrophobicContact CG1-CD1 3.74Å; V572-I619 HydrophobicContact CG1-CG1 3.95Å; V572-I619 HydrophobicContact CG2-CB 4.48Å; V572-I619 HydrophobicContact CG2-CD1 3.87Å; V572-I619 HydrophobicContact CG2-CG1 3.89Å; V572-I619 HydrophobicContact CG2-CG2 3.83Å; L579-I619 HydrophobicContact CD2-CG2 3.83Å; L585-I619 HydrophobicContact CD1-CD1 3.89Å; V598-I619 HydrophobicContact CG1-CB 4.43Å; V598-I619 HydrophobicContact CG1-CG2 4.4Å; S600-I619 WeakPolarHBondContact O-CA 3.3Å; I601-I619 HydrophobicContact CG1-CG2 4.15Å; I601-I619 HydrophobicContact CG2-CG2 4.29Å; V617-I619 HydrophobicContact CG2-CG2 4.25Å; I619-I621 HydrophobicContact CD1-CD1 3.85Å; I619-I621 HydrophobicContact CD1-CG1 3.91Å; I619-I621 HydrophobicContact CG1-CD1 4.41Å; I619-I621 HydrophobicContact CG1-CG1 4.2Å
620	K	95.1	Very high	89.4	Confident	63 Å²	63	58.1 Å²	58.1	27%	0.274	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	119.1	168.8	-171.9	-171.2	-175.7	-155.4	0	108.4	P567 I568 I569 V598 A599 S600 E622	P567-K620 HydrophobicContact CB-CD 4.23Å; P567-K620 VanDerWaalsContact CB-CE 3.46Å; P567-K620 HydrophobicContact CB-CG 3.72Å; I568-K620 CarbonylContact O-C 3.52Å; I568-K620 WeakPolarHBondContact O-CA 3.26Å; I569-K620 HydrophobicContact CG1-CG 4.24Å; V598-K620 CarbonylContact C-O 3.53Å; A599-K620 HydrophobicContact CB-CB 4.48Å; A599-K620 HydrophobicContact CB-CD 4.22Å; A599-K620 HydrophobicContact CB-CG 4.39Å; A599-K620 PolarHBondContact N-O 2.6Å; S600-K620 PolarHBondContact O-N 3.45Å; S600-K620 VanDerWaalsContact OG-CB 3.31Å; S600-K620 WeakPolarHBondContact OG-CB 3.16Å; K620-E622 WeakPolarHBondContact CE-OE1 3.3Å; K620-E622 IonicContact NZ-OE1 2.8Å; K620-E622 PolarHBondContact NZ-OE1 3.19Å
621	I	94.2	Very high	89.2	Confident	1 Å²	1	58.2 Å²	58.2	1%	0.005	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	123.1	178.8	-49.6	169.8	0	0	0	108.3	P567 I568 V570 L585 I595 T597 I619 L642	P567-I621 CarbonylContact C-O 3.45Å; P567-I621 WeakPolarHBondContact CA-O 3.34Å; I568-I621 HydrophobicContact CB-CB 4.25Å; I568-I621 PolarHBondContact N-O 2.89Å; I568-I621 PolarHBondContact O-N 2.69Å; V570-I621 HydrophobicContact CG2-CD1 4.18Å; L585-I621 HydrophobicContact CD1-CD1 3.95Å; L585-I621 HydrophobicContact CD1-CG1 4.24Å; I595-I621 HydrophobicContact CG2-CD1 4.34Å; I595-I621 HydrophobicContact CG2-CG2 4.05Å; T597-I621 WeakPolarHBondContact O-CA 3.35Å; I619-I621 HydrophobicContact CD1-CD1 3.85Å; I619-I621 HydrophobicContact CD1-CG1 3.91Å; I619-I621 HydrophobicContact CG1-CD1 4.41Å; I619-I621 HydrophobicContact CG1-CG1 4.2Å; I621-L642 HydrophobicContact CD1-CD1 4.36Å
622	E	92.6	Very high	88.9	Confident	70 Å²	70	59.4 Å²	59.4	33%	0.327	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	141.7	178.1	-76.7	178.2	-178.1	0	0	110.6	P567 G596 T597 A599 K620 T624	P567-E622 HydrophobicContact CB-CG 3.88Å; G596-E622 CarbonylContact C-O 3.51Å; G596-E622 VanDerWaalsContact CA-O 3.24Å; G596-E622 WeakPolarHBondContact CA-O 3.45Å; T597-E622 PolarHBondContact N-O 3.07Å; T597-E622 PolarHBondContact O-N 3.41Å; A599-E622 HydrophobicContact CB-CB 4.31Å; A599-E622 HydrophobicContact CB-CG 3.87Å; K620-E622 WeakPolarHBondContact CE-OE1 3.3Å; K620-E622 IonicContact NZ-OE1 2.8Å; K620-E622 PolarHBondContact NZ-OE1 3.19Å; E622-T624 PolarHBondContact O-N 2.82Å
623	N	89.3	Confident	88.7	Confident	37 Å²	37	57.4 Å²	57.4	20%	0.198	36%	0.358	C	S	.	.			trans	-78.2	109.2	174.6	-174.1	23.6	0	0	0	110.5	D566 T625 E627 P629	D566-N623 PolarHBondContact OD1-N 3.28Å; N623-T625 VanDerWaalsContact CG-O 3.29Å; N623-T625 PolarHBondContact ND2-O 3.25Å; N623-T625 PolarHBondContact OD1-N 3.11Å; N623-T625 PolarHBondContact OD1-O 2.82Å; N623-T625 VanDerWaalsContact OD1-O 3.12Å; N623-T625 PolarHBondContact OD1-OG1 2.83Å; N623-E627 PolarHBondContact ND2-O 2.88Å; N623-P629 HydrophobicContact CB-CB 4.37Å
624	T	81	Confident	88.5	Confident	88 Å²	88	60.5 Å²	60.5	54%	0.54	37%	0.366	S	S	.	.			trans	-95.7	-10.4	177.2	40.2	0	0	0	0	113.4	T597 E622	T597-T624 HydrophobicContact CG2-CG2 4.35Å; T597-T624 WeakPolarHBondContact CG2-OG1 3.07Å; T597-T624 WeakPolarHBondContact OG1-CG2 3.42Å; T597-T624 PolarHBondContact OG1-OG1 2.66Å; E622-T624 PolarHBondContact O-N 2.82Å
625	T	77.7	Confident	88.5	Confident	39 Å²	39	60.5 Å²	60.5	24%	0.239	35%	0.348	C	S	.	.	S	Bend	trans	-90.5	137.7	173	56.8	0	0	0	0	108.6	F594 N623 E627	F594-T625 HydrophobicContact CD1-CG2 3.8Å; F594-T625 HydrophobicContact CE1-CG2 3.41Å; F594-T625 VanDerWaalsContact CE1-CG2 3.41Å; F594-T625 HydrophobicContact CZ-CG2 4.26Å; N623-T625 VanDerWaalsContact CG-O 3.29Å; N623-T625 PolarHBondContact ND2-O 3.25Å; N623-T625 PolarHBondContact OD1-N 3.11Å; N623-T625 PolarHBondContact OD1-O 2.82Å; N623-T625 VanDerWaalsContact OD1-O 3.12Å; N623-T625 PolarHBondContact OD1-OG1 2.83Å; T625-E627 PolarHBondContact O-N 2.66Å
626	G	75.2	Confident	88.4	Confident	97 Å²	97	59 Å²	59	100%	1	34%	0.337	S	S	*	.	S	Bend	trans	-63.6	7.4	176.3	0	0	0	0	0	114.7
627	E	82.3	Confident	88.2	Confident	111 Å²	111	56 Å²	56	52%	0.519	33%	0.325	S	S	.	.	S	Bend	trans	-71.3	163.2	173.6	-64.1	-177.1	-167.8	0	0	111.5	N623 T625 K630	N623-E627 PolarHBondContact ND2-O 2.88Å; T625-E627 PolarHBondContact O-N 2.66Å; E627-K630 IonicContact OE2-NZ 3.86Å
628	A	84.6	Confident	88	Confident	77 Å²	77	60.6 Å²	60.6	64%	0.636	34%	0.342	S	S	*	.	P	Polyproline II helix	trans	-61.2	131.8	175	0	0	0	0	0	110.9	K630	A628-K630 PolarHBondContact O-N 2.7Å
629	P	84	Confident	87.8	Confident	38 Å²	38	65.7 Å²	65.7	25%	0.247	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-62.3	134.2	-176	24.3	-33.7	0	0	0	110.8	D566 N623	D566-P629 HydrophobicContact CB-CB 3.73Å; D566-P629 HydrophobicContact CB-CG 4.46Å; N623-P629 HydrophobicContact CB-CB 4.37Å
630	K	87.6	Confident	87.6	Confident	42 Å²	42	66.2 Å²	66.2	18%	0.183	37%	0.366	C	S	.	.	P	Polyproline II helix	trans	-71.9	156.4	174.4	-49.4	-52.7	175.9	-175.7	0	109.8	L593 F594 E627 A628 H635	L593-K630 HydrophobicContact CD1-CD 3.99Å; L593-K630 HydrophobicContact CD1-CG 4.37Å; F594-K630 WeakPolarHBondContact O-CG 3.48Å; E627-K630 IonicContact OE2-NZ 3.86Å; A628-K630 PolarHBondContact O-N 2.7Å; K630-H635 HydrophobicContact CB-CB 4.4Å
631	M	87.6	Confident	87.5	Confident	66 Å²	66	67.6 Å²	67.6	33%	0.325	37%	0.372	S	S	.	.	B	Isolated β-bridge	trans	-129.2	127.4	-174.2	-178.1	-171.7	-70.3	0	0	109.2	S564 R634 H635	S564-M631 WeakPolarHBondContact O-CA 3.35Å; M631-R634 HydrophobicContact CB-CB 4.39Å; M631-R634 PolarHBondContact O-N 2.69Å; M631-R634 HydrophobicContact SD-CB 4.36Å; M631-H635 PolarHBondContact N-ND1 2.81Å; M631-H635 PolarHBondContact O-N 3.01Å; M631-H635 PolarHBondContact O-ND1 2.81Å
632	Y	88.4	Confident	87.5	Confident	34 Å²	34	67.6 Å²	67.6	13%	0.133	37%	0.372	C	S	.	.	B	Isolated β-bridge	trans	-62.8	136.4	172.6	-179.8	-88.8	0	0	0	110.3	I556 V561 S564 R634 F636 Y638	I556-Y632 HydrophobicContact CD1-CD2 4.34Å; I556-Y632 HydrophobicContact CD1-CE2 3.99Å; I556-Y632 HydrophobicContact CG2-CE2 4.08Å; V561-Y632 HydrophobicContact CB-CD1 4.44Å; V561-Y632 HydrophobicContact CB-CE1 4.27Å; V561-Y632 HydrophobicContact CG1-CD1 3.72Å; V561-Y632 HydrophobicContact CG1-CE1 4.05Å; V561-Y632 HydrophobicContact CG1-CG 4.07Å; V561-Y632 HydrophobicContact CG2-CD1 4.18Å; V561-Y632 HydrophobicContact CG2-CE1 3.68Å; V561-Y632 HydrophobicContact CG2-CE2 4.08Å; S564-Y632 PolarHBondContact O-N 2.99Å; Y632-R634 VanDerWaalsContact C-N 3.28Å; Y632-R634 PolarHBondContact O-N 2.94Å; Y632-F636 HydrophobicContact CD2-CD2 4.04Å; Y632-F636 AromaticContact CD2-CE2 3.67Å; Y632-F636 HydrophobicContact CD2-CE2 3.67Å; Y632-F636 HydrophobicContact CD2-CZ 4.17Å; Y632-F636 HydrophobicContact CE2-CE2 4.47Å; Y632-Y638 WeakPolarHBondContact OH-CB 3.17Å; Y632-Y638 PolarHBondContact OH-N 2.91Å
633	G	88	Confident	87.5	Confident	61 Å²	61	64.4 Å²	64.4	63%	0.629	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.1	-15.2	-176.4	0	0	0	0	0	114.7	F636	G633-F636 PolarHBondContact N-O 3.05Å
634	R	87.5	Confident	87.8	Confident	197 Å²	197	62.7 Å²	62.7	74%	0.743	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.1	-46.9	172.9	-176.6	175	177.5	177	-0.5	112.7	M631 Y632	M631-R634 HydrophobicContact CB-CB 4.39Å; M631-R634 PolarHBondContact O-N 2.69Å; M631-R634 HydrophobicContact SD-CB 4.36Å; Y632-R634 VanDerWaalsContact C-N 3.28Å; Y632-R634 PolarHBondContact O-N 2.94Å
635	H	89.6	Confident	88.3	Confident	65 Å²	65	64.6 Å²	64.6	30%	0.301	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.2	-32.3	-174.4	-55.7	93.9	0	0	0	112.9	L593 K630 M631	L593-H635 HydrophobicContact CD2-CB 3.77Å; K630-H635 HydrophobicContact CB-CB 4.4Å; M631-H635 PolarHBondContact N-ND1 2.81Å; M631-H635 PolarHBondContact O-N 3.01Å; M631-H635 PolarHBondContact O-ND1 2.81Å
636	F	91.3	Very high	88.9	Confident	4 Å²	4	63.3 Å²	63.3	2%	0.018	34%	0.337	C	S	.	.	B	Isolated β-bridge	trans	-149.8	156.2	175.8	69.1	-79.4	0	0	0	109.1	I556 I568 V587 I595 Y632 G633 D640 L642	I556-F636 HydrophobicContact CD1-CD2 3.81Å; I556-F636 HydrophobicContact CD1-CE2 3.66Å; I568-F636 HydrophobicContact CD1-CE1 3.98Å; I568-F636 HydrophobicContact CD1-CZ 3.89Å; I568-F636 HydrophobicContact CG2-CZ 4.42Å; V587-F636 HydrophobicContact CG2-CB 3.91Å; V587-F636 HydrophobicContact CG2-CG 4.26Å; I595-F636 HydrophobicContact CD1-CD1 4.18Å; I595-F636 HydrophobicContact CD1-CD2 4.05Å; I595-F636 HydrophobicContact CD1-CE1 4.13Å; I595-F636 HydrophobicContact CD1-CE2 3.97Å; I595-F636 HydrophobicContact CD1-CG 4.15Å; I595-F636 HydrophobicContact CD1-CZ 4.01Å; I595-F636 HydrophobicContact CG1-CD1 4.09Å; I595-F636 HydrophobicContact CG1-CE1 4Å; I595-F636 HydrophobicContact CG1-CZ 4.32Å; I595-F636 HydrophobicContact CG2-CE1 3.76Å; I595-F636 HydrophobicContact CG2-CZ 3.77Å; Y632-F636 HydrophobicContact CD2-CD2 4.04Å; Y632-F636 AromaticContact CD2-CE2 3.67Å; Y632-F636 HydrophobicContact CD2-CE2 3.67Å; Y632-F636 HydrophobicContact CD2-CZ 4.17Å; Y632-F636 HydrophobicContact CE2-CE2 4.47Å; G633-F636 PolarHBondContact N-O 3.05Å; F636-D640 VanDerWaalsContact CA-OD2 3.31Å; F636-D640 WeakPolarHBondContact CA-OD2 3.38Å; F636-D640 HydrophobicContact CB-CB 4.49Å; F636-L642 HydrophobicContact CD2-CD2 4.24Å; F636-L642 HydrophobicContact CE2-CD2 4.42Å
637	D	90.6	Very high	89.6	Confident	49 Å²	49	60.8 Å²	60.8	26%	0.262	30%	0.304	S	S	.	.			trans	-135.2	-168.7	179.5	66.1	28.6	0	0	0	112.1	Q639 D640	D637-Q639 PolarHBondContact O-N 2.81Å; D637-Q639 WeakPolarHBondContact OD1-CA 3.1Å; D637-Q639 VanDerWaalsContact OD1-CB 3.23Å; D637-Q639 WeakPolarHBondContact OD1-CB 3.32Å; D637-Q639 PolarHBondContact OD1-N 3.37Å; D637-D640 PolarHBondContact N-OD2 2.95Å; D637-D640 VanDerWaalsContact N-OD2 3.15Å; D637-D640 PolarHBondContact O-N 2.97Å
638	Y	90.3	Very high	89.9	Confident	104 Å²	104	60.8 Å²	60.8	41%	0.408	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-12.4	-179	67.4	-87.6	0	0	0	114.5	P558 Y632 D640	P558-Y638 HydrophobicContact CB-CD1 4.4Å; P558-Y638 HydrophobicContact CB-CD2 3.97Å; P558-Y638 HydrophobicContact CB-CE2 4.46Å; P558-Y638 HydrophobicContact CB-CG 3.94Å; P558-Y638 HydrophobicContact CG-CD2 3.65Å; P558-Y638 HydrophobicContact CG-CE2 4.26Å; P558-Y638 HydrophobicContact CG-CG 4.01Å; Y632-Y638 WeakPolarHBondContact OH-CB 3.17Å; Y632-Y638 PolarHBondContact OH-N 2.91Å; Y638-D640 VanDerWaalsContact C-N 3.32Å
639	Q	90.6	Very high	90.1	Very high	135 Å²	135	63.7 Å²	63.7	63%	0.631	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-22.5	177	-54.1	-176.9	-2.1	0	0	111	D637	D637-Q639 PolarHBondContact O-N 2.81Å; D637-Q639 WeakPolarHBondContact OD1-CA 3.1Å; D637-Q639 VanDerWaalsContact OD1-CB 3.23Å; D637-Q639 WeakPolarHBondContact OD1-CB 3.32Å; D637-Q639 PolarHBondContact OD1-N 3.37Å
640	D	91.6	Very high	90.5	Very high	13 Å²	13	62.1 Å²	62.1	7%	0.07	29%	0.29	C	S	.	.	S	Bend	trans	-79.1	136.1	177.6	-68.3	-47.5	0	0	0	111.7	V587 S589 K590 F636 D637 Y638	V587-D640 HydrophobicContact CG1-CB 3.66Å; S589-D640 PolarHBondContact OG-OD1 3.25Å; K590-D640 WeakPolarHBondContact CE-OD2 3.29Å; F636-D640 VanDerWaalsContact CA-OD2 3.31Å; F636-D640 WeakPolarHBondContact CA-OD2 3.38Å; F636-D640 HydrophobicContact CB-CB 4.49Å; D637-D640 PolarHBondContact N-OD2 2.95Å; D637-D640 VanDerWaalsContact N-OD2 3.15Å; D637-D640 PolarHBondContact O-N 2.97Å; Y638-D640 VanDerWaalsContact C-N 3.32Å
641	F	92.8	Very high	90.5	Very high	92 Å²	92	60.5 Å²	60.5	40%	0.404	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	139.5	169.2	-71.8	-80.6	0	0	0	110.4	K553 R555 P588	K553-F641 HydrophobicContact CG-CD1 4.5Å; R555-F641 HydrophobicContact CB-CD1 4.29Å; R555-F641 HydrophobicContact CB-CE1 4.17Å; R555-F641 HydrophobicContact CG-CE1 4.36Å; P588-F641 WeakPolarHBondContact CD-O 3.44Å
642	L	93.9	Very high	90.6	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	133.7	169.3	-44.7	-175.8	0	0	0	108.5	L554 I556 L585 V587 I595 I621 F636	L554-L642 HydrophobicContact CB-CB 4.14Å; L554-L642 HydrophobicContact CD1-CB 4.44Å; L554-L642 PolarHBondContact N-O 2.96Å; L554-L642 PolarHBondContact O-N 3.16Å; I556-L642 HydrophobicContact CD1-CD1 4.02Å; I556-L642 HydrophobicContact CD1-CD2 4.05Å; I556-L642 HydrophobicContact CD1-CG 4.11Å; I556-L642 HydrophobicContact CG1-CD1 3.93Å; I556-L642 HydrophobicContact CG1-CG 4.09Å; L585-L642 HydrophobicContact CD1-CD1 4.32Å; V587-L642 HydrophobicContact CG2-CD2 3.73Å; I595-L642 HydrophobicContact CD1-CD1 4.46Å; I595-L642 HydrophobicContact CD1-CD2 3.35Å; I595-L642 HydrophobicContact CD1-CG 4.44Å; I621-L642 HydrophobicContact CD1-CD1 4.36Å; F636-L642 HydrophobicContact CD2-CD2 4.24Å; F636-L642 HydrophobicContact CE2-CD2 4.42Å
643	V	94.6	Very high	90.7	Very high	4 Å²	4	59.2 Å²	59.2	2%	0.024	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	154.6	174.6	-56.9	0	0	0	0	110.6	C552 K553 L585 C586 P588 R645 L673 F677	C552-V643 CarbonylContact O-C 3.53Å; C552-V643 VanDerWaalsContact O-CA 3.3Å; C552-V643 WeakPolarHBondContact O-CA 3.48Å; K553-V643 HydrophobicContact CG-CG1 4.24Å; L585-V643 WeakPolarHBondContact CA-O 3.13Å; C586-V643 PolarHBondContact N-O 3.29Å; C586-V643 PolarHBondContact O-N 3.47Å; P588-V643 HydrophobicContact CG-CB 4.3Å; P588-V643 HydrophobicContact CG-CG1 3.9Å; P588-V643 HydrophobicContact CG-CG2 3.4Å; P588-V643 VanDerWaalsContact CG-CG2 3.4Å; V643-R645 PolarHBondContact O-N 2.93Å; V643-L673 HydrophobicContact CB-CD2 3.68Å; V643-L673 HydrophobicContact CG1-CD2 3.84Å; V643-L673 HydrophobicContact CG2-CD2 3.9Å; V643-F677 HydrophobicContact CG2-CE2 4.26Å; V643-F677 HydrophobicContact CG2-CZ 3.68Å
644	S	94.2	Very high	90.7	Very high	0 Å²	0	56.5 Å²	56.5	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	130.3	168.2	52.7	0	0	0	0	110.1	F550 P551 C552 P584 I646 L673	F550-S644 WeakPolarHBondContact O-CB 3.2Å; P551-S644 WeakPolarHBondContact CA-OG 3.28Å; C552-S644 PolarHBondContact N-OG 3.3Å; C552-S644 PolarHBondContact O-N 3.06Å; P584-S644 CarbonylContact O-C 3.38Å; P584-S644 WeakPolarHBondContact O-CA 3.38Å; S644-I646 PolarHBondContact O-N 2.76Å; S644-L673 WeakPolarHBondContact OG-CD1 3.32Å
645	R	91	Very high	90.7	Very high	128 Å²	128	51.4 Å²	51.4	48%	0.483	24%	0.235	S	C	.	.			trans	-76.6	104.6	172	-177.2	-179.1	178.9	175.3	1.2	109.1	I549 P584 V643	I549-R645 WeakPolarHBondContact CD1-O 3.36Å; P584-R645 HydrophobicContact CB-CB 4.11Å; P584-R645 HydrophobicContact CG-CB 4.11Å; P584-R645 PolarHBondContact O-N 3.45Å; V643-R645 PolarHBondContact O-N 2.93Å
646	I	91.2	Very high	90.4	Very high	12 Å²	12	54.2 Å²	54.2	6%	0.062	25%	0.248	C	C	.	.			trans	-101.4	141.2	-179	-60.9	-179.1	0	0	0	109.2	P551 S644 T650 I651 V670 L673 I679	P551-I646 HydrophobicContact CB-CD1 3.83Å; S644-I646 PolarHBondContact O-N 2.76Å; I646-T650 WeakPolarHBondContact CG2-OG1 3.48Å; I646-I651 HydrophobicContact CG2-CD1 3.64Å; I646-I651 HydrophobicContact CG2-CG1 3.29Å; I646-V670 HydrophobicContact CD1-CG2 4.45Å; I646-L673 HydrophobicContact CD1-CB 4.18Å; I646-L673 HydrophobicContact CD1-CD1 3.4Å; I646-L673 VanDerWaalsContact CD1-CD1 3.4Å; I646-L673 HydrophobicContact CD1-CG 4.44Å; I646-L673 HydrophobicContact CG1-CD1 4.23Å; I646-I679 HydrophobicContact CG2-CD1 4.49Å; I646-I679 VanDerWaalsContact O-CD1 3.31Å; I646-I679 WeakPolarHBondContact O-CD1 3.35Å
647	S	89.7	Confident	90.1	Very high	45 Å²	45	54.9 Å²	54.9	32%	0.315	25%	0.25	S	S	.	.			trans	-116.8	166.5	170.2	76	0	0	0	0	111	E649 T650 I651	S647-E649 VanDerWaalsContact C-N 3.29Å; S647-E649 PolarHBondContact O-N 3.44Å; S647-T650 PolarHBondContact N-OG1 2.99Å; S647-T650 PolarHBondContact O-N 2.95Å; S647-T650 PolarHBondContact O-OG1 3.39Å; S647-T650 WeakPolarHBondContact OG-CG2 3.48Å; S647-T650 PolarHBondContact OG-N 3.22Å; S647-T650 PolarHBondContact OG-OG1 2.99Å; S647-I651 WeakPolarHBondContact O-CG1 3.31Å; S647-I651 PolarHBondContact O-N 2.83Å; S647-I651 VanDerWaalsContact O-N 3.1Å
648	R	88.7	Confident	89.9	Confident	110 Å²	110	53.3 Å²	53.3	42%	0.415	24%	0.241	S	C	.	.	H	α-helix	trans	-56.3	-44.5	175.4	-177.2	62	-171.6	-129.2	-3.9	112.2	T650 I651 D652 I679 L680	R648-T650 VanDerWaalsContact C-N 3.34Å; R648-T650 PolarHBondContact O-N 3.19Å; R648-I651 WeakPolarHBondContact O-CB 3.42Å; R648-I651 PolarHBondContact O-N 2.82Å; R648-D652 IonicContact CZ-OD2 2.71Å; R648-D652 IonicContact NE-OD1 3.57Å; R648-D652 PolarHBondContact NE-OD1 3.07Å; R648-D652 IonicContact NE-OD2 3.56Å; R648-D652 PolarHBondContact NE-OD2 3.4Å; R648-D652 PolarHBondContact O-N 3.04Å; R648-I679 HydrophobicContact CB-CG2 3.96Å; R648-L680 PolarHBondContact NH1-O 3.47Å; R648-L680 PolarHBondContact NH1-OXT 3.5Å
649	E	89.9	Confident	89.6	Confident	138 Å²	138	55.6 Å²	55.6	65%	0.645	25%	0.249	S	C	*	.	H	α-helix	trans	-59.3	-44.3	178.2	-63.9	173.7	176	0	0	111.7	S647 I651 D652 V653	S647-E649 VanDerWaalsContact C-N 3.29Å; S647-E649 PolarHBondContact O-N 3.44Å; E649-I651 VanDerWaalsContact C-N 3.31Å; E649-I651 PolarHBondContact O-N 3.22Å; E649-D652 PolarHBondContact O-N 3.42Å; E649-V653 WeakPolarHBondContact O-CG2 3.22Å; E649-V653 PolarHBondContact O-N 3.15Å
650	T	90.4	Very high	89.3	Confident	5 Å²	5	55.7 Å²	55.7	3%	0.031	25%	0.25	C	C	.	.	H	α-helix	trans	-66.3	-35.3	179.8	63.7	0	0	0	0	112	L547 I549 I646 S647 R648 C654	L547-T650 WeakPolarHBondContact O-CB 3.27Å; L547-T650 VanDerWaalsContact O-CG2 3.26Å; L547-T650 WeakPolarHBondContact O-CG2 3.24Å; I549-T650 HydrophobicContact CB-CG2 4.22Å; I549-T650 HydrophobicContact CD1-CG2 3.56Å; I549-T650 HydrophobicContact CG1-CG2 3.91Å; I646-T650 WeakPolarHBondContact CG2-OG1 3.48Å; S647-T650 PolarHBondContact N-OG1 2.99Å; S647-T650 PolarHBondContact O-N 2.95Å; S647-T650 PolarHBondContact O-OG1 3.39Å; S647-T650 WeakPolarHBondContact OG-CG2 3.48Å; S647-T650 PolarHBondContact OG-N 3.22Å; S647-T650 PolarHBondContact OG-OG1 2.99Å; R648-T650 VanDerWaalsContact C-N 3.34Å; R648-T650 PolarHBondContact O-N 3.19Å; T650-C654 WeakPolarHBondContact O-CB 3.25Å; T650-C654 PolarHBondContact O-N 3.46Å; T650-C654 PolarHBondContact O-SG 2.86Å
651	I	89.6	Confident	89	Confident	9 Å²	9	57.5 Å²	57.5	5%	0.046	26%	0.259	C	S	.	.	H	α-helix	trans	-64.8	-45.7	174.8	-66.3	169.6	0	0	0	110	I646 S647 R648 E649 C654 K655 W667 V670 I679	I646-I651 HydrophobicContact CG2-CD1 3.64Å; I646-I651 HydrophobicContact CG2-CG1 3.29Å; S647-I651 WeakPolarHBondContact O-CG1 3.31Å; S647-I651 PolarHBondContact O-N 2.83Å; S647-I651 VanDerWaalsContact O-N 3.1Å; R648-I651 WeakPolarHBondContact O-CB 3.42Å; R648-I651 PolarHBondContact O-N 2.82Å; E649-I651 VanDerWaalsContact C-N 3.31Å; E649-I651 PolarHBondContact O-N 3.22Å; I651-C654 PolarHBondContact O-N 3Å; I651-K655 HydrophobicContact CG2-CD 4.24Å; I651-K655 HydrophobicContact CG2-CG 4.47Å; I651-K655 WeakPolarHBondContact O-CG 3.41Å; I651-K655 PolarHBondContact O-N 2.93Å; I651-W667 HydrophobicContact CG2-CZ3 4.33Å; I651-V670 HydrophobicContact CD1-CG1 4.01Å; I651-V670 HydrophobicContact CG1-CG1 3.98Å; I651-V670 HydrophobicContact CG2-CG1 4.35Å; I651-I679 HydrophobicContact CD1-CD1 4.3Å; I651-I679 HydrophobicContact CD1-CG2 4.41Å
652	D	89.8	Confident	88.7	Confident	59 Å²	59	53.7 Å²	53.7	32%	0.316	24%	0.243	S	C	.	.	H	α-helix	trans	-68.1	-39.2	-176.5	-67.4	-24.6	0	0	0	110.8	R648 E649 C654 K655 E656	R648-D652 IonicContact CZ-OD2 2.71Å; R648-D652 IonicContact NE-OD1 3.57Å; R648-D652 PolarHBondContact NE-OD1 3.07Å; R648-D652 IonicContact NE-OD2 3.56Å; R648-D652 PolarHBondContact NE-OD2 3.4Å; R648-D652 PolarHBondContact O-N 3.04Å; E649-D652 PolarHBondContact O-N 3.42Å; D652-C654 PolarHBondContact O-N 2.84Å; D652-K655 PolarHBondContact O-N 2.83Å; D652-K655 IonicContact OD1-NZ 2.72Å; D652-E656 WeakPolarHBondContact O-CB 3.37Å; D652-E656 PolarHBondContact O-N 3.36Å
653	V	89.5	Confident	88.4	Confident	13 Å²	13	58.8 Å²	58.8	8%	0.079	27%	0.267	C	S	.	.	H	α-helix	trans	-59.8	-45.8	170	169	0	0	0	0	111.8	F544 L547 A548 E649 K655 E656 Y657 F658	F544-V653 HydrophobicContact CB-CG1 3.88Å; F544-V653 HydrophobicContact CD1-CG2 4.19Å; L547-V653 HydrophobicContact CB-CG1 4.47Å; L547-V653 HydrophobicContact CB-CG2 4.25Å; A548-V653 HydrophobicContact CB-CG1 4.29Å; E649-V653 WeakPolarHBondContact O-CG2 3.22Å; E649-V653 PolarHBondContact O-N 3.15Å; V653-K655 VanDerWaalsContact C-N 3.31Å; V653-K655 PolarHBondContact O-N 2.84Å; V653-E656 PolarHBondContact O-N 3.29Å; V653-Y657 HydrophobicContact CG1-CD2 4.22Å; V653-Y657 PolarHBondContact O-N 3.06Å; V653-F658 HydrophobicContact CG1-CD2 4.16Å; V653-F658 HydrophobicContact CG1-CE2 3.95Å
654	C	87.8	Confident	88.1	Confident	5 Å²	5	66 Å²	66	3%	0.034	30%	0.298	C	S	.	.	H	α-helix	trans	-63.1	-36.6	177.8	-79.1	0	0	0	0	112.3	T650 I651 D652 F658 R659 L662 W667	T650-C654 WeakPolarHBondContact O-CB 3.25Å; T650-C654 PolarHBondContact O-N 3.46Å; T650-C654 PolarHBondContact O-SG 2.86Å; I651-C654 PolarHBondContact O-N 3Å; D652-C654 PolarHBondContact O-N 2.84Å; C654-F658 CarbonylContact O-C 3.6Å; C654-F658 WeakPolarHBondContact O-CA 3.43Å; C654-F658 PolarHBondContact O-N 3.01Å; C654-R659 PolarHBondContact O-N 2.64Å; C654-L662 HydrophobicContact CB-CD1 3.86Å; C654-W667 HydrophobicContact CB-CH2 4.15Å
655	K	86.8	Confident	87.9	Confident	90 Å²	90	68 Å²	68	39%	0.391	31%	0.312	S	S	.	.	H	α-helix	trans	-68	-40.8	175.4	-74.3	176	-175.1	163.5	0	112.6	I651 D652 V653 W667	I651-K655 HydrophobicContact CG2-CD 4.24Å; I651-K655 HydrophobicContact CG2-CG 4.47Å; I651-K655 WeakPolarHBondContact O-CG 3.41Å; I651-K655 PolarHBondContact O-N 2.93Å; D652-K655 PolarHBondContact O-N 2.83Å; D652-K655 IonicContact OD1-NZ 2.72Å; V653-K655 VanDerWaalsContact C-N 3.31Å; V653-K655 PolarHBondContact O-N 2.84Å; K655-W667 HydrophobicContact CB-CH2 4.23Å; K655-W667 HydrophobicContact CG-CH2 3.33Å; K655-W667 HydrophobicContact CG-CZ2 4.1Å; K655-W667 HydrophobicContact CG-CZ3 3.85Å
656	E	84.6	Confident	87.9	Confident	123 Å²	123	62 Å²	62	58%	0.575	29%	0.29	S	S	*	.	H	α-helix	trans	-79.3	-44.6	-173	-167.3	177.8	-174.7	0	0	112	D652 V653	D652-E656 WeakPolarHBondContact O-CB 3.37Å; D652-E656 PolarHBondContact O-N 3.36Å; V653-E656 PolarHBondContact O-N 3.29Å
657	Y	85	Confident	87.8	Confident	18 Å²	18	64.1 Å²	64.1	7%	0.071	30%	0.297	C	S	.	.	H	α-helix	trans	-112.2	-25.6	-168.2	-57.6	-67.8	0	0	0	114.8	K540 F544 V653	K540-Y657 HydrophobicContact CB-CD1 3.96Å; K540-Y657 HydrophobicContact CB-CE1 3.62Å; K540-Y657 HydrophobicContact CD-CE1 3.51Å; K540-Y657 HydrophobicContact CG-CE1 4.22Å; F544-Y657 HydrophobicContact CB-CD2 4.31Å; F544-Y657 HydrophobicContact CD2-CD2 4.15Å; F544-Y657 AromaticContact CD2-CE2 3.69Å; F544-Y657 HydrophobicContact CD2-CE2 3.69Å; F544-Y657 AromaticContact CD2-CZ 3.98Å; F544-Y657 HydrophobicContact CE2-CE2 4.06Å; F544-Y657 HydrophobicContact CG-CD2 4.31Å; F544-Y657 HydrophobicContact CG-CE2 4.09Å; V653-Y657 HydrophobicContact CG1-CD2 4.22Å; V653-Y657 PolarHBondContact O-N 3.06Å
658	F	85.8	Confident	87.9	Confident	16 Å²	16	68 Å²	68	7%	0.07	31%	0.31	C	S	.	.	S	Bend	trans	-121.5	17.4	-170.5	-57.6	-89.6	0	0	0	113.9	R541 A548 F550 V653 C654 E660 D661	R541-F658 HydrophobicContact CB-CE1 4.41Å; R541-F658 HydrophobicContact CB-CZ 4.26Å; R541-F658 HydrophobicContact CG-CE1 4.43Å; R541-F658 HydrophobicContact CG-CZ 4.41Å; R541-F658 WeakPolarHBondContact O-CZ 3.5Å; A548-F658 HydrophobicContact CB-CD2 3.72Å; A548-F658 HydrophobicContact CB-CE1 4.26Å; A548-F658 HydrophobicContact CB-CE2 3.38Å; A548-F658 HydrophobicContact CB-CG 4.3Å; A548-F658 HydrophobicContact CB-CZ 3.68Å; F550-F658 HydrophobicContact CZ-CB 4.17Å; F550-F658 AromaticContact CZ-CD1 3.95Å; F550-F658 HydrophobicContact CZ-CD1 3.95Å; F550-F658 HydrophobicContact CZ-CG 4.2Å; V653-F658 HydrophobicContact CG1-CD2 4.16Å; V653-F658 HydrophobicContact CG1-CE2 3.95Å; C654-F658 CarbonylContact O-C 3.6Å; C654-F658 WeakPolarHBondContact O-CA 3.43Å; C654-F658 PolarHBondContact O-N 3.01Å; F658-E660 PolarHBondContact O-N 3.13Å; F658-D661 VanDerWaalsContact CD1-OD2 3.28Å; F658-D661 WeakPolarHBondContact CD1-OD2 3.4Å; F658-D661 WeakPolarHBondContact O-CB 3.31Å; F658-D661 PolarHBondContact O-N 2.82Å
659	R	83.8	Confident	88	Confident	152 Å²	152	62.9 Å²	62.9	57%	0.574	29%	0.291	S	S	*	.	G	3₁₀ helix	trans	-56.6	-37.1	-178.2	-174.3	175.2	-179.9	131.3	-1.7	113.3	C654 D661 L662	C654-R659 PolarHBondContact O-N 2.64Å; R659-D661 VanDerWaalsContact C-N 3.29Å; R659-D661 PolarHBondContact O-N 2.93Å; R659-L662 PolarHBondContact O-N 2.9Å
660	E	84	Confident	88	Confident	137 Å²	137	56.8 Å²	56.8	64%	0.64	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-70.1	-22.9	178.9	-71.2	168.4	-159	0	0	113.2	R537 F658	R537-E660 IonicContact CZ-OE1 2.74Å; R537-E660 VanDerWaalsContact CZ-OE1 3.25Å; R537-E660 IonicContact CZ-OE2 3.09Å; R537-E660 IonicContact NH1-OE1 3.61Å; R537-E660 PolarHBondContact NH1-OE1 2.78Å; R537-E660 IonicContact NH1-OE2 3.24Å; R537-E660 IonicContact NH2-OE1 2.64Å; R537-E660 PolarHBondContact NH2-OE1 3.01Å; R537-E660 IonicContact NH2-OE2 2.85Å; R537-E660 PolarHBondContact NH2-OE2 2.97Å; F658-E660 PolarHBondContact O-N 3.13Å
661	D	85.1	Confident	88	Confident	51 Å²	51	60.5 Å²	60.5	27%	0.273	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-82.9	-18.4	-179.1	-59.8	-48	0	0	0	112.6	R541 F550 R612 F658 R659	R541-D661 IonicContact CZ-OD2 2.66Å; R541-D661 IonicContact NH2-OD1 3.55Å; R541-D661 PolarHBondContact NH2-OD1 2.83Å; R541-D661 IonicContact NH2-OD2 3.44Å; R541-D661 PolarHBondContact NH2-OD2 3.31Å; F550-D661 HydrophobicContact CE1-CB 3.89Å; F550-D661 HydrophobicContact CZ-CB 4.38Å; R612-D661 PolarHBondContact NH2-O 3.49Å; F658-D661 VanDerWaalsContact CD1-OD2 3.28Å; F658-D661 WeakPolarHBondContact CD1-OD2 3.4Å; F658-D661 WeakPolarHBondContact O-CB 3.31Å; F658-D661 PolarHBondContact O-N 2.82Å; R659-D661 VanDerWaalsContact C-N 3.29Å; R659-D661 PolarHBondContact O-N 2.93Å
662	L	86.8	Confident	88.1	Confident	12 Å²	12	64 Å²	64	6%	0.063	30%	0.301	C	S	.	.	S	Bend	trans	-101.7	124.9	-175.5	-71.8	159.4	0	0	0	110.8	F550 P551 C654 R659 D666 W667	F550-L662 HydrophobicContact CD1-CD2 3.88Å; F550-L662 HydrophobicContact CD1-CG 4.31Å; F550-L662 HydrophobicContact CE1-CD2 4.38Å; F550-L662 HydrophobicContact CE1-CG 4.31Å; P551-L662 HydrophobicContact CG-CD2 3.89Å; C654-L662 HydrophobicContact CB-CD1 3.86Å; R659-L662 PolarHBondContact O-N 2.9Å; L662-D666 HydrophobicContact CB-CB 4.28Å; L662-D666 HydrophobicContact CD2-CB 3.65Å; L662-W667 HydrophobicContact CB-CZ2 4.45Å; L662-W667 HydrophobicContact CD1-CH2 4.05Å; L662-W667 HydrophobicContact CD1-CZ2 3.51Å
663	Q	88.9	Confident	88.1	Confident	108 Å²	108	61.2 Å²	61.2	51%	0.505	29%	0.287	S	S	.	.			trans	-79.5	167.2	175.1	-63.7	-178.3	-19.7	0	0	111.2	S665 D666 W667	Q663-S665 PolarHBondContact O-N 2.67Å; Q663-D666 PolarHBondContact N-OD2 3.5Å; Q663-D666 WeakPolarHBondContact O-CB 3.49Å; Q663-D666 PolarHBondContact O-N 2.96Å; Q663-W667 PolarHBondContact O-N 3.27Å; Q663-W667 VanDerWaalsContact O-N 3.15Å
664	K	88.6	Confident	88.1	Confident	156 Å²	156	63.8 Å²	63.8	68%	0.678	30%	0.297	S	S	*	.	H	α-helix	trans	-57.5	-36	177.4	-169.4	173.2	-177	172.2	0	112.6	W667 Q668	K664-W667 PolarHBondContact O-N 3.24Å; K664-Q668 WeakPolarHBondContact O-CG 3.25Å; K664-Q668 PolarHBondContact O-N 3.43Å; K664-Q668 VanDerWaalsContact O-N 3.12Å
665	S	89.7	Confident	88.2	Confident	40 Å²	40	71.4 Å²	71.4	28%	0.28	33%	0.329	S	S	.	.	H	α-helix	trans	-63.9	-40.9	173.1	49.8	0	0	0	0	112.4	Q663 W667 Q668 L669	Q663-S665 PolarHBondContact O-N 2.67Å; S665-W667 VanDerWaalsContact C-N 3.28Å; S665-W667 PolarHBondContact O-N 2.81Å; S665-Q668 WeakPolarHBondContact O-CB 3.29Å; S665-Q668 PolarHBondContact O-N 3.34Å; S665-Q668 VanDerWaalsContact O-N 3.1Å; S665-L669 PolarHBondContact O-N 3.31Å
666	D	90.9	Very high	88.2	Confident	4 Å²	4	69.8 Å²	69.8	2%	0.021	33%	0.327	C	S	.	.	H	α-helix	trans	-63.7	-39	-179.9	-54.9	-28	0	0	0	110.1	P551 R612 L662 Q663 L669 V670	P551-D666 HydrophobicContact CG-CB 4.11Å; R612-D666 IonicContact NH1-OD2 2.92Å; R612-D666 PolarHBondContact NH1-OD2 3.4Å; L662-D666 HydrophobicContact CB-CB 4.28Å; L662-D666 HydrophobicContact CD2-CB 3.65Å; Q663-D666 PolarHBondContact N-OD2 3.5Å; Q663-D666 WeakPolarHBondContact O-CB 3.49Å; Q663-D666 PolarHBondContact O-N 2.96Å; D666-L669 WeakPolarHBondContact O-CB 3.38Å; D666-L669 PolarHBondContact O-N 3.49Å; D666-V670 WeakPolarHBondContact O-CG2 3.43Å; D666-V670 PolarHBondContact O-N 3.34Å
667	W	89.5	Confident	88.4	Confident	55 Å²	55	65.7 Å²	65.7	21%	0.208	31%	0.307	C	S	.	.	H	α-helix	trans	-68.8	-33.5	173.5	-76.7	109	0	0	0	113.8	I651 C654 K655 L662 Q663 K664 S665 L669 V670 V671	I651-W667 HydrophobicContact CG2-CZ3 4.33Å; C654-W667 HydrophobicContact CB-CH2 4.15Å; K655-W667 HydrophobicContact CB-CH2 4.23Å; K655-W667 HydrophobicContact CG-CH2 3.33Å; K655-W667 HydrophobicContact CG-CZ2 4.1Å; K655-W667 HydrophobicContact CG-CZ3 3.85Å; L662-W667 HydrophobicContact CB-CZ2 4.45Å; L662-W667 HydrophobicContact CD1-CH2 4.05Å; L662-W667 HydrophobicContact CD1-CZ2 3.51Å; Q663-W667 PolarHBondContact O-N 3.27Å; Q663-W667 VanDerWaalsContact O-N 3.15Å; K664-W667 PolarHBondContact O-N 3.24Å; S665-W667 VanDerWaalsContact C-N 3.28Å; S665-W667 PolarHBondContact O-N 2.81Å; W667-L669 VanDerWaalsContact C-N 3.29Å; W667-V670 HydrophobicContact CE3-CB 4.06Å; W667-V670 HydrophobicContact CE3-CG1 4.21Å; W667-V670 HydrophobicContact CE3-CG2 4.03Å; W667-V670 HydrophobicContact CZ3-CB 4.44Å; W667-V670 HydrophobicContact CZ3-CG1 4.18Å; W667-V670 HydrophobicContact CZ3-CG2 4.26Å; W667-V670 WeakPolarHBondContact O-CB 3.38Å; W667-V670 PolarHBondContact O-N 3.43Å; W667-V671 WeakPolarHBondContact O-CG2 3.22Å; W667-V671 PolarHBondContact O-N 2.84Å
668	Q	91.2	Very high	88.4	Confident	128 Å²	128	73.1 Å²	73.1	60%	0.598	34%	0.343	S	S	*	.	H	α-helix	trans	-62.5	-40.4	171.7	-71.8	172.1	-12.2	0	0	110.9	K664 S665 V671 E672	K664-Q668 WeakPolarHBondContact O-CG 3.25Å; K664-Q668 PolarHBondContact O-N 3.43Å; K664-Q668 VanDerWaalsContact O-N 3.12Å; S665-Q668 WeakPolarHBondContact O-CB 3.29Å; S665-Q668 PolarHBondContact O-N 3.34Å; S665-Q668 VanDerWaalsContact O-N 3.1Å; Q668-V671 WeakPolarHBondContact O-CB 3.45Å; Q668-V671 PolarHBondContact O-N 2.99Å; Q668-V671 VanDerWaalsContact O-N 3.16Å; Q668-E672 PolarHBondContact O-N 3.21Å
669	L	90.6	Very high	88.1	Confident	1 Å²	1	73.7 Å²	73.7	1%	0.005	35%	0.346	C	S	.	.	H	α-helix	trans	-64.2	-39.5	173.5	-177.2	63.3	0	0	0	111.8	P551 K553 D576 S665 D666 W667 V671 E672 L673	P551-L669 HydrophobicContact CB-CB 4.47Å; P551-L669 HydrophobicContact CB-CD2 3.94Å; P551-L669 HydrophobicContact CB-CG 4.14Å; K553-L669 HydrophobicContact CB-CD1 4.18Å; K553-L669 HydrophobicContact CB-CD2 4.4Å; K553-L669 HydrophobicContact CD-CD1 4.37Å; D576-L669 HydrophobicContact CB-CD1 4.45Å; D576-L669 HydrophobicContact CB-CD2 4.04Å; S665-L669 PolarHBondContact O-N 3.31Å; D666-L669 WeakPolarHBondContact O-CB 3.38Å; D666-L669 PolarHBondContact O-N 3.49Å; W667-L669 VanDerWaalsContact C-N 3.29Å; L669-V671 VanDerWaalsContact C-N 3.27Å; L669-V671 PolarHBondContact O-N 2.93Å; L669-E672 WeakPolarHBondContact O-CB 3.47Å; L669-E672 PolarHBondContact O-N 2.94Å; L669-L673 HydrophobicContact CD1-CD1 4.41Å; L669-L673 HydrophobicContact CD1-CG 4.27Å; L669-L673 HydrophobicContact CG-CD1 4.07Å; L669-L673 HydrophobicContact CG-CG 4.34Å; L669-L673 WeakPolarHBondContact O-CB 3.28Å; L669-L673 VanDerWaalsContact O-CG 3.3Å; L669-L673 WeakPolarHBondContact O-CG 3.39Å; L669-L673 PolarHBondContact O-N 2.98Å
670	V	90.6	Very high	87.3	Confident	11 Å²	11	75.2 Å²	75.2	7%	0.067	37%	0.365	C	S	.	.	H	α-helix	trans	-57.8	-41	172.1	175.7	0	0	0	0	111.1	P551 I646 I651 D666 W667 L673 K674	P551-V670 HydrophobicContact CB-CG2 3.78Å; P551-V670 HydrophobicContact CG-CG2 3.71Å; I646-V670 HydrophobicContact CD1-CG2 4.45Å; I651-V670 HydrophobicContact CD1-CG1 4.01Å; I651-V670 HydrophobicContact CG1-CG1 3.98Å; I651-V670 HydrophobicContact CG2-CG1 4.35Å; D666-V670 WeakPolarHBondContact O-CG2 3.43Å; D666-V670 PolarHBondContact O-N 3.34Å; W667-V670 HydrophobicContact CE3-CB 4.06Å; W667-V670 HydrophobicContact CE3-CG1 4.21Å; W667-V670 HydrophobicContact CE3-CG2 4.03Å; W667-V670 HydrophobicContact CZ3-CB 4.44Å; W667-V670 HydrophobicContact CZ3-CG1 4.18Å; W667-V670 HydrophobicContact CZ3-CG2 4.26Å; W667-V670 WeakPolarHBondContact O-CB 3.38Å; W667-V670 PolarHBondContact O-N 3.43Å; V670-L673 PolarHBondContact O-N 3.37Å; V670-K674 VanDerWaalsContact O-CB 3.26Å; V670-K674 WeakPolarHBondContact O-CB 3.49Å; V670-K674 PolarHBondContact O-N 2.77Å
671	V	90.3	Very high	87.5	Confident	83 Å²	83	72.2 Å²	72.2	50%	0.503	35%	0.351	S	S	.	.	H	α-helix	trans	-66.8	-38.9	177.2	174.2	0	0	0	0	111.8	W667 Q668 L669 K675	W667-V671 WeakPolarHBondContact O-CG2 3.22Å; W667-V671 PolarHBondContact O-N 2.84Å; Q668-V671 WeakPolarHBondContact O-CB 3.45Å; Q668-V671 PolarHBondContact O-N 2.99Å; Q668-V671 VanDerWaalsContact O-N 3.16Å; L669-V671 VanDerWaalsContact C-N 3.27Å; L669-V671 PolarHBondContact O-N 2.93Å; V671-K675 PolarHBondContact O-N 3.42Å
672	E	90.8	Very high	87.6	Confident	81 Å²	81	73.3 Å²	73.3	38%	0.379	36%	0.355	S	S	.	.	H	α-helix	trans	-60.6	-51.3	172.4	-175.1	-176.2	157.5	0	0	110.6	K553 Q668 L669 K674 K675 V676	K553-E672 IonicContact NZ-OE1 2.76Å; K553-E672 PolarHBondContact NZ-OE1 3.28Å; Q668-E672 PolarHBondContact O-N 3.21Å; L669-E672 WeakPolarHBondContact O-CB 3.47Å; L669-E672 PolarHBondContact O-N 2.94Å; E672-K674 VanDerWaalsContact C-N 3.32Å; E672-K674 PolarHBondContact O-N 2.83Å; E672-K675 WeakPolarHBondContact O-CB 3.27Å; E672-K675 PolarHBondContact O-N 2.85Å; E672-K675 VanDerWaalsContact O-N 3.12Å; E672-V676 WeakPolarHBondContact O-CG2 3.34Å; E672-V676 PolarHBondContact O-N 2.91Å; E672-V676 VanDerWaalsContact O-N 3.14Å
673	L	90.2	Very high	87.7	Confident	2 Å²	2	76.7 Å²	76.7	1%	0.01	37%	0.371	C	S	.	.	H	α-helix	trans	-65	-34.6	-179.7	-65.9	177.2	0	0	0	112.4	P551 V643 S644 I646 L669 V670 K675 V676 F677	P551-L673 HydrophobicContact CB-CD1 4.21Å; V643-L673 HydrophobicContact CB-CD2 3.68Å; V643-L673 HydrophobicContact CG1-CD2 3.84Å; V643-L673 HydrophobicContact CG2-CD2 3.9Å; S644-L673 WeakPolarHBondContact OG-CD1 3.32Å; I646-L673 HydrophobicContact CD1-CB 4.18Å; I646-L673 HydrophobicContact CD1-CD1 3.4Å; I646-L673 VanDerWaalsContact CD1-CD1 3.4Å; I646-L673 HydrophobicContact CD1-CG 4.44Å; I646-L673 HydrophobicContact CG1-CD1 4.23Å; L669-L673 HydrophobicContact CD1-CD1 4.41Å; L669-L673 HydrophobicContact CD1-CG 4.27Å; L669-L673 HydrophobicContact CG-CD1 4.07Å; L669-L673 HydrophobicContact CG-CG 4.34Å; L669-L673 WeakPolarHBondContact O-CB 3.28Å; L669-L673 VanDerWaalsContact O-CG 3.3Å; L669-L673 WeakPolarHBondContact O-CG 3.39Å; L669-L673 PolarHBondContact O-N 2.98Å; V670-L673 PolarHBondContact O-N 3.37Å; L673-K675 PolarHBondContact O-N 3.15Å; L673-V676 PolarHBondContact O-N 2.77Å; L673-V676 VanDerWaalsContact O-N 3.13Å; L673-F677 HydrophobicContact CB-CD2 4.2Å; L673-F677 HydrophobicContact CD2-CE2 4.16Å; L673-F677 WeakPolarHBondContact O-CD2 3.32Å; L673-F677 PolarHBondContact O-N 2.93Å; L673-F677 HydrophobicContact CB-CE2 4.11Å
674	K	90.2	Very high	87.6	Confident	66 Å²	66	74.8 Å²	74.8	29%	0.287	36%	0.364	S	S	.	.	H	α-helix	trans	-57.5	-39.6	173.9	-166.6	-178.8	174.8	175.7	0	111.5	V670 E672 E678 I679 L680	V670-K674 VanDerWaalsContact O-CB 3.26Å; V670-K674 WeakPolarHBondContact O-CB 3.49Å; V670-K674 PolarHBondContact O-N 2.77Å; E672-K674 VanDerWaalsContact C-N 3.32Å; E672-K674 PolarHBondContact O-N 2.83Å; K674-E678 PolarHBondContact O-N 2.75Å; K674-I679 WeakPolarHBondContact CE-O 3.44Å; K674-I679 HydrophobicContact CG-CB 3.89Å; K674-I679 HydrophobicContact CG-CG2 4.35Å; K674-I679 VanDerWaalsContact CG-O 3.29Å; K674-I679 WeakPolarHBondContact CG-O 3.37Å; K674-I679 PolarHBondContact O-N 3.28Å; K674-I679 VanDerWaalsContact O-N 3.09Å; K674-L680 VanDerWaalsContact CE-OXT 3.31Å; K674-L680 PolarHBondContact NZ-OXT 3.12Å; K674-L680 PolarHBondContact NZ-O 3.2Å; K674-L680 WeakPolarHBondContact CE-OXT 3.49Å
675	K	88.8	Confident	87.5	Confident	166 Å²	166	69.8 Å²	69.8	72%	0.722	34%	0.344	S	S	*	.	H	α-helix	trans	-70.7	-39.3	175.7	-66.5	175.1	-177.7	177.5	0	112.1	V671 E672 L673 E678	V671-K675 PolarHBondContact O-N 3.42Å; E672-K675 WeakPolarHBondContact O-CB 3.27Å; E672-K675 PolarHBondContact O-N 2.85Å; E672-K675 VanDerWaalsContact O-N 3.12Å; L673-K675 PolarHBondContact O-N 3.15Å; K675-E678 PolarHBondContact O-N 3.37Å
676	V	87.9	Confident	87.4	Confident	56 Å²	56	71.7 Å²	71.7	34%	0.339	35%	0.348	S	S	.	.	H	α-helix	trans	-65.5	-39.6	179.7	172.3	0	0	0	0	112	P588 E672 L673	P588-V676 HydrophobicContact CB-CG1 3.66Å; P588-V676 HydrophobicContact CG-CG1 4.02Å; E672-V676 WeakPolarHBondContact O-CG2 3.34Å; E672-V676 PolarHBondContact O-N 2.91Å; E672-V676 VanDerWaalsContact O-N 3.14Å; L673-V676 PolarHBondContact O-N 2.77Å; L673-V676 VanDerWaalsContact O-N 3.13Å
677	F	87.6	Confident	87.1	Confident	36 Å²	36	76.6 Å²	76.6	16%	0.158	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	4.9	-178.9	-64.2	-59.8	0	0	0	114.3	C586 N592 V643 L673 I679	C586-F677 VanDerWaalsContact SG-CE1 3.53Å; C586-F677 WeakPolarHBondContact SG-CZ 3.19Å; N592-F677 HydrophobicContact CB-CD1 4.4Å; N592-F677 HydrophobicContact CB-CE1 4.17Å; N592-F677 WeakPolarHBondContact OD1-CE1 3.29Å; V643-F677 HydrophobicContact CG2-CE2 4.26Å; V643-F677 HydrophobicContact CG2-CZ 3.68Å; L673-F677 HydrophobicContact CB-CD2 4.2Å; L673-F677 HydrophobicContact CD2-CE2 4.16Å; L673-F677 WeakPolarHBondContact O-CD2 3.32Å; L673-F677 PolarHBondContact O-N 2.93Å; L673-F677 HydrophobicContact CB-CE2 4.11Å; F677-I679 HydrophobicContact CB-CD1 3.71Å; F677-I679 HydrophobicContact CB-CG1 3.67Å; F677-I679 HydrophobicContact CD2-CD1 4.28Å; F677-I679 HydrophobicContact CG-CD1 4.4Å; F677-I679 PolarHBondContact O-N 3.46Å; F677-I679 VanDerWaalsContact O-N 3.1Å
678	E	85	Confident	87	Confident	174 Å²	174	78.2 Å²	78.2	81%	0.813	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	33.5	-177.4	-56.6	-175.8	169.3	0	0	113.5	K674 K675 L680	K674-E678 PolarHBondContact O-N 2.75Å; K675-E678 PolarHBondContact O-N 3.37Å; E678-L680 PolarHBondContact O-N 2.88Å
679	I	79.7	Confident	86.6	Confident	28 Å²	28	74.1 Å²	74.1	14%	0.144	37%	0.366	C	S	.	.			trans	-73.5	122.1	-179.3	-60.7	163.2	0	0	0	107.7	I646 R648 I651 K674 F677	I646-I679 HydrophobicContact CG2-CD1 4.49Å; I646-I679 VanDerWaalsContact O-CD1 3.31Å; I646-I679 WeakPolarHBondContact O-CD1 3.35Å; R648-I679 HydrophobicContact CB-CG2 3.96Å; I651-I679 HydrophobicContact CD1-CD1 4.3Å; I651-I679 HydrophobicContact CD1-CG2 4.41Å; K674-I679 WeakPolarHBondContact CE-O 3.44Å; K674-I679 HydrophobicContact CG-CB 3.89Å; K674-I679 HydrophobicContact CG-CG2 4.35Å; K674-I679 VanDerWaalsContact CG-O 3.29Å; K674-I679 WeakPolarHBondContact CG-O 3.37Å; K674-I679 PolarHBondContact O-N 3.28Å; K674-I679 VanDerWaalsContact O-N 3.09Å; F677-I679 HydrophobicContact CB-CD1 3.71Å; F677-I679 HydrophobicContact CB-CG1 3.67Å; F677-I679 HydrophobicContact CD2-CD1 4.28Å; F677-I679 HydrophobicContact CG-CD1 4.4Å; F677-I679 PolarHBondContact O-N 3.46Å; F677-I679 VanDerWaalsContact O-N 3.1Å
680	L	67.5	Low	86.2	Confident	185 Å²	185	80.7 Å²	80.7	97%	0.969	40%	0.399	S	S	*	.			trans	-67.3	0	175.8	-68.7	167.7	0	0	0	111.8	R648 K674 E678	R648-L680 PolarHBondContact NH1-O 3.47Å; R648-L680 PolarHBondContact NH1-OXT 3.5Å; K674-L680 VanDerWaalsContact CE-OXT 3.31Å; K674-L680 PolarHBondContact NZ-OXT 3.12Å; K674-L680 PolarHBondContact NZ-O 3.2Å; K674-L680 WeakPolarHBondContact CE-OXT 3.49Å; E678-L680 PolarHBondContact O-N 2.88Å

Retrieved 680 of 680 residues in 826.8 ms (Link to these results)

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