A0A087XR88_POEFO Loading...

Epiphycan

AlphaFold DB , UniProt , Accession A0A087XR88, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 586 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	56.7	Low	55.3	Low	230 Å²	230	149.8 Å²	149.8	100%	1.133	72%	0.72	S	S	*	*				0	8.1	0	-72.2	171	169.7	0	0	115.4
2	R	55.7	Low	54.7	Low	233 Å²	233	150.7 Å²	150.7	88%	0.879	72%	0.718	S	S	*	*			trans	-95.2	-30.9	175.3	-80.5	-175.7	170.5	171.4	-3.7	115.6
3	I	57.3	Low	54.6	Low	148 Å²	148	146.8 Å²	146.8	76%	0.759	71%	0.709	S	S	*	*	H	α-helix	trans	-70.7	-32.3	-179.2	-64.8	165.5	0	0	0	112.4	L5	I3-L5 VanDerWaalsContact C-N 3.28Å; I3-L5 PolarHBondContact O-N 2.78Å
4	F	54.4	Low	53.8	Low	162 Å²	162	146.4 Å²	146.4	71%	0.711	71%	0.712	S	S	*	*	H	α-helix	trans	-67.9	-23.8	-179.6	-121.9	-92.3	0	0	0	113.7
5	L	53.1	Low	52.9	Low	118 Å²	118	148.4 Å²	148.4	62%	0.618	72%	0.715	S	S	*	*	H	α-helix	trans	-74.7	-35.2	-176.3	-151.1	78	0	0	0	112.3	I3 V8 F9	I3-L5 VanDerWaalsContact C-N 3.28Å; I3-L5 PolarHBondContact O-N 2.78Å; L5-V8 PolarHBondContact O-N 3.23Å; L5-F9 PolarHBondContact O-N 3.21Å
6	W	52.3	Low	52.4	Low	226 Å²	226	146.3 Å²	146.3	86%	0.856	71%	0.714	S	S	*	*	H	α-helix	trans	-70.3	-36.4	179.3	-89.1	43.2	0	0	0	112.9	V8 F9 G10	W6-V8 VanDerWaalsContact C-N 3.32Å; W6-V8 PolarHBondContact O-N 3.24Å; W6-F9 PolarHBondContact O-N 3.4Å; W6-G10 PolarHBondContact O-N 3.24Å
7	L	56.9	Low	51.9	Low	116 Å²	116	145.2 Å²	145.2	61%	0.607	72%	0.718	S	S	*	*	H	α-helix	trans	-65.3	-33.6	176.2	-84.6	165.8	0	0	0	112.8	L11	L7-L11 PolarHBondContact O-N 2.74Å
8	V	58.6	Low	51.4	Low	91 Å²	91	142 Å²	142	55%	0.552	72%	0.718	S	S	*	*	H	α-helix	trans	-71.9	-41	177.1	176.7	0	0	0	0	111.2	L5 W6	L5-V8 PolarHBondContact O-N 3.23Å; W6-V8 VanDerWaalsContact C-N 3.32Å; W6-V8 PolarHBondContact O-N 3.24Å
9	F	54.4	Low	50.6	Low	152 Å²	152	138.6 Å²	138.6	67%	0.667	71%	0.714	S	S	*	*	H	α-helix	trans	-67.7	-41.9	176.6	-103.5	-92.5	0	0	0	112.9	L5 W6 L11 F12 V13	L5-F9 PolarHBondContact O-N 3.21Å; W6-F9 PolarHBondContact O-N 3.4Å; F9-L11 VanDerWaalsContact C-N 3.28Å; F9-L11 PolarHBondContact O-N 3.25Å; F9-F12 PolarHBondContact O-N 3.18Å; F9-F12 VanDerWaalsContact O-N 3.13Å; F9-V13 PolarHBondContact O-N 2.91Å
10	G	55	Low	50.1	Low	46 Å²	46	137.4 Å²	137.4	47%	0.474	72%	0.718	S	S	.	*	H	α-helix	trans	-60.8	-34.5	178.5	0	0	0	0	0	113.8	W6 F12	W6-G10 PolarHBondContact O-N 3.24Å; G10-F12 VanDerWaalsContact C-N 3.33Å; G10-F12 PolarHBondContact O-N 3.06Å
11	L	53.3	Low	49.5	Very low	126 Å²	126	136.4 Å²	136.4	66%	0.66	72%	0.72	S	S	*	*	H	α-helix	trans	-73.9	-19.1	177.3	-97.8	163.5	0	0	0	114.3	L7 F9	L7-L11 PolarHBondContact O-N 2.74Å; F9-L11 VanDerWaalsContact C-N 3.28Å; F9-L11 PolarHBondContact O-N 3.25Å
12	F	48.8	Very low	48.8	Very low	160 Å²	160	137.1 Å²	137.1	70%	0.702	71%	0.71	S	S	*	*	H	α-helix	trans	-82.2	-41.6	178.2	-133.6	-91.6	0	0	0	111.8	F9 G10 L14 K15	F9-F12 PolarHBondContact O-N 3.18Å; F9-F12 VanDerWaalsContact O-N 3.13Å; G10-F12 VanDerWaalsContact C-N 3.33Å; G10-F12 PolarHBondContact O-N 3.06Å; F12-L14 VanDerWaalsContact C-N 3.31Å; F12-L14 PolarHBondContact O-N 2.95Å; F12-K15 PolarHBondContact O-N 2.91Å
13	V	53.8	Low	47.7	Very low	100 Å²	100	134 Å²	134	61%	0.606	70%	0.703	S	S	*	*	H	α-helix	trans	-61.6	-39.1	178.1	-178.9	0	0	0	0	111.4	F9 K15 V16	F9-V13 PolarHBondContact O-N 2.91Å; V13-K15 PolarHBondContact O-N 3.1Å; V13-K15 VanDerWaalsContact O-N 3.15Å; V13-V16 PolarHBondContact O-N 2.7Å
14	L	42.3	Very low	46.8	Very low	141 Å²	141	132.6 Å²	132.6	74%	0.738	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	-10.5	-179.4	-146.2	80.6	0	0	0	114.3	F12	F12-L14 VanDerWaalsContact C-N 3.31Å; F12-L14 PolarHBondContact O-N 2.95Å
15	K	41.6	Very low	46	Very low	177 Å²	177	134.7 Å²	134.7	77%	0.77	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.6	-8.1	178.8	-95.3	-162	169.1	-164.7	0	115.2	F12 V13	F12-K15 PolarHBondContact O-N 2.91Å; V13-K15 PolarHBondContact O-N 3.1Å; V13-K15 VanDerWaalsContact O-N 3.15Å
16	V	44.3	Very low	45.1	Very low	114 Å²	114	136.7 Å²	136.7	69%	0.691	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	-19	-178.9	-177.4	0	0	0	0	112.4	V13	V13-V16 PolarHBondContact O-N 2.7Å
17	V	43.8	Very low	44.2	Very low	129 Å²	129	132.2 Å²	132.2	78%	0.782	71%	0.713	S	S	*	*	S	Bend	trans	-93.9	-1.5	-175.1	-175.6	0	0	0	0	113.2
18	A	42.8	Very low	43.1	Very low	87 Å²	87	132.9 Å²	132.9	72%	0.719	72%	0.717	S	S	*	*	S	Bend	trans	-124.9	48.5	-173.7	0	0	0	0	0	113.1
19	A	36.4	Very low	42.1	Very low	77 Å²	77	138 Å²	138	64%	0.636	73%	0.732	S	S	*	*			trans	-137.6	49.3	-177.5	0	0	0	0	0	112.9
20	S	40.2	Very low	41	Very low	115 Å²	115	138 Å²	138	80%	0.804	74%	0.74	S	S	*	*			trans	-120.9	84.8	174.1	-54.6	0	0	0	0	111	R22	S20-R22 PolarHBondContact O-N 2.72Å; S20-R22 VanDerWaalsContact O-N 3.17Å
21	P	38	Very low	40.3	Very low	116 Å²	116	140 Å²	140	75%	0.753	75%	0.746	S	S	*	*			trans	-71.6	107.7	171.9	-9.4	26.2	0	0	0	109.3	F23	P21-F23 PolarHBondContact O-N 3.3Å
22	R	41.8	Very low	39.3	Very low	246 Å²	246	144.2 Å²	144.2	93%	0.928	76%	0.755	S	S	*	*			trans	-64.2	117.7	157.6	-75.2	-178.4	173.3	137.2	-3.7	107.2	S20	S20-R22 PolarHBondContact O-N 2.72Å; S20-R22 VanDerWaalsContact O-N 3.17Å
23	F	33.5	Very low	38.5	Very low	167 Å²	167	144 Å²	144	73%	0.732	76%	0.761	S	S	*	*			trans	-110.1	85.3	176	-149.8	-79.3	0	0	0	110.6	P21 R25	P21-F23 PolarHBondContact O-N 3.3Å; F23-R25 HydrophobicContact CD1-CB 3.97Å; F23-R25 HydrophobicContact CE1-CB 4.03Å; F23-R25 HydrophobicContact CE1-CG 4.18Å; F23-R25 PolarHBondContact O-N 2.79Å; F23-R25 VanDerWaalsContact O-N 3.12Å
24	S	37.9	Very low	37.4	Very low	118 Å²	118	150.6 Å²	150.6	83%	0.825	78%	0.777	S	S	*	*			trans	-64.7	107.2	161.2	-56	0	0	0	0	107.7
25	R	37.4	Very low	37.2	Very low	207 Å²	207	150.7 Å²	150.7	78%	0.781	78%	0.778	S	S	*	*			trans	-95.4	102	171.5	-165.1	158.6	-171.5	163.5	-0.3	110.2	F23	F23-R25 HydrophobicContact CD1-CB 3.97Å; F23-R25 HydrophobicContact CE1-CB 4.03Å; F23-R25 HydrophobicContact CE1-CG 4.18Å; F23-R25 PolarHBondContact O-N 2.79Å; F23-R25 VanDerWaalsContact O-N 3.12Å
26	Q	34.2	Very low	37.1	Very low	160 Å²	160	150.6 Å²	150.6	75%	0.748	78%	0.78	S	S	*	*			trans	-59	131	160.9	-161.7	159.6	-34.1	0	0	108.2
27	V	33.4	Very low	36.7	Very low	132 Å²	132	155.6 Å²	155.6	80%	0.8	79%	0.787	S	S	*	*			trans	-100.7	106.8	173	178.5	0	0	0	0	106.4
28	D	33.2	Very low	36.4	Very low	130 Å²	130	157.5 Å²	157.5	70%	0.695	79%	0.787	S	S	*	*			trans	-71.5	153.6	170.5	-71.8	-57	0	0	0	110.4
29	F	37.5	Very low	36	Very low	198 Å²	198	159.4 Å²	159.4	87%	0.868	79%	0.785	S	S	*	*			trans	-102.5	89.5	-161.9	-160.5	-82	0	0	0	110.8
30	D	32.3	Very low	35.9	Very low	153 Å²	153	162.9 Å²	162.9	82%	0.818	79%	0.793	S	S	*	*			trans	-104.1	122.2	171.9	-87.4	-44	0	0	0	110.7
31	S	39.5	Very low	35.8	Very low	88 Å²	88	163.9 Å²	163.9	62%	0.615	79%	0.794	S	S	*	*			trans	-101.7	134.5	-178.6	57.7	0	0	0	0	112
32	Y	32.1	Very low	35.9	Very low	213 Å²	213	166.7 Å²	166.7	84%	0.835	80%	0.797	S	S	*	*			trans	-138.8	154	158	-77.5	-72.1	0	0	0	111.2
33	D	33.2	Very low	35.6	Very low	156 Å²	156	162.3 Å²	162.3	83%	0.834	79%	0.792	S	S	*	*			trans	-72.1	155.2	-162.5	-66.2	-75.3	0	0	0	115.5
34	Y	31.1	Very low	35.5	Very low	239 Å²	239	160 Å²	160	94%	0.937	79%	0.787	S	S	*	*			trans	-78.5	125.7	154.7	-92.2	-100.6	0	0	0	109
35	D	36.3	Very low	35.3	Very low	143 Å²	143	163.7 Å²	163.7	77%	0.765	78%	0.784	S	S	*	*			trans	-108.9	127.1	166.4	-146.4	-21.6	0	0	0	108.1	R37	D35-R37 IonicContact OD1-NH1 3.94Å
36	E	40.4	Very low	35.1	Very low	174 Å²	174	162.4 Å²	162.4	81%	0.813	79%	0.787	S	S	*	*			trans	-73.5	151.8	-177	-60.7	175	134.4	0	0	111.4
37	R	35.3	Very low	35	Very low	220 Å²	220	165.3 Å²	165.3	83%	0.83	79%	0.793	S	S	*	*			trans	-167.5	129.5	135.1	-106.4	157.1	-150.4	90.6	-4.2	113.3	D35	D35-R37 IonicContact OD1-NH1 3.94Å
38	E	38.6	Very low	34.9	Very low	168 Å²	168	162.7 Å²	162.7	79%	0.785	79%	0.793	S	S	*	*			trans	-75.5	159.5	165.4	-56.1	170.5	118.2	0	0	111.7
39	N	34.2	Very low	35	Very low	127 Å²	127	164.6 Å²	164.6	68%	0.679	80%	0.797	S	S	*	*			trans	141.5	117	132.8	-77.4	-74.8	0	0	0	110.6
40	N	33.7	Very low	35.5	Very low	150 Å²	150	159.9 Å²	159.9	80%	0.802	79%	0.787	S	S	*	*				59.3	92.9	75.3	-80.5	-16.2	0	0	0	113.6
41	V	38.6	Very low	35.5	Very low	137 Å²	137	161.5 Å²	161.5	83%	0.83	79%	0.79	S	S	*	*			trans	-141.5	121.6	142.2	176.6	0	0	0	0	107.2
42	E	38.9	Very low	35	Very low	175 Å²	175	164.9 Å²	164.9	82%	0.818	80%	0.8	S	S	*	*			trans	-81.4	146.9	160.3	-61.5	168.8	101.2	0	0	108.5
43	D	36.1	Very low	35.2	Very low	153 Å²	153	164.3 Å²	164.3	82%	0.818	81%	0.805	S	S	*	*			trans	-157.3	156.7	140.1	-117.3	-36.3	0	0	0	112.4
44	N	31.6	Very low	35.2	Very low	119 Å²	119	166.4 Å²	166.4	64%	0.636	81%	0.807	S	S	*	*			trans	-108.5	-171.8	-171.8	-95	-69.9	0	0	0	112.2
45	Y	34.9	Very low	35.9	Very low	195 Å²	195	160.3 Å²	160.3	77%	0.765	80%	0.797	S	S	*	*			trans	82.1	142.8	158.7	-48.8	-64.4	0	0	0	116
46	E	32.4	Very low	35.7	Very low	180 Å²	180	161.1 Å²	161.1	84%	0.841	80%	0.801	S	S	*	*			cis	-160.9	169.2	-10.7	173.8	163.5	-176.9	0	0	109.9
47	Y	32	Very low	35.4	Very low	222 Å²	222	162 Å²	162	87%	0.871	80%	0.797	S	S	*	*			trans	-74	150.5	-173.1	-115	-96.9	0	0	0	114.3
48	G	32.1	Very low	35.3	Very low	77 Å²	77	157 Å²	157	79%	0.794	80%	0.796	S	S	*	*			trans	-160.6	81.5	177.7	0	0	0	0	0	114.9
49	E	34.3	Very low	35.2	Very low	169 Å²	169	153.9 Å²	153.9	79%	0.79	79%	0.785	S	S	*	*			trans	-99.1	170.3	158.8	-101.2	-171.2	-154.4	0	0	109.5
50	P	48.4	Very low	35.3	Very low	99 Å²	99	159.5 Å²	159.5	64%	0.643	80%	0.798	S	S	*	*			cis	-128.1	-169.3	-7.1	38.7	-21.5	0	0	0	112.2
51	E	32.5	Very low	35.3	Very low	188 Å²	188	159.5 Å²	159.5	88%	0.879	80%	0.798	S	S	*	*				-170.9	157.6	115.4	-104.4	176.4	-173	0	0	112.4
52	N	28.9	Very low	35.2	Very low	158 Å²	158	162.8 Å²	162.8	85%	0.845	80%	0.797	S	S	*	*			trans	-126.7	126.4	-178.6	-91	-92.8	0	0	0	110.1
53	E	34.6	Very low	35.3	Very low	201 Å²	201	160.2 Å²	160.2	94%	0.939	80%	0.796	S	S	*	*			trans	-132.3	147	159.3	-77	-153.5	135	0	0	113.6
54	K	33.5	Very low	35.6	Very low	200 Å²	200	161 Å²	161	87%	0.87	80%	0.795	S	S	*	*			trans	-148.3	169.9	179	-109.2	-178.5	-177.6	173.5	0	105.1
55	P	46.2	Very low	36.2	Very low	112 Å²	112	161 Å²	161	73%	0.727	80%	0.8	S	S	*	*			cis	-128.9	-167.3	-14.7	40.1	-24.1	0	0	0	111.2
56	D	31.5	Very low	36.3	Very low	159 Å²	159	159.9 Å²	159.9	85%	0.85	80%	0.802	S	S	*	*				-153.3	-176.6	120.8	-144.4	-19.3	0	0	0	111.7
57	R	35.1	Very low	36.5	Very low	192 Å²	192	157.2 Å²	157.2	73%	0.725	80%	0.798	S	S	*	*			trans	-139.3	144.8	-148.9	170.1	-170.8	177.5	177.6	3.3	113.8	D59	R57-D59 IonicContact CZ-OD2 3.19Å; R57-D59 IonicContact NE-OD2 2.78Å; R57-D59 PolarHBondContact NE-OD2 2.74Å; R57-D59 IonicContact NH2-OD2 2.74Å; R57-D59 PolarHBondContact NH2-OD2 2.56Å
58	S	33.8	Very low	36.5	Very low	115 Å²	115	153.3 Å²	153.3	80%	0.804	80%	0.797	S	S	*	*			trans	-151.8	112.6	150.7	61.6	0	0	0	0	112
59	D	36	Very low	36.7	Very low	104 Å²	104	153.7 Å²	153.7	56%	0.556	79%	0.793	S	S	*	*			trans	-71.5	144.5	167	-56.7	-87.5	0	0	0	110.7	R57	R57-D59 IonicContact CZ-OD2 3.19Å; R57-D59 IonicContact NE-OD2 2.78Å; R57-D59 PolarHBondContact NE-OD2 2.74Å; R57-D59 IonicContact NH2-OD2 2.74Å; R57-D59 PolarHBondContact NH2-OD2 2.56Å
60	Y	35.1	Very low	36.8	Very low	245 Å²	245	154.5 Å²	154.5	96%	0.961	80%	0.796	S	S	*	*			trans	-157.8	162.7	138.3	-88.6	-53	0	0	0	111.2
61	N	34.5	Very low	36.2	Very low	150 Å²	150	158.9 Å²	158.9	80%	0.802	81%	0.809	S	S	*	*			trans	-112.4	163.7	-156	-161.3	8.5	0	0	0	113.9
62	Y	36.4	Very low	36.4	Very low	206 Å²	206	159 Å²	159	81%	0.808	81%	0.806	S	S	*	*			trans	-53.7	156.1	177.1	-94.9	-101.6	0	0	0	114.2
63	P	41	Very low	36.8	Very low	121 Å²	121	160.8 Å²	160.8	79%	0.786	81%	0.809	S	S	*	*				-135.6	152.5	103.7	38.4	-29.2	0	0	0	115.5
64	E	43	Very low	37.1	Very low	170 Å²	170	160.1 Å²	160.1	79%	0.794	81%	0.806	S	S	*	*			trans	-88.3	150.1	170	170.5	-179.3	-116.5	0	0	111.1
65	P	43.5	Very low	37.3	Very low	117 Å²	117	159.9 Å²	159.9	76%	0.76	81%	0.808	S	S	*	*			trans	-135	122.6	159.6	35.5	-19.6	0	0	0	114.6
66	E	37.4	Very low	36.8	Very low	172 Å²	172	163.9 Å²	163.9	80%	0.804	82%	0.817	S	S	*	*			trans	-61.9	166.5	142.2	-58.9	-179.9	144.9	0	0	108.6
67	V	36.4	Very low	37.3	Very low	124 Å²	124	165.4 Å²	165.4	75%	0.752	82%	0.819	S	S	*	*			cis	-166.3	167.5	41.3	-158.1	0	0	0	0	109.7
68	V	32.2	Very low	37.4	Very low	141 Å²	141	164.8 Å²	164.8	86%	0.855	83%	0.825	S	S	*	*			trans	86.1	137.2	161.1	-172.5	0	0	0	0	117.1
69	A	35.7	Very low	37.6	Very low	85 Å²	85	168.7 Å²	168.7	70%	0.702	83%	0.83	S	S	*	*			trans	-100.1	162.3	179.3	0	0	0	0	0	112.9
70	E	37.5	Very low	37.9	Very low	185 Å²	185	170.5 Å²	170.5	86%	0.864	84%	0.839	S	S	*	*			trans	-119.1	134.9	152.5	-72	-166.1	148.1	0	0	108.8
71	E	34.5	Very low	38.2	Very low	192 Å²	192	164.7 Å²	164.7	90%	0.897	83%	0.831	S	S	*	*			trans	-83.7	140.8	176.4	-63	167.9	141.5	0	0	110.1
72	K	36.8	Very low	38.4	Very low	191 Å²	191	165.8 Å²	165.8	83%	0.83	84%	0.836	S	S	*	*			trans	-139.8	125.8	160.4	-75.4	-166.1	176.9	179.5	0	111
73	E	38.2	Very low	38.4	Very low	194 Å²	194	165.3 Å²	165.3	91%	0.907	84%	0.838	S	S	*	*			trans	-81.6	127.6	170.1	-56.4	165.6	132.3	0	0	108.4
74	E	40.3	Very low	38.2	Very low	187 Å²	187	165.8 Å²	165.8	87%	0.874	84%	0.842	S	S	*	*			trans	-134.2	153.3	156.3	-70.1	-167.9	172.9	0	0	107.7
75	E	37.8	Very low	37.8	Very low	196 Å²	196	167 Å²	167	92%	0.916	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-91	144.1	-144.2	-60.6	169.5	124.8	0	0	114.9
76	E	35.4	Very low	37.5	Very low	196 Å²	196	165.6 Å²	165.6	92%	0.916	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-83	121.6	166.5	-68	-176	129	0	0	110.4
77	E	41.8	Very low	37.5	Very low	191 Å²	191	163.9 Å²	163.9	89%	0.893	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-102.7	120	161.4	-72.1	-159	136.1	0	0	110.2	E79	E77-E79 PolarHBondContact O-N 3.46Å
78	E	38.8	Very low	38	Very low	179 Å²	179	164 Å²	164	84%	0.836	85%	0.849	S	S	*	*			trans	-75.6	115.5	176.2	-67.1	-174.6	118.8	0	0	111.9
79	E	37.8	Very low	38.3	Very low	197 Å²	197	166.5 Å²	166.5	92%	0.921	85%	0.852	S	S	*	*			trans	-84.3	115.8	162.7	-74.9	-154.6	141.7	0	0	111.5	E77	E77-E79 PolarHBondContact O-N 3.46Å
80	L	42.3	Very low	38.1	Very low	142 Å²	142	166 Å²	166	74%	0.743	85%	0.854	S	S	*	*			trans	-124.5	142.9	167	-79.5	173.8	0	0	0	111.7
81	P	41.2	Very low	38.1	Very low	122 Å²	122	163.2 Å²	163.2	79%	0.792	86%	0.856	S	S	*	*	P	Polyproline II helix	trans	-83.1	132.8	-157.4	31	-36.7	0	0	0	114.5
82	L	37.5	Very low	38.1	Very low	174 Å²	174	157.9 Å²	157.9	91%	0.911	85%	0.852	S	S	*	*	P	Polyproline II helix	trans	-98.5	122.7	174.2	-71.7	176.2	0	0	0	112.8
83	K	37.3	Very low	37.9	Very low	195 Å²	195	152.7 Å²	152.7	85%	0.848	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-96.9	130.4	179.2	-171.6	175.9	-173.5	172.1	0	110.1	Q85	K83-Q85 PolarHBondContact O-N 3.17Å
84	P	37.4	Very low	37.8	Very low	132 Å²	132	149.4 Å²	149.4	86%	0.857	85%	0.851	S	S	*	*	P	Polyproline II helix	trans	-63	132.7	-179.9	-23.7	34.1	0	0	0	112.9
85	Q	33.9	Very low	37.6	Very low	196 Å²	196	143.9 Å²	143.9	92%	0.916	84%	0.844	S	S	*	*			trans	-122	142	173.7	-160.7	174.6	35.6	0	0	109.6	K83	K83-Q85 PolarHBondContact O-N 3.17Å
86	A	37.9	Very low	37.5	Very low	86 Å²	86	140.4 Å²	140.4	71%	0.711	84%	0.836	S	S	*	*			trans	-107.2	-161.7	-173.5	0	0	0	0	0	112.3
87	V	37.3	Very low	37.4	Very low	137 Å²	137	138 Å²	138	83%	0.83	83%	0.829	S	S	*	*			trans	84	133.8	175.6	-174	0	0	0	0	111.3
88	P	45.4	Very low	36.9	Very low	125 Å²	125	137.3 Å²	137.3	81%	0.812	83%	0.828	S	S	*	*			cis	-127.7	163	41.3	40	-24.4	0	0	0	119.8
89	Q	38.6	Very low	36.7	Very low	195 Å²	195	132 Å²	132	91%	0.911	82%	0.821	S	S	*	*			trans	-79.2	162.9	171	-62.4	175.1	-33.2	0	0	112.2
90	G	32.8	Very low	37.5	Very low	73 Å²	73	128 Å²	128	75%	0.753	81%	0.812	S	S	*	*			trans	-116.8	124.1	170.6	0	0	0	0	0	113.6
91	S	36.9	Very low	37.1	Very low	128 Å²	128	128.1 Å²	128.1	90%	0.895	81%	0.814	S	S	*	*			trans	52.2	104.8	157.8	-167.4	0	0	0	0	119.3
92	G	34.8	Very low	36.9	Very low	79 Å²	79	129.5 Å²	129.5	81%	0.814	82%	0.82	S	S	*	*			trans	-105	177.5	166.3	0	0	0	0	0	114.6
93	G	31.8	Very low	36.9	Very low	83 Å²	83	129.9 Å²	129.9	86%	0.856	82%	0.817	S	S	*	*			trans	123.5	148.7	174.3	0	0	0	0	0	113
94	S	37.1	Very low	36.7	Very low	125 Å²	125	128.9 Å²	128.9	87%	0.874	81%	0.813	S	S	*	*			cis	-166	144.3	-9.7	-174.3	0	0	0	0	108.3
95	G	34.8	Very low	36.5	Very low	70 Å²	70	130.3 Å²	130.3	72%	0.722	81%	0.808	S	S	*	*			trans	163.5	37.1	179	0	0	0	0	0	122.6
96	V	35.6	Very low	36.4	Very low	124 Å²	124	127 Å²	127	75%	0.752	80%	0.801	S	S	*	*			trans	28.5	123	132.7	-177.8	0	0	0	0	121
97	L	33.9	Very low	36.1	Very low	144 Å²	144	129.2 Å²	129.2	75%	0.754	80%	0.797	S	S	*	*			trans	91	132.1	150.8	-77	167.5	0	0	0	124.1
98	M	32.5	Very low	35.8	Very low	177 Å²	177	130.9 Å²	130.9	87%	0.872	80%	0.8	S	S	*	*			trans	67.8	136	148.9	-71.9	174.7	177.1	0	0	122.5
99	G	33.3	Very low	35.1	Very low	68 Å²	68	134.8 Å²	134.8	70%	0.701	80%	0.799	S	S	*	*			trans	-124.3	-155.1	149.3	0	0	0	0	0	108.7
100	P	55.7	Low	34.8	Very low	113 Å²	113	134 Å²	134	73%	0.734	80%	0.795	S	S	*	*			cis	-116.2	-159.7	-2.7	42.2	-28.8	0	0	0	112.6
101	D	34.2	Very low	34.8	Very low	144 Å²	144	135 Å²	135	77%	0.77	80%	0.796	S	S	*	*			trans	63.3	109.8	164	-56.3	-18.7	0	0	0	119.9
102	T	35.8	Very low	34.6	Very low	152 Å²	152	135 Å²	135	93%	0.933	79%	0.791	S	S	*	*				-169.8	146	121.2	12.8	0	0	0	0	111.6
103	E	38.3	Very low	34.4	Very low	181 Å²	181	137.1 Å²	137.1	85%	0.846	79%	0.787	S	S	*	*			trans	-83.4	141.8	177.9	-54.7	171.5	127	0	0	112
104	K	32	Very low	34.4	Very low	175 Å²	175	139.6 Å²	139.6	76%	0.761	78%	0.781	S	S	*	*				174.3	124	120.9	-96.6	174.7	179	-170.2	0	115.7
105	E	34.1	Very low	34.1	Very low	162 Å²	162	140.4 Å²	140.4	76%	0.757	78%	0.781	S	S	*	*			trans	56	149.8	134.1	-59.2	176.1	131.4	0	0	123.1
106	V	31.5	Very low	33.9	Very low	127 Å²	127	144.5 Å²	144.5	77%	0.77	79%	0.786	S	S	*	*			trans	97.8	126.2	157.1	-166.5	0	0	0	0	119.2
107	E	31.1	Very low	33.7	Very low	132 Å²	132	147 Å²	147	62%	0.617	79%	0.789	S	S	*	*			trans	43.5	96.3	163.8	-71.4	-174	93.1	0	0	120.9	R109	E107-R109 PolarHBondContact O-N 3.09Å; E107-R109 IonicContact OE1-CZ 3.92Å; E107-R109 IonicContact OE1-NE 2.91Å; E107-R109 PolarHBondContact OE1-NE 3.24Å; E107-R109 IonicContact OE1-NH2 3.5Å; E107-R109 PolarHBondContact OE1-NH2 3.02Å
108	L	31	Very low	33.6	Very low	171 Å²	171	146.1 Å²	146.1	90%	0.895	79%	0.789	S	S	*	*			trans	-70.4	109.1	144.3	-101.2	138.8	0	0	0	109.9
109	R	31.3	Very low	33.6	Very low	208 Å²	208	143.2 Å²	143.2	79%	0.785	79%	0.786	S	S	*	*			trans	-108.2	97.2	161.8	-72.1	-169.1	-177.8	-138.6	-3	109.7	E107	E107-R109 PolarHBondContact O-N 3.09Å; E107-R109 IonicContact OE1-CZ 3.92Å; E107-R109 IonicContact OE1-NE 2.91Å; E107-R109 PolarHBondContact OE1-NE 3.24Å; E107-R109 IonicContact OE1-NH2 3.5Å; E107-R109 PolarHBondContact OE1-NH2 3.02Å
110	Q	31.9	Very low	33.5	Very low	179 Å²	179	143.4 Å²	143.4	84%	0.836	79%	0.788	S	S	*	*			trans	-80.9	132.2	171.8	-168.2	160.9	-8.3	0	0	109.7
111	A	32.9	Very low	32.4	Very low	94 Å²	94	145.5 Å²	145.5	78%	0.777	79%	0.793	S	S	*	*			trans	-79.2	156.8	-178.6	0	0	0	0	0	112.3
112	T	32.8	Very low	32.3	Very low	128 Å²	128	148.2 Å²	148.2	79%	0.785	80%	0.798	S	S	*	*			trans	-86.8	-173.5	-177.2	51.6	0	0	0	0	113
113	V	31.5	Very low	32.2	Very low	122 Å²	122	144.7 Å²	144.7	74%	0.739	79%	0.792	S	S	*	*			trans	105.3	124.6	171.6	179.8	0	0	0	0	113.9
114	D	30.9	Very low	31.9	Very low	136 Å²	136	140 Å²	140	73%	0.727	79%	0.792	S	S	*	*			cis	-160.8	146.8	-26.6	-99.5	-29	0	0	0	107.8
115	T	32.1	Very low	32	Very low	141 Å²	141	137.5 Å²	137.5	87%	0.865	80%	0.797	S	S	*	*			trans	-128.9	104.1	171.4	-50.1	0	0	0	0	110.1	H117	T115-H117 PolarHBondContact O-N 3.03Å
116	L	29.9	Very low	32.1	Very low	157 Å²	157	136.8 Å²	136.8	82%	0.822	80%	0.804	S	S	*	*			trans	-73.5	113.9	-177.8	-91.2	160.5	0	0	0	112.1
117	H	31.5	Very low	32.1	Very low	176 Å²	176	134.2 Å²	134.2	82%	0.815	80%	0.802	S	S	*	*			trans	-72	130.5	153	-101.8	84.9	0	0	0	109.1	T115	T115-H117 PolarHBondContact O-N 3.03Å
118	V	30.8	Very low	32.4	Very low	125 Å²	125	134 Å²	134	76%	0.758	82%	0.815	S	S	*	*			trans	-125.4	102.3	167.6	179.1	0	0	0	0	108.7	G120	V118-G120 PolarHBondContact O-N 3.23Å
119	S	32.4	Very low	32.4	Very low	116 Å²	116	129.6 Å²	129.6	81%	0.811	81%	0.811	S	S	*	*			trans	-77.7	114.2	169.3	-51.8	0	0	0	0	109.1
120	G	31.8	Very low	32.6	Very low	72 Å²	72	128 Å²	128	74%	0.742	81%	0.813	S	S	*	*			trans	-96.6	110.9	176.8	0	0	0	0	0	111.8	V118	V118-G120 PolarHBondContact O-N 3.23Å
121	D	32.6	Very low	32.7	Very low	158 Å²	158	126.2 Å²	126.2	85%	0.845	81%	0.814	S	S	*	*			trans	-76.2	144.2	175.1	-169.9	10.6	0	0	0	111.2
122	F	32.1	Very low	32.9	Very low	200 Å²	200	127.5 Å²	127.5	88%	0.877	82%	0.818	S	S	*	*			trans	-140.3	98.9	179.7	-119	-78.4	0	0	0	111.2	G124	F122-G124 PolarHBondContact O-N 3.41Å
123	G	32.6	Very low	33	Very low	78 Å²	78	126.5 Å²	126.5	80%	0.804	82%	0.822	S	S	*	*			trans	-76	121.7	-178.6	0	0	0	0	0	113.4
124	G	32.5	Very low	33.4	Very low	82 Å²	82	125.1 Å²	125.1	85%	0.845	82%	0.824	S	S	*	*			trans	-113.3	121.8	165.3	0	0	0	0	0	110.6	F122	F122-G124 PolarHBondContact O-N 3.41Å
125	S	34.7	Very low	33.6	Very low	124 Å²	124	124.4 Å²	124.4	87%	0.867	83%	0.829	S	S	*	*			trans	-115.8	114.1	-178.6	-179	0	0	0	0	111.2
126	V	36	Very low	33.5	Very low	147 Å²	147	121.1 Å²	121.1	89%	0.891	82%	0.824	S	S	*	*			trans	-143.7	128.3	169.8	-178.5	0	0	0	0	110.9
127	G	32.3	Very low	33.8	Very low	72 Å²	72	118.6 Å²	118.6	74%	0.742	83%	0.826	S	S	*	*			trans	52.8	97.4	142	0	0	0	0	0	119.7
128	S	36.9	Very low	33.9	Very low	127 Å²	127	116.1 Å²	116.1	89%	0.888	83%	0.828	S	S	*	*			trans	-70.2	131.5	162.2	54.2	0	0	0	0	112.3
129	G	31.2	Very low	33.9	Very low	79 Å²	79	113.3 Å²	113.3	81%	0.814	82%	0.824	S	S	*	*			trans	-140.2	125.1	165.3	0	0	0	0	0	109.5
130	E	34.2	Very low	34.1	Very low	176 Å²	176	113.7 Å²	113.7	82%	0.822	83%	0.827	S	S	*	*			trans	-99.1	170.5	-170.6	-64.8	-172.1	118	0	0	113.8
131	T	34.2	Very low	34	Very low	141 Å²	141	114.7 Å²	114.7	87%	0.865	83%	0.828	S	S	*	*			trans	76.3	143.6	172	77.9	0	0	0	0	115.4
132	S	37	Very low	34	Very low	121 Å²	121	114.1 Å²	114.1	85%	0.846	83%	0.83	S	S	*	*			cis	-144.7	158	0.2	53.6	0	0	0	0	111.5
133	A	35	Very low	34.1	Very low	107 Å²	107	110.1 Å²	110.1	88%	0.884	83%	0.827	S	S	*	*			trans	-102.7	145.7	-170.4	0	0	0	0	0	115.5
134	A	39.7	Very low	33.9	Very low	93 Å²	93	110.1 Å²	110.1	77%	0.769	83%	0.827	S	S	*	*			trans	-169.7	150.9	154.6	0	0	0	0	0	109.1
135	S	35.3	Very low	33.8	Very low	120 Å²	120	113.3 Å²	113.3	84%	0.839	83%	0.825	S	S	*	*			cis	164.5	119.4	-39.1	50.6	0	0	0	0	107.8
136	G	30.4	Very low	33.5	Very low	73 Å²	73	115.6 Å²	115.6	75%	0.753	83%	0.825	S	S	*	*			trans	133.6	113.3	-179.3	0	0	0	0	0	110.2
137	A	37.6	Very low	33.2	Very low	104 Å²	104	114.5 Å²	114.5	86%	0.86	82%	0.819	S	S	*	*				65.4	134.3	56.1	0	0	0	0	0	112.4
138	S	33.2	Very low	33	Very low	123 Å²	123	115.8 Å²	115.8	86%	0.86	82%	0.822	S	S	*	*			cis	-174.9	160.6	-5.5	45.2	0	0	0	0	106.5
139	G	30.4	Very low	32.6	Very low	66 Å²	66	114.7 Å²	114.7	68%	0.68	81%	0.814	S	S	*	*			cis	161.6	171.7	9.5	0	0	0	0	0	108.5
140	S	35.4	Very low	32.5	Very low	125 Å²	125	116.8 Å²	116.8	87%	0.874	82%	0.817	S	S	*	*			trans	62.4	131	-178.3	-58.5	0	0	0	0	116
141	A	30.1	Very low	32.4	Very low	92 Å²	92	112.6 Å²	112.6	76%	0.76	81%	0.812	S	S	*	*			cis	76.8	121.5	26.2	0	0	0	0	0	116.3
142	V	33	Very low	32.3	Very low	147 Å²	147	111.8 Å²	111.8	89%	0.891	81%	0.812	S	S	*	*			trans	-169.1	152.5	136.3	138.5	0	0	0	0	110.6
143	S	35.2	Very low	32	Very low	115 Å²	115	109.8 Å²	109.8	80%	0.804	81%	0.81	S	S	*	*			trans	-72.2	174.6	-167.5	-35.9	0	0	0	0	117.6
144	G	27.9	Very low	31.9	Very low	78 Å²	78	112.3 Å²	112.3	80%	0.804	81%	0.809	S	S	*	*			trans	-175.6	60.8	166.7	0	0	0	0	0	116.5
145	D	30.6	Very low	31.6	Very low	150 Å²	150	115.9 Å²	115.9	80%	0.802	82%	0.815	S	S	*	*			trans	-69.2	142	172.3	-60	-68.5	0	0	0	112.8
146	I	28.6	Very low	31.5	Very low	171 Å²	171	115.8 Å²	115.8	88%	0.877	81%	0.814	S	S	*	*			trans	-134.4	137.8	150	-66.9	-172.3	0	0	0	109.2
147	V	28.2	Very low	31.8	Very low	125 Å²	125	115.5 Å²	115.5	76%	0.758	81%	0.81	S	S	*	*			trans	-114.9	135.4	-176.1	-161.6	0	0	0	0	109.9
148	A	28.8	Very low	31.5	Very low	98 Å²	98	118 Å²	118	81%	0.81	81%	0.809	S	S	*	*			trans	-149.9	147.8	163.1	0	0	0	0	0	110
149	S	29	Very low	31.4	Very low	104 Å²	104	119.8 Å²	119.8	73%	0.727	81%	0.808	S	S	*	*			trans	-145.6	163.9	-176.1	-53.8	0	0	0	0	111.2
150	S	29.2	Very low	31.4	Very low	124 Å²	124	123.6 Å²	123.6	87%	0.867	81%	0.811	S	S	*	*			trans	72.5	151	-177.1	80.9	0	0	0	0	115.1
151	A	30.8	Very low	31	Very low	88 Å²	88	125.5 Å²	125.5	73%	0.727	81%	0.811	S	S	*	*			cis	-139.8	161.5	10.4	0	0	0	0	0	114.4
152	S	33.8	Very low	30.8	Very low	124 Å²	124	129 Å²	129	87%	0.867	82%	0.815	S	S	*	*			trans	-22.5	138.8	168.6	53.8	0	0	0	0	119.5
153	G	29.8	Very low	30.5	Very low	78 Å²	78	127.7 Å²	127.7	80%	0.804	81%	0.812	S	S	*	*			trans	177.8	108	157.7	0	0	0	0	0	112
154	D	33.7	Very low	30.1	Very low	161 Å²	161	125 Å²	125	86%	0.861	80%	0.803	S	S	*	*			trans	-75.5	137.9	172.4	-60.8	-66.9	0	0	0	111
155	L	32.9	Very low	30.2	Very low	168 Å²	168	129.2 Å²	129.2	88%	0.88	81%	0.807	S	S	*	*				162	143.5	123.6	-89	169.8	0	0	0	112.7
156	S	32.6	Very low	30.9	Very low	118 Å²	118	126.9 Å²	126.9	83%	0.825	80%	0.8	S	S	*	*			trans	60.6	138.9	161.7	-151.7	0	0	0	0	118.1
157	G	37.2	Very low	31.2	Very low	66 Å²	66	125.6 Å²	125.6	68%	0.68	79%	0.79	S	S	*	*			trans	-86.1	142.6	171.5	0	0	0	0	0	112
158	D	31.7	Very low	31.5	Very low	156 Å²	156	128.5 Å²	128.5	83%	0.834	80%	0.795	S	S	*	*			trans	-157.2	129.3	148	-99.5	-34.1	0	0	0	106.6
159	I	31.4	Very low	31.6	Very low	162 Å²	162	131.4 Å²	131.4	83%	0.831	79%	0.79	S	S	*	*			trans	-125.8	101.8	168.9	-64.5	-176.1	0	0	0	108
160	I	28.8	Very low	31.6	Very low	145 Å²	145	134.9 Å²	134.9	74%	0.744	79%	0.792	S	S	*	*			trans	-73.2	126.8	173.6	-62.6	171.4	0	0	0	108.3
161	L	27.9	Very low	31.4	Very low	166 Å²	166	136.5 Å²	136.5	87%	0.869	79%	0.791	S	S	*	*			trans	-74.1	129.4	170	-65.6	175.3	0	0	0	109.9
162	I	26.6	Very low	31.3	Very low	166 Å²	166	137.2 Å²	137.2	85%	0.851	80%	0.797	S	S	*	*			trans	-105.1	131.1	171	-61.2	176	0	0	0	107.7
163	S	26.5	Very low	31.1	Very low	119 Å²	119	137.4 Å²	137.4	83%	0.832	80%	0.798	S	S	*	*			trans	-139.7	125	175.6	-166.9	0	0	0	0	110.9
164	G	25.7	Very low	31	Very low	59 Å²	59	137.1 Å²	137.1	61%	0.608	80%	0.796	S	S	*	*			trans	-111.8	168.4	153.7	0	0	0	0	0	107.9
165	D	31.4	Very low	30.7	Very low	166 Å²	166	135.7 Å²	135.7	89%	0.888	79%	0.793	S	S	*	*			cis	-145.6	178.2	28.2	-96.3	-29.8	0	0	0	112
166	P	43.8	Very low	30.5	Very low	101 Å²	101	134.4 Å²	134.4	66%	0.656	79%	0.791	S	S	*	*			trans	-114.8	-172	-145.3	43.1	-38.2	0	0	0	118.6
167	E	36	Very low	30.3	Very low	143 Å²	143	134.5 Å²	134.5	67%	0.668	79%	0.792	S	S	*	*			trans	80	145.3	169.2	-57	-55.9	154.3	0	0	118
168	E	33.9	Very low	29.8	Very low	186 Å²	186	135.1 Å²	135.1	87%	0.869	80%	0.798	S	S	*	*			cis	-123.6	170.6	9.7	-75.6	-170.6	134.4	0	0	115
169	F	30.3	Very low	29.7	Very low	159 Å²	159	133.9 Å²	133.9	70%	0.697	80%	0.802	S	S	*	*			trans	-86.6	179.6	-179.5	-84.4	-101.1	0	0	0	113.8
170	F	30	Very low	29.6	Very low	177 Å²	177	129.7 Å²	129.7	78%	0.776	80%	0.798	S	S	*	*			cis	-159.3	142.5	35.6	-77.3	-95	0	0	0	114.3
171	N	25.6	Very low	29.6	Very low	159 Å²	159	132.4 Å²	132.4	85%	0.85	81%	0.808	S	S	*	*				167.6	113.2	101.7	-103.7	-39.1	0	0	0	114
172	A	28.8	Very low	29.4	Very low	103 Å²	103	130.2 Å²	130.2	85%	0.851	80%	0.801	S	S	*	*			trans	-164.2	139.8	151.4	0	0	0	0	0	110.8
173	S	28	Very low	29.5	Very low	127 Å²	127	130.8 Å²	130.8	89%	0.888	81%	0.805	S	S	*	*			trans	-84.7	134.7	-178.2	-178.4	0	0	0	0	112.6
174	G	29.1	Very low	29.4	Very low	73 Å²	73	131 Å²	131	75%	0.753	80%	0.801	S	S	*	*			trans	-159.5	119.8	172.3	0	0	0	0	0	111.8
175	V	26.6	Very low	29.4	Very low	131 Å²	131	136.6 Å²	136.6	79%	0.794	82%	0.817	S	S	*	*			trans	-96.6	122.3	-171	178.8	0	0	0	0	111.9
176	V	29	Very low	29.2	Very low	141 Å²	141	131.9 Å²	131.9	86%	0.855	81%	0.809	S	S	*	*			trans	-137.6	133.8	160.4	179.6	0	0	0	0	109.5
177	S	27.4	Very low	28.5	Very low	119 Å²	119	133.9 Å²	133.9	83%	0.832	82%	0.818	S	S	*	*			trans	-84.3	133.2	179.5	-55.4	0	0	0	0	112.2
178	G	28.3	Very low	28.9	Very low	79 Å²	79	132.2 Å²	132.2	81%	0.814	82%	0.82	S	S	*	*			trans	-152.6	124.7	170	0	0	0	0	0	111.2
179	S	29.4	Very low	28.8	Very low	131 Å²	131	132 Å²	132	92%	0.916	82%	0.819	S	S	*	*			trans	-93.6	123.6	-175.5	54.7	0	0	0	0	112.4
180	G	29.3	Very low	28.7	Very low	73 Å²	73	132.5 Å²	132.5	75%	0.753	82%	0.824	S	S	*	*			trans	-153.9	146.7	169.9	0	0	0	0	0	109.9
181	E	28.6	Very low	28.5	Very low	202 Å²	202	132.4 Å²	132.4	94%	0.944	82%	0.823	S	S	*	*			trans	-89.9	151.8	-168.1	-65.3	-175.7	125.4	0	0	113.9
182	V	24.1	Very low	28.5	Very low	121 Å²	121	131 Å²	131	73%	0.733	82%	0.82	S	S	*	*			trans	-89.6	134.7	177.8	173.6	0	0	0	0	110.3	T184	V182-T184 HydrophobicContact CG1-CG2 3.83Å
183	L	26.7	Very low	28.8	Very low	177 Å²	177	132.8 Å²	132.8	93%	0.927	81%	0.814	S	S	*	*			trans	-130.8	125.1	160.5	-71.1	176.1	0	0	0	109.2
184	T	24.6	Very low	29.6	Very low	123 Å²	123	131.8 Å²	131.8	76%	0.755	80%	0.804	S	S	*	*			trans	-121	120.2	-179.2	51.6	0	0	0	0	110.7	V182	V182-T184 HydrophobicContact CG1-CG2 3.83Å
185	D	26.4	Very low	29.7	Very low	177 Å²	177	133.9 Å²	133.9	95%	0.947	81%	0.807	S	S	*	*			trans	-163.4	137.8	168.2	-122.9	-13.6	0	0	0	106.7
186	G	26.6	Very low	29.8	Very low	68 Å²	68	130.7 Å²	130.7	70%	0.701	80%	0.801	S	S	*	*			cis	-167.5	152.3	-6.8	0	0	0	0	0	110.1
187	V	29.6	Very low	30	Very low	142 Å²	142	130.3 Å²	130.3	86%	0.861	81%	0.805	S	S	*	*			trans	-109.1	140.6	-179.8	171.4	0	0	0	0	106
188	P	43.8	Very low	30.1	Very low	109 Å²	109	128.4 Å²	128.4	71%	0.708	80%	0.803	S	S	*	*				-165.7	173.1	81.5	48	-26.2	0	0	0	121.7
189	E	32.3	Very low	30.2	Very low	182 Å²	182	132 Å²	132	85%	0.85	80%	0.799	S	S	*	*			trans	63.6	161	159	-35.5	-149.8	136.1	0	0	119.1
190	E	29	Very low	30.9	Very low	169 Å²	169	131.6 Å²	131.6	79%	0.79	79%	0.793	S	S	*	*			cis	-126.9	136.7	-1.1	-90.6	-177.1	111.7	0	0	108.7
191	F	25.4	Very low	30.9	Very low	175 Å²	175	134.4 Å²	134.4	77%	0.768	79%	0.791	S	S	*	*				64	104.3	71.9	-162	-86.6	0	0	0	117.2
192	V	26.4	Very low	31	Very low	130 Å²	130	132.6 Å²	132.6	79%	0.788	79%	0.786	S	S	*	*			trans	-159.3	133.4	133.8	168.5	0	0	0	0	109.5
193	I	33.3	Very low	31.2	Very low	140 Å²	140	132.4 Å²	132.4	72%	0.718	79%	0.79	S	S	*	*			trans	-128.3	165.4	155.8	-33.4	178.3	0	0	0	106.6
194	P	44.8	Very low	31.2	Very low	105 Å²	105	127.5 Å²	127.5	68%	0.682	78%	0.781	S	S	*	*				-150.6	137.1	112	35.8	-18.9	0	0	0	117.3
195	S	32.3	Very low	31.4	Very low	117 Å²	117	129.1 Å²	129.1	82%	0.818	79%	0.786	S	S	*	*			trans	63.3	143.8	141	66	0	0	0	0	121.8
196	G	28.9	Very low	31.5	Very low	64 Å²	64	127 Å²	127	66%	0.66	78%	0.778	S	S	*	*			cis	157.4	-172.9	-9.7	0	0	0	0	0	116.2
197	S	32.6	Very low	31.6	Very low	134 Å²	134	129.4 Å²	129.4	94%	0.937	79%	0.785	S	S	*	*			trans	78.2	134.7	177.1	75.7	0	0	0	0	117.1
198	G	29.6	Very low	31.5	Very low	78 Å²	78	125.7 Å²	125.7	80%	0.804	78%	0.775	S	S	*	*			cis	-165.6	151.3	-4.1	0	0	0	0	0	114.8
199	E	30.8	Very low	30.9	Very low	155 Å²	155	126.7 Å²	126.7	72%	0.724	79%	0.785	S	S	*	*			trans	-87.7	176.3	177.5	-131.5	-166.6	-127.3	0	0	110.9	L201	E199-L201 WeakPolarHBondContact OE2-CG 3.26Å
200	P	42.7	Very low	30.7	Very low	122 Å²	122	122 Å²	122	79%	0.792	79%	0.785	S	S	*	*				-145.6	175.9	54.8	39.5	-17.8	0	0	0	118.4
201	L	30	Very low	30.8	Very low	133 Å²	133	119 Å²	119	70%	0.696	79%	0.789	S	S	*	*			trans	-84.9	176.8	-176.4	-58.4	159.2	0	0	0	115.3	E199	E199-L201 WeakPolarHBondContact OE2-CG 3.26Å
202	I	30.2	Very low	31.1	Very low	164 Å²	164	114.8 Å²	114.8	84%	0.841	79%	0.787	S	S	*	*			trans	153.8	101.6	144.5	-81.6	156.6	0	0	0	107.6
203	S	29.1	Very low	31.3	Very low	117 Å²	117	117 Å²	117	82%	0.818	79%	0.793	S	S	*	*				80.5	128.4	73.9	-172.2	0	0	0	0	114.7
204	G	26.9	Very low	31.1	Very low	73 Å²	73	113.5 Å²	113.5	75%	0.753	79%	0.791	S	S	*	*			trans	166.2	115.5	176.3	0	0	0	0	0	114.4
205	D	27.6	Very low	30.5	Very low	158 Å²	158	114.5 Å²	114.5	85%	0.845	80%	0.8	S	S	*	*			trans	-94	179.9	-179.8	-70.5	-66	0	0	0	114.1
206	V	29.2	Very low	30.5	Very low	131 Å²	131	113 Å²	113	79%	0.794	79%	0.794	S	S	*	*			trans	88.7	103.2	155	-169.5	0	0	0	0	118.9
207	S	29.1	Very low	30.4	Very low	120 Å²	120	119.5 Å²	119.5	84%	0.839	81%	0.805	S	S	*	*				25.2	137.4	125.7	-164.3	0	0	0	0	121.4
208	G	28.2	Very low	30.5	Very low	64 Å²	64	119.1 Å²	119.1	66%	0.66	80%	0.803	S	S	*	*			trans	141.3	96.1	140.9	0	0	0	0	0	118.7
209	S	30.6	Very low	30.4	Very low	130 Å²	130	119.4 Å²	119.4	91%	0.909	81%	0.806	S	S	*	*			trans	2.2	128.1	148.7	58.3	0	0	0	0	120.4
210	G	28.6	Very low	30.4	Very low	83 Å²	83	116.5 Å²	116.5	86%	0.856	81%	0.808	S	S	*	*			trans	-179.7	115.4	161.2	0	0	0	0	0	113.3
211	A	30.6	Very low	29.9	Very low	105 Å²	105	116.6 Å²	116.6	87%	0.868	81%	0.811	S	S	*	*			trans	-91.9	155.8	-177.2	0	0	0	0	0	113.6
212	A	30.8	Very low	29.7	Very low	88 Å²	88	114 Å²	114	73%	0.727	82%	0.817	S	S	*	*				148.6	120.1	123.7	0	0	0	0	0	115
213	I	31.9	Very low	29.7	Very low	177 Å²	177	113.9 Å²	113.9	91%	0.908	82%	0.818	S	S	*	*			trans	37.1	130	154.4	47.1	170	0	0	0	121.7
214	G	28.2	Very low	29.7	Very low	65 Å²	65	112.5 Å²	112.5	67%	0.67	81%	0.809	S	S	*	*			cis	159.1	-163.4	-4.6	0	0	0	0	0	115.1
215	S	33.2	Very low	30.1	Very low	127 Å²	127	117.1 Å²	117.1	89%	0.888	82%	0.815	S	S	*	*			trans	94.3	135	168.9	78.4	0	0	0	0	121
216	A	31	Very low	31	Very low	84 Å²	84	114.5 Å²	114.5	69%	0.694	81%	0.807	S	S	*	*			trans	80.9	89.7	148.3	0	0	0	0	0	123.3
217	F	27.3	Very low	31	Very low	201 Å²	201	116.7 Å²	116.7	88%	0.882	81%	0.809	S	S	*	*			trans	71.7	146	135.4	-76.2	-78.5	0	0	0	123.7
218	S	35.4	Very low	30.9	Very low	127 Å²	127	116 Å²	116	89%	0.888	80%	0.799	S	S	*	*			trans	69.3	129.5	168.7	-57.4	0	0	0	0	117.5
219	G	28	Very low	30.7	Very low	84 Å²	84	118.5 Å²	118.5	87%	0.866	80%	0.801	S	S	*	*			cis	152	70.9	-6.4	0	0	0	0	0	114.1
220	A	30.6	Very low	30.4	Very low	94 Å²	94	117.7 Å²	117.7	78%	0.777	79%	0.791	S	S	*	*			trans	-151.6	152.6	177.8	0	0	0	0	0	113.4
221	S	31.7	Very low	30.2	Very low	123 Å²	123	121.8 Å²	121.8	86%	0.86	79%	0.788	S	S	*	*			trans	0.7	137.3	159.8	56.5	0	0	0	0	121.3
222	G	26.5	Very low	30.2	Very low	80 Å²	80	124.1 Å²	124.1	83%	0.825	79%	0.785	S	S	*	*			trans	137.7	80.2	147.6	0	0	0	0	0	117.9
223	D	29.6	Very low	30.5	Very low	160 Å²	160	125.2 Å²	125.2	86%	0.856	78%	0.784	S	S	*	*			trans	21	159.3	147	-151.3	12.5	0	0	0	125
224	S	28.6	Very low	30.1	Very low	89 Å²	89	121.1 Å²	121.1	62%	0.622	77%	0.771	S	S	*	*			trans	85.6	97.4	150.3	71.6	0	0	0	0	123
225	L	34.8	Very low	30	Very low	170 Å²	170	126.2 Å²	126.2	89%	0.89	78%	0.778	S	S	*	*				64.8	-176.9	127.1	-68.8	-179.8	0	0	0	117.7
226	P	48.2	Very low	29.8	Very low	103 Å²	103	126.4 Å²	126.4	67%	0.669	77%	0.774	S	S	*	*			cis	-142.6	-169.4	8.5	45.4	-25.5	0	0	0	118.5
227	E	28.7	Very low	29.7	Very low	177 Å²	177	125.9 Å²	125.9	83%	0.827	78%	0.776	S	S	*	*			trans	73.4	145.1	155	-68.6	-154.7	131.3	0	0	119.8
228	V	26.3	Very low	29.9	Very low	105 Å²	105	122.8 Å²	122.8	64%	0.636	77%	0.774	S	S	*	*			cis	-162.4	139	-4.8	116.8	0	0	0	0	111.7
229	V	23.8	Very low	29.8	Very low	117 Å²	117	122.3 Å²	122.3	71%	0.709	77%	0.77	S	S	*	*			trans	52.3	132.7	145	-177	0	0	0	0	118.9
230	T	24.3	Very low	30	Very low	112 Å²	112	121.4 Å²	121.4	69%	0.687	76%	0.761	S	S	*	*				-179.3	168.8	71.7	-24.6	0	0	0	0	112.2
231	E	25.5	Very low	30	Very low	169 Å²	169	124 Å²	124	79%	0.79	76%	0.762	S	S	*	*			trans	66.1	122.4	156.5	-57.9	-56.1	79.6	0	0	122.7
232	L	30.3	Very low	30	Very low	155 Å²	155	125.7 Å²	125.7	81%	0.812	76%	0.756	S	S	*	*			trans	-81	158.2	140.9	-93.1	161.5	0	0	0	108.2
233	P	36.9	Very low	30.2	Very low	110 Å²	110	126.9 Å²	126.9	71%	0.714	75%	0.752	S	S	*	*				-161.4	-175.1	62.7	40.1	-15.4	0	0	0	119.4
234	S	22.8	Very low	30.2	Very low	91 Å²	91	122.7 Å²	122.7	64%	0.636	75%	0.747	S	S	*	*			trans	66.4	116.9	139.1	64.4	0	0	0	0	124.3
235	E	26.6	Very low	30.8	Very low	173 Å²	173	124.4 Å²	124.4	81%	0.808	76%	0.759	S	S	*	*				80.9	121.4	119.3	-68.8	-158.1	126.9	0	0	125.4
236	T	29	Very low	30.6	Very low	130 Å²	130	119.8 Å²	119.8	80%	0.798	75%	0.752	S	S	*	*			trans	79.9	121.9	131.7	59.5	0	0	0	0	124.2
237	G	28.3	Very low	30	Very low	73 Å²	73	124.7 Å²	124.7	75%	0.753	76%	0.764	S	S	*	*				110.7	160.1	129.2	0	0	0	0	0	118.4
238	V	32.9	Very low	30.4	Very low	137 Å²	137	120.7 Å²	120.7	83%	0.83	76%	0.755	S	S	*	*			cis	-165.8	154.4	-12.7	119.4	0	0	0	0	109.3
239	S	33.3	Very low	30.6	Very low	116 Å²	116	118.8 Å²	118.8	81%	0.811	76%	0.756	S	S	*	*			trans	11.1	153.8	165.8	69.7	0	0	0	0	123
240	G	30.3	Very low	31.1	Very low	66 Å²	66	120.4 Å²	120.4	68%	0.68	76%	0.761	S	S	*	*			cis	160.8	-144.3	10.1	0	0	0	0	0	112.3
241	D	31.2	Very low	31.5	Very low	147 Å²	147	121.7 Å²	121.7	79%	0.786	76%	0.763	S	S	*	*			trans	73.3	149.1	176.4	-70.1	-21.2	0	0	0	119.3
242	Q	33	Very low	31.8	Very low	159 Å²	159	121 Å²	121	74%	0.743	76%	0.764	S	S	*	*			cis	-166.7	146.1	-38.4	-125.7	-170.5	89.9	0	0	112.7
243	S	30.2	Very low	32	Very low	105 Å²	105	118.2 Å²	118.2	73%	0.734	76%	0.757	S	S	*	*			trans	56	118.9	143.1	-58.4	0	0	0	0	123.7
244	G	29.6	Very low	32.2	Very low	72 Å²	72	118.7 Å²	118.7	74%	0.742	76%	0.763	S	S	*	*			trans	121.9	147.2	143.8	0	0	0	0	0	117.2
245	S	39.9	Very low	32.6	Very low	126 Å²	126	118.2 Å²	118.2	88%	0.881	77%	0.773	S	S	*	*			cis	163.6	127.5	-29	46.5	0	0	0	0	109.6
246	G	31.6	Very low	33.2	Very low	73 Å²	73	114.7 Å²	114.7	75%	0.753	77%	0.773	S	S	*	*			trans	142.8	109.7	172.5	0	0	0	0	0	112.6
247	F	35.2	Very low	33.7	Very low	206 Å²	206	114.4 Å²	114.4	90%	0.904	78%	0.776	S	S	*	*				84.1	126.7	53	-158.8	-80.8	0	0	0	112.4
248	S	38.1	Very low	33.9	Very low	93 Å²	93	113.7 Å²	113.7	65%	0.65	77%	0.769	S	S	*	*			cis	-170.2	168.3	-11.1	-86	0	0	0	0	111.2
249	G	30.3	Very low	34.3	Very low	64 Å²	64	114 Å²	114	66%	0.66	77%	0.772	S	S	*	*			trans	128.5	127.3	161.4	0	0	0	0	0	112.8
250	D	33.5	Very low	34.5	Very low	151 Å²	151	114.1 Å²	114.1	81%	0.807	77%	0.773	S	S	*	*			cis	69.3	133.9	41.3	-65.1	-28.2	0	0	0	113.8
251	L	32.6	Very low	34.6	Very low	139 Å²	139	114.6 Å²	114.6	73%	0.728	78%	0.777	S	S	*	*			cis	-166.9	178.7	-2.7	-121.6	167.5	0	0	0	110.4
252	L	32.7	Very low	34.8	Very low	156 Å²	156	115.1 Å²	115.1	82%	0.817	78%	0.78	S	S	*	*			trans	80.6	155.7	164.1	-48.8	-177.9	0	0	0	119.2
253	S	34.6	Very low	35.1	Very low	96 Å²	96	112.5 Å²	112.5	67%	0.671	78%	0.779	S	S	*	*			cis	-174.3	149.9	-36.9	-162.7	0	0	0	0	112.5
254	S	39.6	Very low	35.6	Very low	119 Å²	119	116.1 Å²	116.1	83%	0.832	79%	0.785	S	S	*	*			trans	66	135.1	147	65.6	0	0	0	0	122.6
255	G	31.2	Very low	36	Very low	81 Å²	81	118.5 Å²	118.5	84%	0.835	78%	0.78	S	S	*	*			trans	177	115.6	162.3	0	0	0	0	0	111.9
256	A	40.1	Very low	36	Very low	100 Å²	100	118.2 Å²	118.2	83%	0.826	78%	0.779	S	S	*	*			trans	-99.2	-179.4	172.7	0	0	0	0	0	109.6
257	S	39.6	Very low	36.2	Very low	123 Å²	123	120.8 Å²	120.8	86%	0.86	77%	0.774	S	S	*	*			cis	-171.9	165.6	12	31.2	0	0	0	0	106.4
258	G	33.2	Very low	36.4	Very low	58 Å²	58	117.1 Å²	117.1	60%	0.598	77%	0.768	S	S	*	*			cis	156.7	178.3	2.9	0	0	0	0	0	110.1
259	T	41.2	Very low	36.6	Very low	145 Å²	145	117.3 Å²	117.3	89%	0.89	77%	0.769	S	S	*	*			trans	63.2	145.6	169.5	58	0	0	0	0	118.5
260	S	37.7	Very low	36.7	Very low	118 Å²	118	117.5 Å²	117.5	83%	0.825	77%	0.771	S	S	*	*			cis	-170.5	147.6	-10.9	46	0	0	0	0	109.5
261	G	31.2	Very low	37.1	Very low	76 Å²	76	120.5 Å²	120.5	78%	0.784	77%	0.772	S	S	*	*			trans	178.3	40.4	179.2	0	0	0	0	0	119.5
262	D	35.5	Very low	37.3	Very low	158 Å²	158	118.6 Å²	118.6	85%	0.845	77%	0.771	S	S	*	*			trans	-68.3	161.2	159.9	-54	-74.4	0	0	0	109.8
263	S	39.7	Very low	37.2	Very low	104 Å²	104	114.5 Å²	114.5	73%	0.727	77%	0.766	S	S	*	*			cis	-146.8	-177.1	29.6	-47.2	0	0	0	0	110.7
264	E	40.6	Very low	37.2	Very low	181 Å²	181	117.4 Å²	117.4	85%	0.846	77%	0.773	S	S	*	*			cis	-154.2	164.1	15.6	-154	157.7	-128.5	0	0	112.8
265	D	38.4	Very low	36.6	Very low	121 Å²	121	117.2 Å²	117.2	65%	0.647	77%	0.766	S	S	*	*			trans	-71.9	153	-162.1	-68.4	-72.7	0	0	0	119.2	I267	D265-I267 HydrophobicContact CB-CD1 3.67Å; D265-I267 HydrophobicContact CB-CG1 3.99Å; D265-I267 WeakPolarHBondContact OD1-CD1 3.49Å
266	S	39.4	Very low	36.5	Very low	121 Å²	121	120.1 Å²	120.1	85%	0.846	76%	0.762	S	S	*	*				-166.7	112.7	117.2	-75.6	0	0	0	0	110.2
267	I	34.9	Very low	36	Very low	126 Å²	126	122 Å²	122	65%	0.646	76%	0.757	S	S	*	*			cis	66.7	123.3	49.3	-60.6	-175.4	0	0	0	111.3	D265	D265-I267 HydrophobicContact CB-CD1 3.67Å; D265-I267 HydrophobicContact CB-CG1 3.99Å; D265-I267 WeakPolarHBondContact OD1-CD1 3.49Å
268	V	40.2	Very low	35.5	Very low	129 Å²	129	120.6 Å²	120.6	78%	0.782	75%	0.747	S	S	*	*			cis	-170.3	162.5	-3.2	111.1	0	0	0	0	107.8
269	S	41.9	Very low	35.2	Very low	98 Å²	98	121.5 Å²	121.5	69%	0.685	76%	0.756	S	S	*	*			cis	-164.4	179	-15.6	69	0	0	0	0	109.1
270	G	33.8	Very low	34.8	Very low	67 Å²	67	122.1 Å²	122.1	69%	0.691	75%	0.749	S	S	*	*			trans	141.5	77.4	164.9	0	0	0	0	0	114.4
271	Y	41	Very low	34.5	Very low	214 Å²	214	124.9 Å²	124.9	84%	0.839	75%	0.749	S	S	*	*				55.5	134.2	78.8	-78.2	-80.9	0	0	0	115
272	S	36.1	Very low	34.4	Very low	99 Å²	99	129.3 Å²	129.3	69%	0.692	75%	0.749	S	S	*	*			cis	-153.5	144.3	5.5	-160.2	0	0	0	0	109.3
273	G	32.1	Very low	33.8	Very low	70 Å²	70	131.6 Å²	131.6	72%	0.722	75%	0.752	S	S	*	*				104.7	157.1	87.6	0	0	0	0	0	111
274	I	33.6	Very low	33.1	Very low	158 Å²	158	134.4 Å²	134.4	81%	0.81	76%	0.758	S	S	*	*			cis	-148.5	156.6	4.8	-56.7	176.4	0	0	0	109.5
275	T	28.3	Very low	33.4	Very low	114 Å²	114	131.1 Å²	131.1	70%	0.699	75%	0.752	S	S	*	*			trans	-66.6	176.9	176	-13.1	0	0	0	0	114.9
276	L	28.9	Very low	32.7	Very low	142 Å²	142	131.4 Å²	131.4	74%	0.743	76%	0.764	S	S	*	*				-168.4	135.8	76.3	-72.8	168.7	0	0	0	110.5
277	I	29.8	Very low	32.2	Very low	141 Å²	141	129.9 Å²	129.9	72%	0.723	76%	0.759	S	S	*	*				64.5	139.3	96.3	-55.3	178.7	0	0	0	114.9
278	S	28.8	Very low	31.8	Very low	93 Å²	93	131.1 Å²	131.1	65%	0.65	77%	0.766	S	S	*	*			cis	-146.6	-179.9	7.9	-145.1	0	0	0	0	113.4	E280	S278-E280 PolarHBondContact OG-OE2 2.82Å
279	G	26.6	Very low	31.2	Very low	76 Å²	76	134.8 Å²	134.8	78%	0.784	77%	0.772	S	S	*	*			trans	176.3	69.9	166.4	0	0	0	0	0	117
280	E	32.9	Very low	30.8	Very low	159 Å²	159	137 Å²	137	74%	0.743	78%	0.775	S	S	*	*			trans	-82.8	165.5	175.4	-63.5	137.1	130.9	0	0	111.9	S278	S278-E280 PolarHBondContact OG-OE2 2.82Å
281	E	30.9	Very low	30.7	Very low	175 Å²	175	139.7 Å²	139.7	82%	0.818	78%	0.78	S	S	*	*			cis	-158.3	-164.6	-2	-131	-178.8	-170.2	0	0	113
282	E	28.1	Very low	30.1	Very low	170 Å²	170	137.5 Å²	137.5	79%	0.794	78%	0.777	S	S	*	*			trans	-58.6	166.9	-172.5	-50.7	-174.9	143.6	0	0	118.9
283	F	24.5	Very low	29.8	Very low	205 Å²	205	138.8 Å²	138.8	90%	0.899	77%	0.772	S	S	*	*			trans	-151.4	134.2	153.4	-110.7	-79.3	0	0	0	113.1
284	L	25.1	Very low	29.6	Very low	163 Å²	163	142.7 Å²	142.7	85%	0.853	78%	0.782	S	S	*	*			trans	-142.1	164.8	166	-87	-174.7	0	0	0	110.4
285	P	45.6	Very low	29.5	Very low	112 Å²	112	141.4 Å²	141.4	73%	0.727	78%	0.776	S	S	*	*				-106.7	175.3	-129	39.8	-40.3	0	0	0	116.7
286	S	25.1	Very low	29.3	Very low	128 Å²	128	141.5 Å²	141.5	90%	0.895	78%	0.781	S	S	*	*			trans	-151.7	161.6	162	-78.7	0	0	0	0	111
287	A	28	Very low	29.5	Very low	89 Å²	89	139 Å²	139	74%	0.736	78%	0.781	S	S	*	*			trans	-101.3	167.5	-160.8	0	0	0	0	0	115.8
288	D	27.1	Very low	29.5	Very low	151 Å²	151	139.2 Å²	139.2	81%	0.807	79%	0.789	S	S	*	*			trans	36.6	110.6	155.3	-62	-16.5	0	0	0	120.2
289	K	26.9	Very low	29.5	Very low	206 Å²	206	137.9 Å²	137.9	90%	0.896	79%	0.79	S	S	*	*				-168.9	158.9	99.5	-107.2	170.8	-177.9	174.6	0	116.5
290	I	33.2	Very low	30	Very low	146 Å²	146	143.1 Å²	143.1	75%	0.749	80%	0.796	S	S	*	*			trans	-76.9	152.5	178.4	-58.2	157.7	0	0	0	111.2	E292	I290-E292 HydrophobicContact CG2-CG 4.04Å
291	P	32.2	Very low	30.8	Very low	122 Å²	122	140.7 Å²	140.7	79%	0.792	79%	0.794	S	S	*	*			trans	-129	132.6	133.8	35.6	-26.8	0	0	0	113.7
292	E	29.1	Very low	31	Very low	168 Å²	168	137.9 Å²	137.9	79%	0.785	79%	0.794	S	S	*	*			trans	-91.6	178.1	158.3	-48.4	-176	119.3	0	0	109.1	I290	I290-E292 HydrophobicContact CG2-CG 4.04Å
293	E	29.9	Very low	31.1	Very low	126 Å²	126	132.8 Å²	132.8	59%	0.589	79%	0.787	S	S	*	*			cis	-140.1	168.5	-1.9	-71.2	-172.9	117.5	0	0	108.1	L295	E293-L295 VanDerWaalsContact OE1-CD1 3.26Å; E293-L295 WeakPolarHBondContact OE1-CD1 3.38Å; E293-L295 WeakPolarHBondContact OE1-CD2 3.33Å; E293-L295 VanDerWaalsContact OE1-CG 3.23Å; E293-L295 WeakPolarHBondContact OE1-CG 3.23Å
294	V	26.6	Very low	31.5	Very low	152 Å²	152	129.8 Å²	129.8	92%	0.921	78%	0.781	S	S	*	*				-145.2	130.4	119.2	-178.2	0	0	0	0	109.5
295	L	31.2	Very low	31.8	Very low	131 Å²	131	129.4 Å²	129.4	69%	0.686	78%	0.778	S	S	*	*			trans	-87.7	170.6	-175.9	-69.9	165.5	0	0	0	115.2	E293	E293-L295 VanDerWaalsContact OE1-CD1 3.26Å; E293-L295 WeakPolarHBondContact OE1-CD1 3.38Å; E293-L295 WeakPolarHBondContact OE1-CD2 3.33Å; E293-L295 VanDerWaalsContact OE1-CG 3.23Å; E293-L295 WeakPolarHBondContact OE1-CG 3.23Å
296	S	24.9	Very low	31.1	Very low	117 Å²	117	131.6 Å²	131.6	82%	0.818	78%	0.783	S	S	*	*			trans	-147.7	109.5	149	-170.2	0	0	0	0	113.2
297	A	32.4	Very low	31.5	Very low	88 Å²	88	129.1 Å²	129.1	73%	0.727	78%	0.778	S	S	*	*			trans	51.3	126.2	149.4	0	0	0	0	0	119.8
298	T	30.5	Very low	31.7	Very low	146 Å²	146	130 Å²	130	90%	0.896	78%	0.779	S	S	*	*			cis	-143.5	-177.6	10.3	65.5	0	0	0	0	109.4
299	G	28.5	Very low	32.1	Very low	65 Å²	65	129 Å²	129	67%	0.67	78%	0.778	S	S	*	*			cis	-171.7	-146	16.8	0	0	0	0	0	114.4
300	M	37.3	Very low	32.3	Very low	186 Å²	186	126 Å²	126	92%	0.916	77%	0.771	S	S	*	*			trans	-154.2	173.1	-164.5	-67.8	-167	91.2	0	0	111
301	P	49.6	Very low	33.3	Very low	109 Å²	109	124 Å²	124	71%	0.708	77%	0.768	S	S	*	*			cis	-138.8	-175.7	12.3	41.7	-22.3	0	0	0	118
302	S	34.8	Very low	33.2	Very low	116 Å²	116	126.4 Å²	126.4	81%	0.811	77%	0.768	S	S	*	*			trans	70.6	143.5	171.8	68	0	0	0	0	117.5
303	G	31.3	Very low	33.4	Very low	63 Å²	63	124.5 Å²	124.5	65%	0.649	77%	0.768	S	S	*	*			cis	141.4	152.7	-8.5	0	0	0	0	0	113.5
304	D	31.3	Very low	33.5	Very low	142 Å²	142	124.3 Å²	124.3	76%	0.759	78%	0.781	S	S	*	*			cis	-163.8	146.5	-7.7	-78	-56.5	0	0	0	110
305	I	33.3	Very low	33.7	Very low	155 Å²	155	120.4 Å²	120.4	80%	0.795	77%	0.771	S	S	*	*			trans	48	120.8	152.3	-52.8	159.5	0	0	0	117.7
306	D	29.8	Very low	33.8	Very low	158 Å²	158	120.3 Å²	120.3	85%	0.845	78%	0.776	S	S	*	*				-176	-178.8	57.1	-153.4	-17.2	0	0	0	110.8
307	G	33.2	Very low	34.2	Very low	75 Å²	75	120.6 Å²	120.6	77%	0.773	78%	0.778	S	S	*	*			trans	130.3	107.1	153.5	0	0	0	0	0	115.7
308	S	33.6	Very low	34.1	Very low	108 Å²	108	120.3 Å²	120.3	76%	0.755	78%	0.784	S	S	*	*			trans	-120.7	175.3	-172.7	52.6	0	0	0	0	114.4
309	V	34.2	Very low	34.3	Very low	130 Å²	130	121.4 Å²	121.4	79%	0.788	78%	0.783	S	S	*	*			trans	103.3	120.2	159.4	-170.9	0	0	0	0	118.3
310	D	31.8	Very low	35.6	Very low	142 Å²	142	123.5 Å²	123.5	76%	0.759	79%	0.785	S	S	*	*			trans	-61.5	-176.4	167.1	-63.9	-81.9	0	0	0	116.3
311	P	52.9	Low	35.2	Very low	104 Å²	104	119.7 Å²	119.7	68%	0.675	78%	0.777	S	S	*	*			cis	-134.5	-168.1	-26.7	25.6	-2.2	0	0	0	113.5
312	E	29.9	Very low	34.4	Very low	173 Å²	173	121.3 Å²	121.3	81%	0.808	78%	0.784	S	S	*	*			trans	91.9	144.7	133.2	-106.6	-175.2	175.5	0	0	123
313	V	35.2	Very low	34.3	Very low	128 Å²	128	121.7 Å²	121.7	78%	0.776	79%	0.787	S	S	*	*			trans	77.4	120.4	156.9	176.2	0	0	0	0	121.3
314	S	30.6	Very low	34.2	Very low	122 Å²	122	122 Å²	122	85%	0.853	79%	0.791	S	S	*	*			trans	-39.3	147.1	164.5	-44.7	0	0	0	0	118.1
315	G	30.8	Very low	34.6	Very low	70 Å²	70	121.3 Å²	121.3	72%	0.722	80%	0.797	S	S	*	*			trans	-177.8	67.3	173.7	0	0	0	0	0	117.6
316	T	33.9	Very low	34.4	Very low	129 Å²	129	117 Å²	117	79%	0.791	79%	0.79	S	S	*	*			trans	11.8	129.3	141	56	0	0	0	0	121.8
317	S	33.2	Very low	34.8	Very low	124 Å²	124	116.8 Å²	116.8	87%	0.867	79%	0.789	S	S	*	*			trans	58.9	119.3	142.5	62.9	0	0	0	0	121.4
318	G	30.9	Very low	34.6	Very low	82 Å²	82	118.4 Å²	118.4	85%	0.845	78%	0.783	S	S	*	*			trans	-172.1	110.3	164.8	0	0	0	0	0	115.1
319	L	33.7	Very low	34.5	Very low	169 Å²	169	119.2 Å²	119.2	89%	0.885	78%	0.783	S	S	*	*			trans	-124.9	164.6	168.3	-79.6	168.5	0	0	0	108
320	P	56.5	Low	34.3	Very low	109 Å²	109	119.4 Å²	119.4	71%	0.708	78%	0.779	S	S	*	*			cis	-133.6	-139.4	-37.3	39.7	-21.3	0	0	0	110.1
321	S	28.6	Very low	34	Very low	105 Å²	105	120.5 Å²	120.5	73%	0.734	78%	0.784	S	S	*	*			trans	77.9	119.5	176.1	73.2	0	0	0	0	115.4
322	V	32.5	Very low	33	Very low	144 Å²	144	121 Å²	121	87%	0.873	79%	0.785	S	S	*	*			cis	90.5	115.7	49.2	166.6	0	0	0	0	112.9
323	S	33.6	Very low	32.7	Very low	124 Å²	124	119.3 Å²	119.3	87%	0.867	79%	0.786	S	S	*	*				169.5	140.7	119.2	-170.1	0	0	0	0	114.4
324	G	29.3	Very low	32.6	Very low	70 Å²	70	120.7 Å²	120.7	72%	0.722	79%	0.788	S	S	*	*			trans	117.3	149.4	145	0	0	0	0	0	118.2
325	S	38	Very low	32.7	Very low	127 Å²	127	125.8 Å²	125.8	89%	0.888	79%	0.788	S	S	*	*			cis	-170.5	135.5	-16.7	-168.5	0	0	0	0	112.5
326	G	30.5	Very low	33.3	Very low	63 Å²	63	127 Å²	127	65%	0.649	78%	0.784	S	S	*	*			trans	71.7	176.8	164	0	0	0	0	0	117.6
327	D	36.9	Very low	33.3	Very low	154 Å²	154	129 Å²	129	82%	0.824	78%	0.784	S	S	*	*			cis	-175	155.1	-9.7	-114.1	23.8	0	0	0	109.2
328	V	30.8	Very low	33.2	Very low	109 Å²	109	131.6 Å²	131.6	66%	0.661	78%	0.782	S	S	*	*			cis	-170.5	145.4	-19.8	96.7	0	0	0	0	111.1
329	V	29.8	Very low	33.4	Very low	125 Å²	125	135.4 Å²	135.4	76%	0.758	78%	0.778	S	S	*	*			trans	66.7	150.9	153.7	164	0	0	0	0	119.8
330	I	30.1	Very low	33.6	Very low	135 Å²	135	133 Å²	133	69%	0.692	77%	0.773	S	S	*	*			cis	-170.4	141.6	-29.1	-102.8	168.6	0	0	0	107.3
331	L	25.7	Very low	32.6	Very low	165 Å²	165	136.6 Å²	136.6	86%	0.864	78%	0.777	S	S	*	*			trans	177.3	169	132	-108	144.3	0	0	0	113
332	V	32.6	Very low	33.2	Very low	115 Å²	115	136.7 Å²	136.7	70%	0.697	78%	0.776	S	S	*	*			trans	-139.3	143.5	-154.9	174.8	0	0	0	0	113
333	T	24.3	Very low	32.9	Very low	136 Å²	136	136.3 Å²	136.3	83%	0.834	77%	0.774	S	S	*	*			trans	-159.6	106.6	150.9	1.1	0	0	0	0	114.7
334	I	32.4	Very low	33	Very low	157 Å²	157	136.5 Å²	136.5	81%	0.805	77%	0.77	S	S	*	*			trans	38.7	142	135.1	-43.9	-178.2	0	0	0	122.4
335	R	31.8	Very low	32.9	Very low	230 Å²	230	139.6 Å²	139.6	87%	0.868	78%	0.775	S	S	*	*			trans	-62	-173.7	170.1	-68.8	-175.2	177.5	-173.2	-1.7	114.5
336	P	44.2	Very low	32.5	Very low	96 Å²	96	142.8 Å²	142.8	62%	0.623	77%	0.773	S	S	*	*			cis	-149.6	-173.2	17.5	46.3	-24.9	0	0	0	119.9
337	E	33.5	Very low	32.6	Very low	169 Å²	169	145.5 Å²	145.5	79%	0.79	78%	0.782	S	S	*	*			trans	62.5	159.1	149.3	-76.3	146.6	-153.9	0	0	118.9
338	E	30.9	Very low	33.2	Very low	179 Å²	179	143.4 Å²	143.4	84%	0.836	78%	0.776	S	S	*	*			cis	-152.4	173	-0.2	-138.9	171.5	-174.4	0	0	110.9
339	E	36.8	Very low	33.2	Very low	163 Å²	163	146.6 Å²	146.6	76%	0.762	78%	0.784	S	S	*	*			trans	-79.4	154.6	165.1	-101.5	-174	-144.3	0	0	110.8
340	P	36.8	Very low	33.2	Very low	119 Å²	119	149.6 Å²	149.6	77%	0.773	79%	0.79	S	S	*	*				-162.2	178.1	70.3	44.6	-22.9	0	0	0	119.6
341	F	36.3	Very low	33.2	Very low	183 Å²	183	146.8 Å²	146.8	80%	0.803	79%	0.794	S	S	*	*			trans	-71	159.2	155.3	-68.9	-90.1	0	0	0	111
342	P	40.8	Very low	33.3	Very low	108 Å²	108	148.1 Å²	148.1	70%	0.701	79%	0.793	S	S	*	*				-166.7	171	73.4	43.5	-20	0	0	0	121.6
343	T	25.1	Very low	33.2	Very low	136 Å²	136	147.8 Å²	147.8	83%	0.834	79%	0.791	S	S	*	*			trans	68.2	158.5	143.3	45.1	0	0	0	0	124.3
344	T	37	Very low	33.4	Very low	128 Å²	128	147.6 Å²	147.6	79%	0.785	79%	0.79	S	S	*	*			trans	-113.9	153.4	-177.5	49.2	0	0	0	0	113
345	T	25.8	Very low	33.5	Very low	134 Å²	134	146 Å²	146	82%	0.822	79%	0.793	S	S	*	*			trans	-172.8	126.8	146.4	7.2	0	0	0	0	117.3
346	K	30.3	Very low	33.6	Very low	195 Å²	195	140.6 Å²	140.6	85%	0.848	79%	0.785	S	S	*	*			trans	35.8	121.9	139.9	-65.2	178.8	177.8	-177.8	0	124.6
347	S	33.3	Very low	33.1	Very low	119 Å²	119	145.4 Å²	145.4	83%	0.832	80%	0.8	S	S	*	*				53.1	171.5	117.3	-116.4	0	0	0	0	122.2
348	P	48.8	Very low	33.2	Very low	110 Å²	110	146.4 Å²	146.4	71%	0.714	80%	0.804	S	S	*	*			cis	-140	-167.6	-1.3	30.8	-4.5	0	0	0	116.8
349	E	31.7	Very low	33.3	Very low	177 Å²	177	141.2 Å²	141.2	83%	0.827	80%	0.798	S	S	*	*			trans	125.8	144.9	144.7	-68	-164.1	149.6	0	0	121.7
350	E	29.3	Very low	33.8	Very low	187 Å²	187	139.7 Å²	139.7	87%	0.874	80%	0.803	S	S	*	*			trans	11.3	144.2	172.6	-52.6	-168.1	130.9	0	0	123.1
351	G	29	Very low	34	Very low	76 Å²	76	139.1 Å²	139.1	78%	0.784	80%	0.801	S	S	*	*			cis	128.9	118.7	-8.8	0	0	0	0	0	116.2
352	K	29.3	Very low	34	Very low	193 Å²	193	133.7 Å²	133.7	84%	0.839	80%	0.797	S	S	*	*			trans	-168.2	137.8	160.3	-159.7	162.1	-179.1	173.4	0	115.8
353	T	28.9	Very low	33.9	Very low	108 Å²	108	137.6 Å²	137.6	66%	0.663	80%	0.804	S	S	*	*			trans	42.6	112.6	163.1	51.2	0	0	0	0	119.3
354	T	30.4	Very low	34.7	Very low	132 Å²	132	137 Å²	137	81%	0.81	80%	0.802	S	S	*	*				76.7	101.1	50.5	72.5	0	0	0	0	117.3
355	S	32.7	Very low	35.1	Very low	123 Å²	123	138.1 Å²	138.1	86%	0.86	80%	0.802	S	S	*	*			trans	-145	136.1	138	52.3	0	0	0	0	107.6
356	V	33.8	Very low	36.2	Very low	118 Å²	118	137.3 Å²	137.3	72%	0.715	80%	0.799	S	S	*	*			trans	-121.2	134	-174.7	174.6	0	0	0	0	109.2	E358	V356-E358 HydrophobicContact CG1-CG 4.09Å
357	E	33.9	Very low	36.8	Very low	197 Å²	197	136.9 Å²	136.9	92%	0.921	80%	0.8	S	S	*	*			trans	-132.6	146.3	145.8	-70.7	-159.7	138.1	0	0	108.4
358	E	36.4	Very low	37.5	Very low	190 Å²	190	139.9 Å²	139.9	89%	0.888	80%	0.801	S	S	*	*			trans	-104.9	129.4	-176.1	-63.9	-179.1	130.1	0	0	110.4	V356	V356-E358 HydrophobicContact CG1-CG 4.09Å
359	G	33.7	Very low	37.6	Very low	69 Å²	69	140.4 Å²	140.4	71%	0.711	81%	0.805	S	S	*	*			trans	-121	140.6	168.9	0	0	0	0	0	109.8
360	P	45.6	Very low	38.5	Very low	132 Å²	132	139.3 Å²	139.3	86%	0.857	81%	0.805	S	S	*	*			trans	-75.6	151.1	-162.5	29.1	-35.8	0	0	0	114.3	G362	P360-G362 PolarHBondContact O-N 3.4Å
361	S	42.6	Very low	39.7	Very low	106 Å²	106	137 Å²	137	74%	0.741	79%	0.794	S	S	*	*			trans	-64.5	110.5	178.9	55.1	0	0	0	0	113.2
362	G	35.5	Very low	40.7	Very low	69 Å²	69	138.9 Å²	138.9	71%	0.711	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-79.1	128	153.3	0	0	0	0	0	109.9	P360	P360-G362 PolarHBondContact O-N 3.4Å
363	F	39.7	Very low	41.9	Very low	191 Å²	191	137.9 Å²	137.9	84%	0.838	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-74.5	134	163.9	-77.5	-100.8	0	0	0	108.2	L365	F363-L365 PolarHBondContact O-N 2.89Å
364	P	41.1	Very low	43	Very low	124 Å²	124	138.6 Å²	138.6	81%	0.805	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-59.2	124	163.6	-19.9	32.4	0	0	0	109
365	L	45.8	Very low	43.8	Very low	151 Å²	151	139.4 Å²	139.4	79%	0.791	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-65	149.5	155.2	-74.8	164.4	0	0	0	107.5	F363 E367	F363-L365 PolarHBondContact O-N 2.89Å; L365-E367 PolarHBondContact O-N 3.03Å
366	P	47.5	Very low	44.4	Very low	117 Å²	117	135.6 Å²	135.6	76%	0.76	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-60.4	124.4	169.2	-15.9	29.8	0	0	0	108.3	E368	P366-E368 PolarHBondContact O-N 3.11Å
367	E	43.5	Very low	45.2	Very low	186 Å²	186	138.7 Å²	138.7	87%	0.869	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-59.3	129.3	161.2	-69.1	165.1	149.5	0	0	106.9	L365	L365-E367 PolarHBondContact O-N 3.03Å
368	E	48.7	Very low	46	Very low	181 Å²	181	132.5 Å²	132.5	85%	0.846	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-64	130.7	171.5	-64.6	-166.1	145.6	0	0	107.2	P366 D370	P366-E368 PolarHBondContact O-N 3.11Å; E368-D370 PolarHBondContact O-N 2.93Å
369	P	51.1	Low	47.3	Very low	122 Å²	122	128.5 Å²	128.5	79%	0.792	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-63.6	127.3	-177.1	26.6	-33.7	0	0	0	108.9	E371	P369-E371 PolarHBondContact O-N 3.02Å
370	D	50.1	Low	49.7	Very low	154 Å²	154	129.1 Å²	129.1	82%	0.824	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-46.9	127.6	178.7	-64.5	-72	0	0	0	110.6	E368 P372	E368-D370 PolarHBondContact O-N 2.93Å; D370-P372 WeakPolarHBondContact O-CD 3.49Å
371	E	53.8	Low	51.7	Low	138 Å²	138	123.1 Å²	123.1	65%	0.645	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-56.1	117.1	171	-72.2	-169.9	135.4	0	0	106.8	P369 E373 K398	P369-E371 PolarHBondContact O-N 3.02Å; E371-E373 PolarHBondContact O-N 3.11Å; E371-K398 IonicContact OE1-NZ 2.65Å; E371-K398 PolarHBondContact OE1-NZ 3.14Å; E371-K398 IonicContact OE2-NZ 2.71Å; E371-K398 PolarHBondContact OE2-NZ 2.84Å
372	P	51.5	Low	53.9	Low	115 Å²	115	121 Å²	121	75%	0.747	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-61.4	126.1	-169.6	22.9	-33.4	0	0	0	109.5	D370 V374	D370-P372 WeakPolarHBondContact O-CD 3.49Å; P372-V374 PolarHBondContact O-N 3.16Å
373	E	53.7	Low	56.4	Low	172 Å²	172	124.1 Å²	124.1	80%	0.804	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-54.2	119.1	177.1	-67.6	-160	135	0	0	109.1	E371 I375	E371-E373 PolarHBondContact O-N 3.11Å; E373-I375 PolarHBondContact O-N 2.99Å
374	V	52.1	Low	58.8	Low	123 Å²	123	118.1 Å²	118.1	75%	0.745	66%	0.655	S	S	*	*			trans	-71.4	101.8	-175.6	-178.2	0	0	0	0	108.3	P372 D376	P372-V374 PolarHBondContact O-N 3.16Å; V374-D376 HydrophobicContact CG1-CB 4.3Å; V374-D376 PolarHBondContact O-N 2.87Å
375	I	46.3	Very low	61.4	Low	150 Å²	150	112.5 Å²	112.5	77%	0.769	62%	0.619	S	S	*	*			trans	-71.5	83.4	170.5	-52.9	177.3	0	0	0	107.2	E373 E377	E373-I375 PolarHBondContact O-N 2.99Å; I375-E377 HydrophobicContact CG2-CB 4.34Å; I375-E377 HydrophobicContact CG2-CG 4.42Å; I375-E377 PolarHBondContact O-N 2.85Å
376	D	46.4	Very low	63.7	Low	43 Å²	43	109.2 Å²	109.2	23%	0.23	61%	0.605	C	S	.	*			trans	-77	32.6	-172.6	-156.9	25.1	0	0	0	113.7	V374 G378	V374-D376 HydrophobicContact CG1-CB 4.3Å; V374-D376 PolarHBondContact O-N 2.87Å; D376-G378 VanDerWaalsContact C-N 3.27Å; D376-G378 PolarHBondContact O-N 2.99Å; D376-G378 VanDerWaalsContact O-N 3.1Å
377	E	50.8	Low	66	Low	182 Å²	182	105.8 Å²	105.8	85%	0.85	58%	0.583	S	S	*	*	S	Bend	trans	-83.8	67.1	173.9	-75.4	-72.3	172.5	0	0	110.1	I375	I375-E377 HydrophobicContact CG2-CB 4.34Å; I375-E377 HydrophobicContact CG2-CG 4.42Å; I375-E377 PolarHBondContact O-N 2.85Å
378	G	51	Low	68.4	Low	68 Å²	68	102.1 Å²	102.1	70%	0.701	57%	0.569	S	S	*	*	S	Bend	trans	152	-6.6	164.2	0	0	0	0	0	119	D376	D376-G378 VanDerWaalsContact C-N 3.27Å; D376-G378 PolarHBondContact O-N 2.99Å; D376-G378 VanDerWaalsContact O-N 3.1Å
379	L	63	Low	70.3	Confident	105 Å²	105	97.7 Å²	97.7	55%	0.55	57%	0.572	S	S	.	*			trans	-83.3	132.5	173.5	-89.6	72	0	0	0	110.3	V381	L379-V381 PolarHBondContact O-N 2.66Å
380	P	82.9	Confident	72.3	Confident	82 Å²	82	93 Å²	93	53%	0.532	55%	0.545	S	S	.	.			trans	-59.1	128.2	167.7	-23	32.8	0	0	0	110.2	C382 L383	P380-C382 PolarHBondContact O-N 3.11Å; P380-L383 HydrophobicContact CB-CG 4.39Å; P380-L383 HydrophobicContact CG-CD1 4.38Å; P380-L383 WeakPolarHBondContact O-CB 3.46Å; P380-L383 PolarHBondContact O-N 3.37Å
381	V	88.2	Confident	74.5	Confident	7 Å²	7	86.4 Å²	86.4	4%	0.042	51%	0.511	C	S	.	.	H	α-helix	trans	-53.8	-29.5	-177.8	176.8	0	0	0	0	112.6	L379 L383 L384 C385 V392 P403 P404 L405	L379-V381 PolarHBondContact O-N 2.66Å; V381-L383 PolarHBondContact O-N 3.13Å; V381-L383 VanDerWaalsContact O-N 3.14Å; V381-L384 PolarHBondContact O-N 3.25Å; V381-L384 VanDerWaalsContact O-N 3.11Å; V381-C385 HydrophobicContact CG1-CB 4.02Å; V381-C385 WeakPolarHBondContact O-CA 3.4Å; V381-C385 WeakPolarHBondContact O-CB 3.24Å; V381-C385 PolarHBondContact O-N 3.14Å; V381-V392 HydrophobicContact CG1-CG1 4.11Å; V381-P403 HydrophobicContact CG1-CB 4.24Å; V381-P403 HydrophobicContact CG1-CG 3.99Å; V381-P403 HydrophobicContact CG2-CB 3.9Å; V381-P403 HydrophobicContact CG2-CG 4.46Å; V381-P404 HydrophobicContact CG2-CG 3.86Å; V381-P404 WeakPolarHBondContact CG2-O 3.42Å; V381-L405 HydrophobicContact CG1-CD2 4.36Å
382	C	88.8	Confident	76.6	Confident	62 Å²	62	79.9 Å²	79.9	42%	0.419	48%	0.481	S	S	.	.	H	α-helix	trans	-72.2	5.6	174.9	-54.6	0	0	0	0	115.8	P380 C385 C387	P380-C382 PolarHBondContact O-N 3.11Å; C382-C385 CarbonylContact C-O 3.57Å; C382-C385 VanDerWaalsContact C-O 3.32Å; C382-C385 WeakPolarHBondContact CA-O 3.33Å; C382-C387 WeakPolarHBondContact CA-SG 3.45Å; C382-C387 HydrophobicContact CB-CB 3.71Å; C382-C387 WeakPolarHBondContact CB-SG 3.39Å; C382-C387 WeakPolarHBondContact SG-CB 3.3Å; C382-C387 CovalentContact SG-SG 2.03Å; C382-C387 PolarHBondContact SG-SG 3.47Å
383	L	88.3	Confident	78.8	Confident	133 Å²	133	78.2 Å²	78.2	70%	0.696	46%	0.461	S	S	*	.	H	α-helix	trans	-99.8	-28.3	165.2	-60.6	-175	0	0	0	112.6	P380 V381	P380-L383 HydrophobicContact CB-CG 4.39Å; P380-L383 HydrophobicContact CG-CD1 4.38Å; P380-L383 WeakPolarHBondContact O-CB 3.46Å; P380-L383 PolarHBondContact O-N 3.37Å; V381-L383 PolarHBondContact O-N 3.13Å; V381-L383 VanDerWaalsContact O-N 3.14Å
384	L	90.1	Very high	80.9	Confident	65 Å²	65	70 Å²	70	34%	0.34	42%	0.422	S	S	.	.	H	α-helix	trans	-89	-42.2	177.9	177.4	57.5	0	0	0	110.9	V381 L397 L399	V381-L384 PolarHBondContact O-N 3.25Å; V381-L384 VanDerWaalsContact O-N 3.11Å; L384-L397 HydrophobicContact CD1-CD1 4.33Å; L384-L397 HydrophobicContact CG-CD1 4.18Å; L384-L397 VanDerWaalsContact O-CD1 3.24Å; L384-L397 WeakPolarHBondContact O-CD1 3.12Å; L384-L399 HydrophobicContact CD2-CD2 3.99Å
385	C	94.9	Very high	83	Confident	7 Å²	7	66.4 Å²	66.4	5%	0.047	40%	0.399	C	S	.	.	S	Bend	trans	-110.9	161.3	179.4	-55.7	0	0	0	0	111.2	V381 C382 V392 Y393 C394 L397	V381-C385 HydrophobicContact CG1-CB 4.02Å; V381-C385 WeakPolarHBondContact O-CA 3.4Å; V381-C385 WeakPolarHBondContact O-CB 3.24Å; V381-C385 PolarHBondContact O-N 3.14Å; C382-C385 CarbonylContact C-O 3.57Å; C382-C385 VanDerWaalsContact C-O 3.32Å; C382-C385 WeakPolarHBondContact CA-O 3.33Å; C385-V392 HydrophobicContact CB-CG1 4.03Å; C385-Y393 WeakPolarHBondContact CA-O 3.48Å; C385-Y393 VanDerWaalsContact CB-O 3.27Å; C385-Y393 WeakPolarHBondContact CB-O 3.44Å; C385-C394 HydrophobicContact CB-CB 4.02Å; C385-C394 WeakPolarHBondContact CB-SG 3.32Å; C385-C394 VanDerWaalsContact SG-CA 3.56Å; C385-C394 WeakPolarHBondContact SG-CB 3.38Å; C385-C394 CovalentContact SG-SG 2.03Å; C385-C394 PolarHBondContact SG-SG 3.01Å; C385-L397 HydrophobicContact CB-CD1 4.46Å
386	T	95.4	Very high	85.4	Confident	82 Å²	82	65 Å²	65	50%	0.503	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	123.7	174.6	-64.6	0	0	0	0	110.7	L388 Y393	T386-L388 HydrophobicContact CG2-CD1 3.92Å; T386-L388 HydrophobicContact CG2-CG 3.95Å; T386-Y393 PolarHBondContact N-O 3.14Å; T386-Y393 WeakPolarHBondContact O-CD2 3.36Å; T386-Y393 PolarHBondContact O-N 3.35Å
387	C	95.3	Very high	87.7	Confident	44 Å²	44	66 Å²	66	30%	0.297	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	123.2	177.2	-64.5	0	0	0	0	111.4	C382 S391	C382-C387 WeakPolarHBondContact CA-SG 3.45Å; C382-C387 HydrophobicContact CB-CB 3.71Å; C382-C387 WeakPolarHBondContact CB-SG 3.39Å; C382-C387 WeakPolarHBondContact SG-CB 3.3Å; C382-C387 CovalentContact SG-SG 2.03Å; C382-C387 PolarHBondContact SG-SG 3.47Å; C387-S391 CarbonylContact C-O 3.57Å; C387-S391 WeakPolarHBondContact CA-O 3.42Å
388	L	94.2	Very high	89.9	Confident	110 Å²	110	61.6 Å²	61.6	58%	0.576	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.3	115	-177.7	-67.5	172.1	0	0	0	111	T386 G390 S391 Y393	T386-L388 HydrophobicContact CG2-CD1 3.92Å; T386-L388 HydrophobicContact CG2-CG 3.95Å; L388-G390 VanDerWaalsContact C-N 3.3Å; L388-G390 PolarHBondContact O-N 3.22Å; L388-S391 PolarHBondContact N-O 3.29Å; L388-S391 VanDerWaalsContact O-CB 3.3Å; L388-S391 WeakPolarHBondContact O-CB 3.48Å; L388-S391 PolarHBondContact O-N 2.93Å; L388-Y393 HydrophobicContact CB-CE2 4.41Å
389	G	88.3	Confident	92	Very high	87 Å²	87	59.4 Å²	59.4	90%	0.897	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	61	32.2	171.8	0	0	0	0	0	115.2	S391	G389-S391 VanDerWaalsContact C-N 3.29Å
390	G	92.3	Very high	93.5	Very high	23 Å²	23	58.7 Å²	58.7	24%	0.237	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.7	-1	-172.3	0	0	0	0	0	114.5	L388 T409 T410	L388-G390 VanDerWaalsContact C-N 3.3Å; L388-G390 PolarHBondContact O-N 3.22Å; G390-T409 CarbonylContact O-C 3.45Å; G390-T409 VanDerWaalsContact O-CA 3.25Å; G390-T409 WeakPolarHBondContact O-CA 3.35Å; G390-T409 WeakPolarHBondContact O-CG2 3.43Å; G390-T410 PolarHBondContact O-N 3.3Å; G390-T410 PolarHBondContact O-OG1 3.35Å
391	S	97.4	Very high	94.1	Very high	16 Å²	16	64.5 Å²	64.5	11%	0.112	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	137.3	169.8	-57.9	0	0	0	0	110.8	C387 L388 G389 H411	C387-S391 CarbonylContact C-O 3.57Å; C387-S391 WeakPolarHBondContact CA-O 3.42Å; L388-S391 PolarHBondContact N-O 3.29Å; L388-S391 VanDerWaalsContact O-CB 3.3Å; L388-S391 WeakPolarHBondContact O-CB 3.48Å; L388-S391 PolarHBondContact O-N 2.93Å; G389-S391 VanDerWaalsContact C-N 3.29Å; S391-H411 CarbonylContact C-O 3.32Å; S391-H411 VanDerWaalsContact CA-O 3.31Å; S391-H411 WeakPolarHBondContact CA-O 3.12Å
392	V	97.5	Very high	94.4	Very high	2 Å²	2	65 Å²	65	1%	0.012	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	123.6	177.7	-179.6	0	0	0	0	109.6	V381 C385 L405 P406 T409 H411 F412 Y413	V381-V392 HydrophobicContact CG1-CG1 4.11Å; C385-V392 HydrophobicContact CB-CG1 4.03Å; V392-L405 HydrophobicContact CG1-CD2 4.33Å; V392-P406 HydrophobicContact CG2-CG 4.47Å; V392-T409 HydrophobicContact CB-CG2 4.28Å; V392-T409 HydrophobicContact CG2-CG2 3.78Å; V392-H411 PolarHBondContact N-O 3.28Å; V392-F412 HydrophobicContact CB-CD2 4.35Å; V392-F412 HydrophobicContact CG1-CD2 4.37Å; V392-Y413 PolarHBondContact O-N 2.96Å
393	Y	97.7	Very high	94.7	Very high	80 Å²	80	62.4 Å²	62.4	31%	0.314	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	109.1	-176.7	-57.8	-89.6	0	0	0	110.8	C385 T386 L388 Y413	C385-Y393 WeakPolarHBondContact CA-O 3.48Å; C385-Y393 VanDerWaalsContact CB-O 3.27Å; C385-Y393 WeakPolarHBondContact CB-O 3.44Å; T386-Y393 PolarHBondContact N-O 3.14Å; T386-Y393 WeakPolarHBondContact O-CD2 3.36Å; T386-Y393 PolarHBondContact O-N 3.35Å; L388-Y393 HydrophobicContact CB-CE2 4.41Å; Y393-Y413 AromaticContact CD1-CD2 3.44Å; Y393-Y413 HydrophobicContact CD1-CD2 3.44Å; Y393-Y413 VanDerWaalsContact CD1-CD2 3.44Å; Y393-Y413 HydrophobicContact CD1-CE2 4.1Å; Y393-Y413 AromaticContact CD1-CG 3.83Å; Y393-Y413 HydrophobicContact CD1-CG 3.83Å; Y393-Y413 AromaticContact CE1-CD2 3.28Å; Y393-Y413 HydrophobicContact CE1-CD2 3.28Å; Y393-Y413 AromaticContact CE1-CE2 3.43Å; Y393-Y413 HydrophobicContact CE1-CE2 3.43Å; Y393-Y413 VanDerWaalsContact CE1-CE2 3.43Å; Y393-Y413 AromaticContact CE1-CG 3.92Å; Y393-Y413 HydrophobicContact CE1-CG 3.92Å; Y393-Y413 HydrophobicContact CG-CD2 4.25Å; Y393-Y413 AromaticContact CZ-CD2 3.99Å; Y393-Y413 AromaticContact CZ-CE2 3.83Å
394	C	97.1	Very high	94.9	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	34%	0.336	C	S	.	.			trans	-119.7	25.9	-175.7	-64.5	0	0	0	0	112.5	C385 L397 L399 F412 Y413 A414 N417	C385-C394 HydrophobicContact CB-CB 4.02Å; C385-C394 WeakPolarHBondContact CB-SG 3.32Å; C385-C394 VanDerWaalsContact SG-CA 3.56Å; C385-C394 WeakPolarHBondContact SG-CB 3.38Å; C385-C394 CovalentContact SG-SG 2.03Å; C385-C394 PolarHBondContact SG-SG 3.01Å; C394-L397 HydrophobicContact CB-CD1 4.09Å; C394-L399 HydrophobicContact CB-CD1 3.8Å; C394-F412 HydrophobicContact CB-CE2 4.38Å; C394-Y413 PolarHBondContact N-O 3.39Å; C394-A414 HydrophobicContact CB-CB 3.89Å; C394-N417 PolarHBondContact O-ND2 2.03Å
395	D	97.4	Very high	95	Very high	46 Å²	46	58.1 Å²	58.1	25%	0.246	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	139.4	-174.2	-59.7	-52.1	0	0	0	113	L397 R415	D395-L397 VanDerWaalsContact C-N 3.31Å; D395-L397 PolarHBondContact O-N 3.18Å; D395-R415 WeakPolarHBondContact CA-O 3.29Å; D395-R415 VanDerWaalsContact OD1-CB 3.23Å; D395-R415 WeakPolarHBondContact OD1-CB 3.06Å; D395-R415 WeakPolarHBondContact OD1-CG 3.16Å; D395-R415 IonicContact OD1-CZ 2.76Å; D395-R415 PolarHBondContact OD1-N 2.97Å; D395-R415 IonicContact OD1-NE 3.5Å; D395-R415 PolarHBondContact OD1-NE 3.38Å; D395-R415 IonicContact OD1-NH2 2.65Å; D395-R415 IonicContact OD2-CZ 2.85Å; D395-R415 IonicContact OD2-NE 3.87Å; D395-R415 PolarHBondContact OD2-NE 3.44Å; D395-R415 IonicContact OD2-NH2 3.72Å; D395-R415 PolarHBondContact OD2-NH2 2.96Å
396	D	96.6	Very high	94.9	Very high	120 Å²	120	59.7 Å²	59.7	64%	0.642	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.1	36.5	175.8	-162.6	23.9	0	0	0	115.3	R415	D396-R415 PolarHBondContact N-O 2.91Å
397	L	95.5	Very high	94.7	Very high	64 Å²	64	63.2 Å²	63.2	34%	0.335	34%	0.343	S	S	.	.	S	Bend	trans	-97.5	15.8	178.3	-64.1	-178.4	0	0	0	113.3	L384 C385 C394 D395 L399 N417	L384-L397 HydrophobicContact CD1-CD1 4.33Å; L384-L397 HydrophobicContact CG-CD1 4.18Å; L384-L397 VanDerWaalsContact O-CD1 3.24Å; L384-L397 WeakPolarHBondContact O-CD1 3.12Å; C385-L397 HydrophobicContact CB-CD1 4.46Å; C394-L397 HydrophobicContact CB-CD1 4.09Å; D395-L397 VanDerWaalsContact C-N 3.31Å; D395-L397 PolarHBondContact O-N 3.18Å; L397-L399 HydrophobicContact CB-CD1 4.32Å; L397-L399 HydrophobicContact CB-CD2 4.06Å; L397-L399 HydrophobicContact CB-CG 3.83Å; L397-L399 PolarHBondContact O-N 3.5Å; L397-L399 VanDerWaalsContact O-N 3.11Å; L397-N417 PolarHBondContact N-OD1 3.1Å
398	K	95.6	Very high	94.6	Very high	91 Å²	91	65.6 Å²	65.6	40%	0.396	35%	0.353	S	S	.	.			trans	55	16.2	-173.5	-52.9	176	179.5	174.1	0	115.3	E371 N400 N417	E371-K398 IonicContact OE1-NZ 2.65Å; E371-K398 PolarHBondContact OE1-NZ 3.14Å; E371-K398 IonicContact OE2-NZ 2.71Å; E371-K398 PolarHBondContact OE2-NZ 2.84Å; K398-N400 PolarHBondContact O-N 3.15Å; K398-N417 PolarHBondContact N-OD1 3.49Å; K398-N417 VanDerWaalsContact N-OD1 3.09Å
399	L	94.9	Very high	94.7	Very high	21 Å²	21	60.4 Å²	60.4	11%	0.11	33%	0.326	C	S	.	.			trans	-60.1	130.3	-168.3	-58.2	177	0	0	0	112.7	L384 C394 L397 P403 N417 R418 I419	L384-L399 HydrophobicContact CD2-CD2 3.99Å; C394-L399 HydrophobicContact CB-CD1 3.8Å; L397-L399 HydrophobicContact CB-CD1 4.32Å; L397-L399 HydrophobicContact CB-CD2 4.06Å; L397-L399 HydrophobicContact CB-CG 3.83Å; L397-L399 PolarHBondContact O-N 3.5Å; L397-L399 VanDerWaalsContact O-N 3.11Å; L399-P403 HydrophobicContact CD1-CG 4.21Å; L399-N417 HydrophobicContact CB-CB 4.19Å; L399-N417 PolarHBondContact N-OD1 3.25Å; L399-R418 CarbonylContact O-C 3.39Å; L399-R418 VanDerWaalsContact O-CA 3.24Å; L399-R418 WeakPolarHBondContact O-CA 3.39Å; L399-R418 WeakPolarHBondContact O-CB 3.47Å; L399-R418 PolarHBondContact O-N 2.03Å; L399-I419 HydrophobicContact CB-CG1 4.41Å; L399-I419 WeakPolarHBondContact O-CG1 3.49Å; L399-I419 PolarHBondContact O-N 3.12Å
400	N	95.4	Very high	95.1	Very high	91 Å²	91	57.9 Å²	57.9	49%	0.487	29%	0.293	S	S	.	.	S	Bend	trans	-90	-12.8	179.3	-64.7	-40.1	0	0	0	113.6	K398 R418	K398-N400 PolarHBondContact O-N 3.15Å; N400-R418 WeakPolarHBondContact OD1-CB 3.31Å
401	R	94.9	Very high	95.4	Very high	203 Å²	203	59.4 Å²	59.4	77%	0.766	29%	0.294	S	S	*	.	S	Bend	trans	-147.6	168.6	-179.4	-60.2	-172.6	-172.3	-172.3	5	110
402	V	95.6	Very high	95.5	Very high	17 Å²	17	58.6 Å²	58.6	10%	0.103	29%	0.288	C	S	.	.			trans	-70.4	129.5	168.1	-179.1	0	0	0	0	109.1	L405 F412 I419 D426 F427	V402-L405 HydrophobicContact CG1-CD1 4.19Å; V402-L405 HydrophobicContact CG1-CG 4.23Å; V402-F412 HydrophobicContact CG1-CE1 3.89Å; V402-F412 HydrophobicContact CG1-CZ 3.93Å; V402-F412 HydrophobicContact CG2-CE1 4.36Å; V402-I419 HydrophobicContact CG2-CD1 4.35Å; V402-I419 HydrophobicContact CG2-CG2 4.48Å; V402-D426 HydrophobicContact CB-CB 3.91Å; V402-D426 HydrophobicContact CG1-CB 4.08Å; V402-D426 HydrophobicContact CG2-CB 4.18Å; V402-F427 HydrophobicContact CG1-CE1 4.31Å; V402-F427 HydrophobicContact CG1-CZ 4.31Å; V402-F427 HydrophobicContact CG2-CZ 4.26Å
403	P	93.3	Very high	95.5	Very high	8 Å²	8	60.1 Å²	60.1	5%	0.052	29%	0.294	C	S	.	.			trans	-79.9	160.8	177.5	34	-34.7	0	0	0	111.3	V381 L399 L405	V381-P403 HydrophobicContact CG1-CB 4.24Å; V381-P403 HydrophobicContact CG1-CG 3.99Å; V381-P403 HydrophobicContact CG2-CB 3.9Å; V381-P403 HydrophobicContact CG2-CG 4.46Å; L399-P403 HydrophobicContact CD1-CG 4.21Å; P403-L405 HydrophobicContact CG-CD2 4.11Å; P403-L405 WeakPolarHBondContact O-CD2 3.37Å; P403-L405 VanDerWaalsContact O-CG 3.32Å; P403-L405 WeakPolarHBondContact O-CG 3.32Å; P403-L405 PolarHBondContact O-N 3.01Å
404	P	92.4	Very high	95.5	Very high	91 Å²	91	56.3 Å²	56.3	59%	0.591	28%	0.279	S	S	*	.			trans	-69.4	89.5	-171.4	26.4	-34.5	0	0	0	113.8	V381	V381-P404 HydrophobicContact CG2-CG 3.86Å; V381-P404 WeakPolarHBondContact CG2-O 3.42Å
405	L	93.8	Very high	95.6	Very high	18 Å²	18	59.6 Å²	59.6	9%	0.094	29%	0.291	C	S	.	.			trans	-67.2	146.1	-168.5	-56.1	-176.8	0	0	0	114.3	V381 V392 V402 P403 K407 F412 F427 M430	V381-L405 HydrophobicContact CG1-CD2 4.36Å; V392-L405 HydrophobicContact CG1-CD2 4.33Å; V402-L405 HydrophobicContact CG1-CD1 4.19Å; V402-L405 HydrophobicContact CG1-CG 4.23Å; P403-L405 HydrophobicContact CG-CD2 4.11Å; P403-L405 WeakPolarHBondContact O-CD2 3.37Å; P403-L405 VanDerWaalsContact O-CG 3.32Å; P403-L405 WeakPolarHBondContact O-CG 3.32Å; P403-L405 PolarHBondContact O-N 3.01Å; L405-K407 PolarHBondContact O-N 3.26Å; L405-F412 HydrophobicContact CD1-CB 4.19Å; L405-F412 HydrophobicContact CD1-CD1 3.89Å; L405-F412 HydrophobicContact CD1-CD2 3.82Å; L405-F412 HydrophobicContact CD1-CE1 4.16Å; L405-F412 HydrophobicContact CD1-CE2 4.11Å; L405-F412 HydrophobicContact CD1-CG 3.7Å; L405-F412 HydrophobicContact CD1-CZ 4.27Å; L405-F412 HydrophobicContact CD2-CD2 3.81Å; L405-F412 HydrophobicContact CD2-CE2 3.62Å; L405-F412 HydrophobicContact CD2-CZ 4.19Å; L405-F427 HydrophobicContact CD1-CD1 4.11Å; L405-F427 HydrophobicContact CD1-CE1 3.8Å; L405-M430 HydrophobicContact CB-CE 3.58Å; L405-M430 HydrophobicContact CB-SD 3.94Å; L405-M430 HydrophobicContact CD1-CE 3.73Å; L405-M430 HydrophobicContact CD1-SD 4Å; L405-M430 HydrophobicContact CG-CE 4.29Å; L405-M430 HydrophobicContact CG-SD 4.5Å
406	P	92.3	Very high	95.6	Very high	40 Å²	40	63.4 Å²	63.4	26%	0.26	30%	0.303	S	S	.	.			trans	-57.2	134.1	168.5	-23.3	33.2	0	0	0	112.2	V392 D408 T409	V392-P406 HydrophobicContact CG2-CG 4.47Å; P406-D408 WeakPolarHBondContact CB-OD1 3.37Å; P406-D408 PolarHBondContact O-N 2.94Å; P406-D408 VanDerWaalsContact O-N 3.12Å; P406-T409 VanDerWaalsContact O-CB 3.25Å; P406-T409 WeakPolarHBondContact O-CB 3.35Å; P406-T409 PolarHBondContact O-N 2.79Å; P406-T409 PolarHBondContact O-OG1 2.94Å
407	K	91.7	Very high	95.7	Very high	155 Å²	155	58 Å²	58	67%	0.674	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-17.7	-174.2	-64.4	-175.6	178.6	-178	0	114.7	L405	L405-K407 PolarHBondContact O-N 3.26Å
408	D	92.8	Very high	95.8	Very high	94 Å²	94	60.4 Å²	60.4	50%	0.503	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	3.1	176.9	63	-45.4	0	0	0	113.7	P406 T410	P406-D408 WeakPolarHBondContact CB-OD1 3.37Å; P406-D408 PolarHBondContact O-N 2.94Å; P406-D408 VanDerWaalsContact O-N 3.12Å; D408-T410 PolarHBondContact O-N 3.1Å
409	T	96.1	Very high	95.9	Very high	2 Å²	2	56.1 Å²	56.1	1%	0.012	26%	0.26	C	S	.	.			trans	-58	126.7	176.8	-56.7	0	0	0	0	111.1	G390 V392 P406 H411 F412 M430 L433	G390-T409 CarbonylContact O-C 3.45Å; G390-T409 VanDerWaalsContact O-CA 3.25Å; G390-T409 WeakPolarHBondContact O-CA 3.35Å; G390-T409 WeakPolarHBondContact O-CG2 3.43Å; V392-T409 HydrophobicContact CB-CG2 4.28Å; V392-T409 HydrophobicContact CG2-CG2 3.78Å; P406-T409 VanDerWaalsContact O-CB 3.25Å; P406-T409 WeakPolarHBondContact O-CB 3.35Å; P406-T409 PolarHBondContact O-N 2.79Å; P406-T409 PolarHBondContact O-OG1 2.94Å; T409-H411 WeakPolarHBondContact CG2-O 3.4Å; T409-F412 HydrophobicContact CG2-CB 4.47Å; T409-M430 HydrophobicContact CG2-CE 4.14Å; T409-L433 HydrophobicContact CG2-CD1 4.12Å; T409-L433 WeakPolarHBondContact O-CA 3.42Å
410	T	97.6	Very high	96	Very high	33 Å²	33	58 Å²	58	20%	0.202	27%	0.273	C	S	.	.	S	Bend	trans	-100.5	-28.9	177.3	57.4	0	0	0	0	112.6	G390 D408 K432 K434 K435	G390-T410 PolarHBondContact O-N 3.3Å; G390-T410 PolarHBondContact O-OG1 3.35Å; D408-T410 PolarHBondContact O-N 3.1Å; T410-K432 WeakPolarHBondContact CA-O 3.33Å; T410-K432 HydrophobicContact CG2-CB 4.21Å; T410-K434 WeakPolarHBondContact O-CA 3.05Å; T410-K434 PolarHBondContact O-N 3.46Å; T410-K435 PolarHBondContact O-N 2.91Å
411	H	98.4	Very high	96.1	Very high	55 Å²	55	60.3 Å²	60.3	26%	0.255	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	131.3	178.7	-53.5	70.8	0	0	0	110	S391 V392 T409 Y413 K435	S391-H411 CarbonylContact C-O 3.32Å; S391-H411 VanDerWaalsContact CA-O 3.31Å; S391-H411 WeakPolarHBondContact CA-O 3.12Å; V392-H411 PolarHBondContact N-O 3.28Å; T409-H411 WeakPolarHBondContact CG2-O 3.4Å; H411-Y413 HydrophobicContact CB-CD2 4.41Å; H411-Y413 HydrophobicContact CB-CE2 3.56Å; H411-K435 WeakPolarHBondContact CA-O 3.01Å; H411-K435 HydrophobicContact CB-CB 4.27Å
412	F	98	Very high	96.1	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	124.1	177.3	175.8	-129.4	0	0	0	110.5	V392 C394 V402 L405 T409 A414 F427 L433 K435 I436 D437 L438	V392-F412 HydrophobicContact CB-CD2 4.35Å; V392-F412 HydrophobicContact CG1-CD2 4.37Å; C394-F412 HydrophobicContact CB-CE2 4.38Å; V402-F412 HydrophobicContact CG1-CE1 3.89Å; V402-F412 HydrophobicContact CG1-CZ 3.93Å; V402-F412 HydrophobicContact CG2-CE1 4.36Å; L405-F412 HydrophobicContact CD1-CB 4.19Å; L405-F412 HydrophobicContact CD1-CD1 3.89Å; L405-F412 HydrophobicContact CD1-CD2 3.82Å; L405-F412 HydrophobicContact CD1-CE1 4.16Å; L405-F412 HydrophobicContact CD1-CE2 4.11Å; L405-F412 HydrophobicContact CD1-CG 3.7Å; L405-F412 HydrophobicContact CD1-CZ 4.27Å; L405-F412 HydrophobicContact CD2-CD2 3.81Å; L405-F412 HydrophobicContact CD2-CE2 3.62Å; L405-F412 HydrophobicContact CD2-CZ 4.19Å; T409-F412 HydrophobicContact CG2-CB 4.47Å; F412-A414 HydrophobicContact CE1-CB 4.09Å; F412-A414 HydrophobicContact CE2-CB 3.77Å; F412-A414 HydrophobicContact CZ-CB 3.44Å; F412-A414 VanDerWaalsContact CZ-CB 3.44Å; F412-F427 AromaticContact CD1-CE1 3.69Å; F412-F427 HydrophobicContact CD1-CE1 3.69Å; F412-F427 AromaticContact CD1-CZ 3.96Å; F412-F427 HydrophobicContact CD1-CZ 3.96Å; F412-F427 HydrophobicContact CE1-CE1 4.05Å; F412-F427 HydrophobicContact CE1-CZ 4.04Å; F412-L433 HydrophobicContact CB-CD1 4.21Å; F412-K435 PolarHBondContact N-O 3.4Å; F412-I436 HydrophobicContact CD1-CG2 4.43Å; F412-I436 WeakPolarHBondContact O-CA 3.37Å; F412-D437 PolarHBondContact O-N 3.03Å; F412-L438 HydrophobicContact CE1-CD2 3.93Å
413	Y	98.4	Very high	96.1	Very high	33 Å²	33	51.5 Å²	51.5	13%	0.129	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	120.7	176.8	-53.5	-94.1	0	0	0	108.6	V392 Y393 C394 H411 K435 D437	V392-Y413 PolarHBondContact O-N 2.96Å; Y393-Y413 AromaticContact CD1-CD2 3.44Å; Y393-Y413 HydrophobicContact CD1-CD2 3.44Å; Y393-Y413 VanDerWaalsContact CD1-CD2 3.44Å; Y393-Y413 HydrophobicContact CD1-CE2 4.1Å; Y393-Y413 AromaticContact CD1-CG 3.83Å; Y393-Y413 HydrophobicContact CD1-CG 3.83Å; Y393-Y413 AromaticContact CE1-CD2 3.28Å; Y393-Y413 HydrophobicContact CE1-CD2 3.28Å; Y393-Y413 AromaticContact CE1-CE2 3.43Å; Y393-Y413 HydrophobicContact CE1-CE2 3.43Å; Y393-Y413 VanDerWaalsContact CE1-CE2 3.43Å; Y393-Y413 AromaticContact CE1-CG 3.92Å; Y393-Y413 HydrophobicContact CE1-CG 3.92Å; Y393-Y413 HydrophobicContact CG-CD2 4.25Å; Y393-Y413 AromaticContact CZ-CD2 3.99Å; Y393-Y413 AromaticContact CZ-CE2 3.83Å; C394-Y413 PolarHBondContact N-O 3.39Å; H411-Y413 HydrophobicContact CB-CD2 4.41Å; H411-Y413 HydrophobicContact CB-CE2 3.56Å; Y413-K435 HydrophobicContact CE1-CD 4.3Å; Y413-D437 HydrophobicContact CD1-CB 3.68Å; Y413-D437 HydrophobicContact CE1-CB 4.27Å; Y413-D437 HydrophobicContact CG-CB 4.47Å
414	A	97.8	Very high	96	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	27%	0.27	C	S	.	.			trans	-143.4	53.5	177.4	0	0	0	0	0	111.1	C394 F412 N417 I419 D437 L438 N441	C394-A414 HydrophobicContact CB-CB 3.89Å; F412-A414 HydrophobicContact CE1-CB 4.09Å; F412-A414 HydrophobicContact CE2-CB 3.77Å; F412-A414 HydrophobicContact CZ-CB 3.44Å; F412-A414 VanDerWaalsContact CZ-CB 3.44Å; A414-N417 PolarHBondContact O-ND2 2.89Å; A414-I419 HydrophobicContact CB-CD1 4.26Å; A414-D437 PolarHBondContact N-O 3.09Å; A414-L438 HydrophobicContact CB-CD2 3.99Å; A414-N441 PolarHBondContact O-ND2 2.79Å
415	R	98.4	Very high	96	Very high	70 Å²	70	56.5 Å²	56.5	26%	0.264	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	161.9	-175.8	-54.5	168.6	-78.5	-156.8	4.8	112.3	D395 D396 N417 D437 T439	D395-R415 WeakPolarHBondContact CA-O 3.29Å; D395-R415 VanDerWaalsContact OD1-CB 3.23Å; D395-R415 WeakPolarHBondContact OD1-CB 3.06Å; D395-R415 WeakPolarHBondContact OD1-CG 3.16Å; D395-R415 IonicContact OD1-CZ 2.76Å; D395-R415 PolarHBondContact OD1-N 2.97Å; D395-R415 IonicContact OD1-NE 3.5Å; D395-R415 PolarHBondContact OD1-NE 3.38Å; D395-R415 IonicContact OD1-NH2 2.65Å; D395-R415 IonicContact OD2-CZ 2.85Å; D395-R415 IonicContact OD2-NE 3.87Å; D395-R415 PolarHBondContact OD2-NE 3.44Å; D395-R415 IonicContact OD2-NH2 3.72Å; D395-R415 PolarHBondContact OD2-NH2 2.96Å; D396-R415 PolarHBondContact N-O 2.91Å; R415-N417 PolarHBondContact O-N 2.91Å; R415-N417 VanDerWaalsContact O-N 3.15Å; R415-N417 PolarHBondContact O-ND2 2.77Å; R415-D437 WeakPolarHBondContact CD-OD2 3.39Å; R415-D437 VanDerWaalsContact CG-OD1 3.31Å; R415-D437 WeakPolarHBondContact CG-OD1 3.24Å; R415-D437 IonicContact NE-OD2 2.7Å; R415-D437 IonicContact NH1-OD2 3.64Å; R415-T439 CarbonylContact C-O 3.2Å; R415-T439 WeakPolarHBondContact CA-O 3.49Å; R415-T439 WeakPolarHBondContact CB-O 3.39Å
416	Y	98.3	Very high	96	Very high	126 Å²	126	57.6 Å²	57.6	49%	0.494	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.6	25.4	175.7	-48.3	-71.8	0	0	0	113.6	T439 A440	Y416-T439 PolarHBondContact N-O 2.81Å; Y416-A440 CarbonylContact C-O 3.04Å; Y416-A440 WeakPolarHBondContact CA-O 3.41Å; Y416-A440 HydrophobicContact CD1-CB 3.43Å; Y416-A440 VanDerWaalsContact CD1-CB 3.43Å; Y416-A440 HydrophobicContact CE1-CB 3.62Å; Y416-A440 HydrophobicContact CG-CB 4.31Å; Y416-A440 PolarHBondContact N-O 3.15Å
417	N	98.1	Very high	96.2	Very high	7 Å²	7	55.8 Å²	55.8	4%	0.037	27%	0.265	C	S	.	.	S	Bend	trans	-97.2	-167.2	179.3	-80.3	-59.5	0	0	0	111.1	C394 L397 K398 L399 A414 R415 I419 A440 N441	C394-N417 PolarHBondContact O-ND2 2.03Å; L397-N417 PolarHBondContact N-OD1 3.1Å; K398-N417 PolarHBondContact N-OD1 3.49Å; K398-N417 VanDerWaalsContact N-OD1 3.09Å; L399-N417 HydrophobicContact CB-CB 4.19Å; L399-N417 PolarHBondContact N-OD1 3.25Å; A414-N417 PolarHBondContact O-ND2 2.89Å; R415-N417 PolarHBondContact O-N 2.91Å; R415-N417 VanDerWaalsContact O-N 3.15Å; R415-N417 PolarHBondContact O-ND2 2.77Å; N417-I419 HydrophobicContact CB-CD1 4.49Å; N417-I419 HydrophobicContact CB-CG1 4.21Å; N417-A440 PolarHBondContact N-O 2.9Å; N417-N441 WeakPolarHBondContact CA-OD1 3.26Å; N417-N441 WeakPolarHBondContact CB-OD1 3.36Å; N417-N441 PolarHBondContact O-OD1 2.79Å
418	R	98	Very high	96.1	Very high	114 Å²	114	50.7 Å²	50.7	43%	0.43	25%	0.252	S	S	.	.			trans	-119.5	21.6	-176.4	-59.2	177.5	179.5	-172.8	-1.1	111.4	L399 N400 T420 N441	L399-R418 CarbonylContact O-C 3.39Å; L399-R418 VanDerWaalsContact O-CA 3.24Å; L399-R418 WeakPolarHBondContact O-CA 3.39Å; L399-R418 WeakPolarHBondContact O-CB 3.47Å; L399-R418 PolarHBondContact O-N 2.03Å; N400-R418 WeakPolarHBondContact OD1-CB 3.31Å; R418-T420 PolarHBondContact O-N 3Å; R418-N441 PolarHBondContact N-OD1 2.67Å
419	I	98.1	Very high	95.8	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.257	C	S	.	.			trans	-63.1	122.7	-176	-58.8	175.5	0	0	0	108.1	L399 V402 A414 N417 K421 L438 N441 K442 I443	L399-I419 HydrophobicContact CB-CG1 4.41Å; L399-I419 WeakPolarHBondContact O-CG1 3.49Å; L399-I419 PolarHBondContact O-N 3.12Å; V402-I419 HydrophobicContact CG2-CD1 4.35Å; V402-I419 HydrophobicContact CG2-CG2 4.48Å; A414-I419 HydrophobicContact CB-CD1 4.26Å; N417-I419 HydrophobicContact CB-CD1 4.49Å; N417-I419 HydrophobicContact CB-CG1 4.21Å; I419-K421 WeakPolarHBondContact CG2-O 3.28Å; I419-L438 HydrophobicContact CD1-CD2 3.99Å; I419-N441 WeakPolarHBondContact CB-OD1 3.15Å; I419-N441 WeakPolarHBondContact CG1-OD1 3.36Å; I419-N441 PolarHBondContact N-OD1 3.25Å; I419-K442 CarbonylContact O-C 3.52Å; I419-K442 WeakPolarHBondContact O-CA 3.36Å; I419-K442 PolarHBondContact O-N 2.85Å; I419-I443 HydrophobicContact CB-CG1 4.46Å; I419-I443 HydrophobicContact CG2-CG1 4.23Å; I419-I443 WeakPolarHBondContact O-CG1 3.44Å; I419-I443 PolarHBondContact O-N 3.36Å
420	T	97.1	Very high	95.8	Very high	62 Å²	62	51.8 Å²	51.8	38%	0.38	26%	0.257	S	S	.	.			trans	-103.5	-27	-173.3	48.8	0	0	0	0	114.2	R418 K442 I443 T444	R418-T420 PolarHBondContact O-N 3Å; T420-K442 WeakPolarHBondContact CA-O 3.31Å; T420-K442 HydrophobicContact CG2-CB 4.07Å; T420-I443 WeakPolarHBondContact O-CA 3.5Å; T420-T444 PolarHBondContact O-N 2.87Å; T420-T444 PolarHBondContact O-OG1 2.86Å
421	K	96.1	Very high	95.6	Very high	139 Å²	139	54.6 Å²	54.6	60%	0.604	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-143.6	153.8	-178.8	-61.8	-174.6	-179.5	-177.6	0	109.7	I419 S445	I419-K421 WeakPolarHBondContact CG2-O 3.28Å; K421-S445 WeakPolarHBondContact CA-O 3.34Å
422	I	96.7	Very high	95.5	Very high	5 Å²	5	57.2 Å²	57.2	3%	0.026	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	131.6	169.3	-52.1	-178.5	0	0	0	108.5	D426 F427 L438 I443 S445 I446 E447 T450 F451	I422-D426 WeakPolarHBondContact CA-OD2 3.32Å; I422-D426 HydrophobicContact CG2-CB 4.4Å; I422-F427 HydrophobicContact CG2-CD2 4.08Å; I422-F427 HydrophobicContact CG2-CE2 3.61Å; I422-L438 HydrophobicContact CD1-CD1 3.47Å; I422-L438 VanDerWaalsContact CD1-CD1 3.47Å; I422-I443 HydrophobicContact CD1-CD1 4.04Å; I422-I443 HydrophobicContact CG1-CD1 4.42Å; I422-I443 HydrophobicContact CG1-CG2 4.35Å; I422-S445 PolarHBondContact N-O 2.86Å; I422-S445 VanDerWaalsContact N-O 3.16Å; I422-I446 HydrophobicContact CB-CB 4.5Å; I422-I446 HydrophobicContact CB-CG1 4.21Å; I422-I446 HydrophobicContact CB-CG2 4.22Å; I422-I446 HydrophobicContact CD1-CD1 3.9Å; I422-I446 HydrophobicContact CD1-CG1 3.9Å; I422-I446 HydrophobicContact CG1-CG1 4.14Å; I422-E447 PolarHBondContact O-N 3.18Å; I422-T450 HydrophobicContact CG2-CG2 3.87Å; I422-F451 HydrophobicContact CD1-CZ 4.14Å
423	S	94.3	Very high	95.5	Very high	29 Å²	29	57.2 Å²	57.2	20%	0.203	28%	0.282	C	S	.	.			trans	-105.7	160.1	173.9	89	0	0	0	0	112.3	S425 D426 E447	S423-S425 PolarHBondContact O-N 3.29Å; S423-S425 VanDerWaalsContact OG-CB 3.3Å; S423-S425 WeakPolarHBondContact OG-CB 2.99Å; S423-S425 PolarHBondContact OG-N 3.29Å; S423-S425 PolarHBondContact OG-OG 3.09Å; S423-D426 WeakPolarHBondContact CB-OD1 3.12Å; S423-D426 PolarHBondContact N-OD2 3.25Å; S423-D426 VanDerWaalsContact O-CB 3.32Å; S423-D426 WeakPolarHBondContact O-CB 3.37Å; S423-D426 PolarHBondContact O-N 3.04Å; S423-D426 VanDerWaalsContact O-N 3.13Å; S423-D426 PolarHBondContact OG-N 3.28Å; S423-D426 PolarHBondContact OG-OD1 2.97Å; S423-E447 WeakPolarHBondContact CA-OE2 3.23Å
424	K	92.5	Very high	95.4	Very high	116 Å²	116	58.1 Å²	58.1	50%	0.504	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-25.3	172.2	-177	178.6	175.4	-173.9	0	112.5	D426 E447	K424-D426 VanDerWaalsContact C-N 3.32Å; K424-E447 WeakPolarHBondContact CB-OE2 3.32Å; K424-E447 PolarHBondContact N-OE2 3.12Å
425	S	92	Very high	95.5	Very high	89 Å²	89	59.6 Å²	59.6	62%	0.622	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-36.3	174.8	-10.6	0	0	0	0	112.4	S423 F427 A428	S423-S425 PolarHBondContact O-N 3.29Å; S423-S425 VanDerWaalsContact OG-CB 3.3Å; S423-S425 WeakPolarHBondContact OG-CB 2.99Å; S423-S425 PolarHBondContact OG-N 3.29Å; S423-S425 PolarHBondContact OG-OG 3.09Å; S425-F427 PolarHBondContact O-N 3.36Å; S425-F427 VanDerWaalsContact O-N 3.14Å; S425-A428 WeakPolarHBondContact O-CB 3.03Å; S425-A428 PolarHBondContact O-N 3.28Å; S425-A428 VanDerWaalsContact O-N 3.14Å
426	D	94.3	Very high	95.5	Very high	40 Å²	40	56.3 Å²	56.3	21%	0.214	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-29.6	-170.4	-57.4	1.6	0	0	0	112.3	V402 I422 S423 K424	V402-D426 HydrophobicContact CB-CB 3.91Å; V402-D426 HydrophobicContact CG1-CB 4.08Å; V402-D426 HydrophobicContact CG2-CB 4.18Å; I422-D426 WeakPolarHBondContact CA-OD2 3.32Å; I422-D426 HydrophobicContact CG2-CB 4.4Å; S423-D426 WeakPolarHBondContact CB-OD1 3.12Å; S423-D426 PolarHBondContact N-OD2 3.25Å; S423-D426 VanDerWaalsContact O-CB 3.32Å; S423-D426 WeakPolarHBondContact O-CB 3.37Å; S423-D426 PolarHBondContact O-N 3.04Å; S423-D426 VanDerWaalsContact O-N 3.13Å; S423-D426 PolarHBondContact OG-N 3.28Å; S423-D426 PolarHBondContact OG-OD1 2.97Å; K424-D426 VanDerWaalsContact C-N 3.32Å
427	F	94.8	Very high	95.5	Very high	3 Å²	3	50.8 Å²	50.8	1%	0.013	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.1	19.6	-179.4	-58.2	-67.4	0	0	0	113.6	V402 L405 F412 I422 S425 N429 M430 L433 I436 T450 F451 L454	V402-F427 HydrophobicContact CG1-CE1 4.31Å; V402-F427 HydrophobicContact CG1-CZ 4.31Å; V402-F427 HydrophobicContact CG2-CZ 4.26Å; L405-F427 HydrophobicContact CD1-CD1 4.11Å; L405-F427 HydrophobicContact CD1-CE1 3.8Å; F412-F427 AromaticContact CD1-CE1 3.69Å; F412-F427 HydrophobicContact CD1-CE1 3.69Å; F412-F427 AromaticContact CD1-CZ 3.96Å; F412-F427 HydrophobicContact CD1-CZ 3.96Å; F412-F427 HydrophobicContact CE1-CE1 4.05Å; F412-F427 HydrophobicContact CE1-CZ 4.04Å; I422-F427 HydrophobicContact CG2-CD2 4.08Å; I422-F427 HydrophobicContact CG2-CE2 3.61Å; S425-F427 PolarHBondContact O-N 3.36Å; S425-F427 VanDerWaalsContact O-N 3.14Å; F427-N429 PolarHBondContact O-N 2.98Å; F427-M430 HydrophobicContact CB-SD 4.22Å; F427-M430 HydrophobicContact CD1-SD 3.84Å; F427-M430 WeakPolarHBondContact O-CB 3.39Å; F427-M430 WeakPolarHBondContact O-CG 3.27Å; F427-M430 PolarHBondContact O-N 3Å; F427-L433 HydrophobicContact CD1-CD2 3.54Å; F427-L433 HydrophobicContact CE1-CD2 4.04Å; F427-L433 HydrophobicContact CG-CD2 4.31Å; F427-I436 HydrophobicContact CD1-CD1 4.27Å; F427-I436 HydrophobicContact CD2-CD1 4.42Å; F427-I436 HydrophobicContact CE1-CD1 4.01Å; F427-I436 HydrophobicContact CE1-CG1 4.37Å; F427-I436 HydrophobicContact CE2-CD1 4.15Å; F427-I436 HydrophobicContact CG-CD1 4.48Å; F427-I436 HydrophobicContact CZ-CD1 3.94Å; F427-I436 HydrophobicContact CZ-CG1 4.46Å; F427-I436 HydrophobicContact CZ-CG2 4.33Å; F427-T450 HydrophobicContact CD2-CG2 3.92Å; F427-F451 HydrophobicContact CD2-CD1 4.46Å; F427-F451 HydrophobicContact CD2-CE1 4Å; F427-F451 AromaticContact CE2-CE1 3.83Å; F427-F451 HydrophobicContact CE2-CE1 3.83Å; F427-L454 HydrophobicContact CB-CD1 4.06Å; F427-L454 HydrophobicContact CB-CD2 4.14Å; F427-L454 HydrophobicContact CG-CD1 4.43Å
428	A	90.6	Very high	95.5	Very high	47 Å²	47	50.4 Å²	50.4	39%	0.388	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	122.6	-171	0	0	0	0	0	113.6	S425 M430	S425-A428 WeakPolarHBondContact O-CB 3.03Å; S425-A428 PolarHBondContact O-N 3.28Å; S425-A428 VanDerWaalsContact O-N 3.14Å; A428-M430 VanDerWaalsContact C-N 3.32Å
429	N	87.1	Confident	95.5	Very high	115 Å²	115	45.4 Å²	45.4	62%	0.615	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	68	20.7	-179.6	-39	-92.5	0	0	0	114.9	F427 N431	F427-N429 PolarHBondContact O-N 2.98Å; N429-N431 PolarHBondContact O-N 3.12Å; N429-N431 PolarHBondContact O-OD1 2.93Å
430	M	94.4	Very high	95.6	Very high	5 Å²	5	46.4 Å²	46.4	3%	0.025	25%	0.248	C	C	.	.			trans	-82.2	61.6	178.9	-63.5	-172.9	71	0	0	112	L405 T409 F427 A428 K432 L433 L454	L405-M430 HydrophobicContact CB-CE 3.58Å; L405-M430 HydrophobicContact CB-SD 3.94Å; L405-M430 HydrophobicContact CD1-CE 3.73Å; L405-M430 HydrophobicContact CD1-SD 4Å; L405-M430 HydrophobicContact CG-CE 4.29Å; L405-M430 HydrophobicContact CG-SD 4.5Å; T409-M430 HydrophobicContact CG2-CE 4.14Å; F427-M430 HydrophobicContact CB-SD 4.22Å; F427-M430 HydrophobicContact CD1-SD 3.84Å; F427-M430 WeakPolarHBondContact O-CB 3.39Å; F427-M430 WeakPolarHBondContact O-CG 3.27Å; F427-M430 PolarHBondContact O-N 3Å; A428-M430 VanDerWaalsContact C-N 3.32Å; M430-K432 PolarHBondContact O-N 2.86Å; M430-L433 HydrophobicContact CB-CB 4.05Å; M430-L433 HydrophobicContact CB-CD2 4.24Å; M430-L433 HydrophobicContact CE-CD1 4.44Å; M430-L433 HydrophobicContact CE-CD2 4Å; M430-L433 WeakPolarHBondContact O-CB 3.42Å; M430-L433 PolarHBondContact O-N 2.83Å; M430-L433 HydrophobicContact SD-CD2 4.15Å; M430-L454 HydrophobicContact CB-CD2 3.89Å
431	N	93.8	Very high	95.6	Very high	92 Å²	92	43.8 Å²	43.8	49%	0.492	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-16	-166.9	-61.4	-3.6	0	0	0	115.1	N429 P455 E456	N429-N431 PolarHBondContact O-N 3.12Å; N429-N431 PolarHBondContact O-OD1 2.93Å; N431-P455 HydrophobicContact CB-CG 4.47Å; N431-E456 WeakPolarHBondContact O-CG 3.49Å
432	K	96.1	Very high	95.7	Very high	110 Å²	110	42.7 Å²	42.7	48%	0.478	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.4	0.4	-179.4	-59.5	-176.3	179.3	179.7	0	114.1	T410 M430 K434	T410-K432 WeakPolarHBondContact CA-O 3.33Å; T410-K432 HydrophobicContact CG2-CB 4.21Å; M430-K432 PolarHBondContact O-N 2.86Å; K432-K434 PolarHBondContact O-N 3.04Å; K432-K434 VanDerWaalsContact O-N 3.17Å
433	L	97.9	Very high	95.8	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.225	C	C	.	.			trans	-73.9	107.8	-171.9	-175.5	59	0	0	0	110.3	T409 F412 F427 M430 I436 L454 E456 L457	T409-L433 HydrophobicContact CG2-CD1 4.12Å; T409-L433 WeakPolarHBondContact O-CA 3.42Å; F412-L433 HydrophobicContact CB-CD1 4.21Å; F427-L433 HydrophobicContact CD1-CD2 3.54Å; F427-L433 HydrophobicContact CE1-CD2 4.04Å; F427-L433 HydrophobicContact CG-CD2 4.31Å; M430-L433 HydrophobicContact CB-CB 4.05Å; M430-L433 HydrophobicContact CB-CD2 4.24Å; M430-L433 HydrophobicContact CE-CD1 4.44Å; M430-L433 HydrophobicContact CE-CD2 4Å; M430-L433 WeakPolarHBondContact O-CB 3.42Å; M430-L433 PolarHBondContact O-N 2.83Å; M430-L433 HydrophobicContact SD-CD2 4.15Å; L433-I436 HydrophobicContact CD1-CG1 4.46Å; L433-I436 HydrophobicContact CD2-CD1 3.84Å; L433-I436 HydrophobicContact CD2-CG1 3.89Å; L433-I436 HydrophobicContact CG-CD1 4.45Å; L433-I436 HydrophobicContact CG-CG1 4.15Å; L433-L454 HydrophobicContact CB-CD2 4.46Å; L433-L454 HydrophobicContact CD2-CD1 4.05Å; L433-L454 HydrophobicContact CD2-CD2 4.44Å; L433-E456 CarbonylContact O-C 3.54Å; L433-L457 HydrophobicContact CG-CD1 4.26Å; L433-L457 VanDerWaalsContact O-CA 3.23Å; L433-L457 WeakPolarHBondContact O-CA 3.26Å; L433-L457 VanDerWaalsContact O-CD1 3.3Å; L433-L457 WeakPolarHBondContact O-CD1 2.93Å; L433-L457 PolarHBondContact O-N 2.71Å
434	K	98.1	Very high	95.9	Very high	51 Å²	51	44.5 Å²	44.5	22%	0.222	24%	0.237	C	C	.	.			trans	-91.6	-35.7	-178.1	-59	-162.1	164.6	-66.3	0	113.6	T410 K432 E456 E458 E459	T410-K434 WeakPolarHBondContact O-CA 3.05Å; T410-K434 PolarHBondContact O-N 3.46Å; K432-K434 PolarHBondContact O-N 3.04Å; K432-K434 VanDerWaalsContact O-N 3.17Å; K434-E456 WeakPolarHBondContact CA-O 3.4Å; K434-E456 WeakPolarHBondContact CE-OE2 3.5Å; K434-E456 HydrophobicContact CG-CB 4.49Å; K434-E456 IonicContact NZ-OE2 2.72Å; K434-E456 PolarHBondContact NZ-OE2 3.33Å; K434-E458 WeakPolarHBondContact CE-OE1 3.01Å; K434-E458 IonicContact NZ-OE1 2.72Å; K434-E458 PolarHBondContact NZ-OE1 3.23Å; K434-E458 PolarHBondContact O-N 3.04Å; K434-E459 PolarHBondContact O-N 3.12Å
435	K	98.5	Very high	96	Very high	32 Å²	32	42 Å²	42	14%	0.139	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	135.1	-174.1	-176.5	158.7	-173.3	156.6	0	113.3	T410 H411 F412 Y413 E459	T410-K435 PolarHBondContact O-N 2.91Å; H411-K435 WeakPolarHBondContact CA-O 3.01Å; H411-K435 HydrophobicContact CB-CB 4.27Å; F412-K435 PolarHBondContact N-O 3.4Å; Y413-K435 HydrophobicContact CE1-CD 4.3Å; K435-E459 WeakPolarHBondContact CA-O 3.28Å; K435-E459 HydrophobicContact CB-CB 4.25Å; K435-E459 HydrophobicContact CD-CB 4.1Å; K435-E459 HydrophobicContact CD-CG 4.47Å; K435-E459 VanDerWaalsContact CE-OE2 3.3Å; K435-E459 WeakPolarHBondContact CE-OE2 3.25Å; K435-E459 HydrophobicContact CG-CB 3.94Å; K435-E459 IonicContact NZ-OE1 2.73Å; K435-E459 IonicContact NZ-OE2 3.16Å; K435-E459 PolarHBondContact NZ-OE2 3.26Å
436	I	98.4	Very high	96.2	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	121.4	169.8	-63.6	171.2	0	0	0	108.5	F412 F427 L433 L438 F451 L454 L457 E459 I461	F412-I436 HydrophobicContact CD1-CG2 4.43Å; F412-I436 WeakPolarHBondContact O-CA 3.37Å; F427-I436 HydrophobicContact CD1-CD1 4.27Å; F427-I436 HydrophobicContact CD2-CD1 4.42Å; F427-I436 HydrophobicContact CE1-CD1 4.01Å; F427-I436 HydrophobicContact CE1-CG1 4.37Å; F427-I436 HydrophobicContact CE2-CD1 4.15Å; F427-I436 HydrophobicContact CG-CD1 4.48Å; F427-I436 HydrophobicContact CZ-CD1 3.94Å; F427-I436 HydrophobicContact CZ-CG1 4.46Å; F427-I436 HydrophobicContact CZ-CG2 4.33Å; L433-I436 HydrophobicContact CD1-CG1 4.46Å; L433-I436 HydrophobicContact CD2-CD1 3.84Å; L433-I436 HydrophobicContact CD2-CG1 3.89Å; L433-I436 HydrophobicContact CG-CD1 4.45Å; L433-I436 HydrophobicContact CG-CG1 4.15Å; I436-L438 HydrophobicContact CG2-CD1 3.62Å; I436-L438 HydrophobicContact CG2-CG 3.75Å; I436-F451 HydrophobicContact CD1-CD1 3.92Å; I436-F451 HydrophobicContact CD1-CE1 3.65Å; I436-L454 HydrophobicContact CD1-CD1 4.03Å; I436-L457 HydrophobicContact CD1-CD1 3.9Å; I436-L457 HydrophobicContact CD1-CD2 4.45Å; I436-L457 HydrophobicContact CG1-CD1 3.99Å; I436-E459 PolarHBondContact N-O 3.08Å; I436-I461 PolarHBondContact O-N 2.98Å
437	D	98.7	Very high	96.1	Very high	10 Å²	10	41.2 Å²	41.2	5%	0.053	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	108.4	174.3	-174.5	-7.2	0	0	0	110.5	F412 Y413 A414 R415 T439 I461	F412-D437 PolarHBondContact O-N 3.03Å; Y413-D437 HydrophobicContact CD1-CB 3.68Å; Y413-D437 HydrophobicContact CE1-CB 4.27Å; Y413-D437 HydrophobicContact CG-CB 4.47Å; A414-D437 PolarHBondContact N-O 3.09Å; R415-D437 WeakPolarHBondContact CD-OD2 3.39Å; R415-D437 VanDerWaalsContact CG-OD1 3.31Å; R415-D437 WeakPolarHBondContact CG-OD1 3.24Å; R415-D437 IonicContact NE-OD2 2.7Å; R415-D437 IonicContact NH1-OD2 3.64Å; D437-T439 WeakPolarHBondContact OD1-CB 3.46Å; D437-T439 PolarHBondContact OD1-N 3.47Å; D437-T439 VanDerWaalsContact OD1-N 3.15Å; D437-T439 PolarHBondContact OD1-OG1 2.83Å; D437-I461 HydrophobicContact CB-CB 4.37Å
438	L	98.4	Very high	95.7	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.248	C	C	.	.			trans	-119.8	26.3	-177.6	-66	170.7	0	0	0	111.2	F412 A414 I419 I422 I436 N441 I443 I461 I462 N465	F412-L438 HydrophobicContact CE1-CD2 3.93Å; A414-L438 HydrophobicContact CB-CD2 3.99Å; I419-L438 HydrophobicContact CD1-CD2 3.99Å; I422-L438 HydrophobicContact CD1-CD1 3.47Å; I422-L438 VanDerWaalsContact CD1-CD1 3.47Å; I436-L438 HydrophobicContact CG2-CD1 3.62Å; I436-L438 HydrophobicContact CG2-CG 3.75Å; L438-N441 PolarHBondContact O-ND2 3.12Å; L438-I443 HydrophobicContact CB-CD1 3.91Å; L438-I443 HydrophobicContact CD1-CD1 4Å; L438-I443 HydrophobicContact CG-CD1 4.49Å; L438-I461 PolarHBondContact N-O 2.67Å; L438-I462 HydrophobicContact CB-CG2 4.43Å; L438-N465 PolarHBondContact O-ND2 3.25Å; L438-N465 VanDerWaalsContact O-ND2 3.09Å
439	T	98.6	Very high	95.5	Very high	9 Å²	9	51.5 Å²	51.5	6%	0.055	26%	0.257	C	S	.	.			trans	-49.9	138.7	178.8	-58	0	0	0	0	112.3	R415 Y416 D437 I461 R463	R415-T439 CarbonylContact C-O 3.2Å; R415-T439 WeakPolarHBondContact CA-O 3.49Å; R415-T439 WeakPolarHBondContact CB-O 3.39Å; Y416-T439 PolarHBondContact N-O 2.81Å; D437-T439 WeakPolarHBondContact OD1-CB 3.46Å; D437-T439 PolarHBondContact OD1-N 3.47Å; D437-T439 VanDerWaalsContact OD1-N 3.15Å; D437-T439 PolarHBondContact OD1-OG1 2.83Å; T439-I461 VanDerWaalsContact OG1-CG2 3.27Å; T439-I461 WeakPolarHBondContact OG1-CG2 3.48Å; T439-R463 CarbonylContact C-O 3.27Å; T439-R463 VanDerWaalsContact CA-O 3.26Å; T439-R463 WeakPolarHBondContact CA-O 3.43Å; T439-R463 HydrophobicContact CG2-CB 4.26Å; T439-R463 VanDerWaalsContact CG2-NH2 3.28Å
440	A	98.4	Very high	95.8	Very high	21 Å²	21	46.3 Å²	46.3	17%	0.174	23%	0.229	C	C	.	.	S	Bend	trans	58	58.1	175.2	0	0	0	0	0	113.1	Y416 N417 R463 E464	Y416-A440 CarbonylContact C-O 3.04Å; Y416-A440 WeakPolarHBondContact CA-O 3.41Å; Y416-A440 HydrophobicContact CD1-CB 3.43Å; Y416-A440 VanDerWaalsContact CD1-CB 3.43Å; Y416-A440 HydrophobicContact CE1-CB 3.62Å; Y416-A440 HydrophobicContact CG-CB 4.31Å; Y416-A440 PolarHBondContact N-O 3.15Å; N417-A440 PolarHBondContact N-O 2.9Å; A440-R463 PolarHBondContact N-O 2.91Å; A440-E464 WeakPolarHBondContact CA-O 3.47Å; A440-E464 HydrophobicContact CB-CB 4.23Å; A440-E464 PolarHBondContact N-O 3.06Å
441	N	98.6	Very high	95.7	Very high	7 Å²	7	46 Å²	46	4%	0.037	23%	0.228	C	C	.	.			trans	-116.8	-164.6	174.6	-92.7	-83.1	0	0	0	110.3	A414 N417 R418 I419 L438 I443 E464 N465	A414-N441 PolarHBondContact O-ND2 2.79Å; N417-N441 WeakPolarHBondContact CA-OD1 3.26Å; N417-N441 WeakPolarHBondContact CB-OD1 3.36Å; N417-N441 PolarHBondContact O-OD1 2.79Å; R418-N441 PolarHBondContact N-OD1 2.67Å; I419-N441 WeakPolarHBondContact CB-OD1 3.15Å; I419-N441 WeakPolarHBondContact CG1-OD1 3.36Å; I419-N441 PolarHBondContact N-OD1 3.25Å; L438-N441 PolarHBondContact O-ND2 3.12Å; N441-I443 HydrophobicContact CB-CD1 4.1Å; N441-I443 HydrophobicContact CB-CG1 4.06Å; N441-E464 PolarHBondContact N-O 2.77Å; N441-N465 VanDerWaalsContact CA-OD1 3.29Å; N441-N465 WeakPolarHBondContact CA-OD1 3.21Å; N441-N465 WeakPolarHBondContact CB-OD1 3.2Å; N441-N465 PolarHBondContact N-OD1 2.91Å; N441-N465 PolarHBondContact O-OD1 2.83Å
442	K	98.1	Very high	95.6	Very high	115 Å²	115	46.2 Å²	46.2	50%	0.5	23%	0.227	S	C	.	.			trans	-118.5	27.4	177.8	-63.1	-170.1	175.4	-169.9	0	111.9	I419 T420 T444 N465	I419-K442 CarbonylContact O-C 3.52Å; I419-K442 WeakPolarHBondContact O-CA 3.36Å; I419-K442 PolarHBondContact O-N 2.85Å; T420-K442 WeakPolarHBondContact CA-O 3.31Å; T420-K442 HydrophobicContact CG2-CB 4.07Å; K442-T444 PolarHBondContact O-N 3.03Å; K442-N465 PolarHBondContact N-OD1 2.88Å
443	I	98.3	Very high	95.1	Very high	0 Å²	0	43 Å²	43	0%	0	23%	0.226	C	C	.	.			trans	-66.5	123.4	-171.9	-58	159.4	0	0	0	108.4	I419 T420 I422 L438 N441 I446 N465 H466 I467	I419-I443 HydrophobicContact CB-CG1 4.46Å; I419-I443 HydrophobicContact CG2-CG1 4.23Å; I419-I443 WeakPolarHBondContact O-CG1 3.44Å; I419-I443 PolarHBondContact O-N 3.36Å; T420-I443 WeakPolarHBondContact O-CA 3.5Å; I422-I443 HydrophobicContact CD1-CD1 4.04Å; I422-I443 HydrophobicContact CG1-CD1 4.42Å; I422-I443 HydrophobicContact CG1-CG2 4.35Å; L438-I443 HydrophobicContact CB-CD1 3.91Å; L438-I443 HydrophobicContact CD1-CD1 4Å; L438-I443 HydrophobicContact CG-CD1 4.49Å; N441-I443 HydrophobicContact CB-CD1 4.1Å; N441-I443 HydrophobicContact CB-CG1 4.06Å; I443-I446 HydrophobicContact CG2-CD1 4.22Å; I443-I446 HydrophobicContact CG2-CG1 3.76Å; I443-N465 HydrophobicContact CB-CB 4.29Å; I443-N465 VanDerWaalsContact CB-OD1 3.32Å; I443-N465 WeakPolarHBondContact CB-OD1 3.38Å; I443-N465 WeakPolarHBondContact CD1-OD1 3.3Å; I443-N465 WeakPolarHBondContact CG1-OD1 3.19Å; I443-N465 PolarHBondContact N-OD1 3.06Å; I443-H466 CarbonylContact O-C 3.37Å; I443-H466 WeakPolarHBondContact O-CA 3.33Å; I443-H466 PolarHBondContact O-N 2.79Å; I443-I467 HydrophobicContact CB-CD1 4.17Å; I443-I467 HydrophobicContact CB-CG1 4.13Å; I443-I467 HydrophobicContact CG2-CD1 3.91Å; I443-I467 HydrophobicContact CG2-CG1 3.86Å; I443-I467 WeakPolarHBondContact O-CG1 3.42Å; I443-I467 PolarHBondContact O-N 2.6Å
444	T	96.4	Very high	95	Very high	72 Å²	72	43.1 Å²	43.1	44%	0.442	23%	0.226	S	C	.	.			trans	-113.8	-20.8	178.8	48.5	0	0	0	0	112.4	T420 K442 H466	T420-T444 PolarHBondContact O-N 2.87Å; T420-T444 PolarHBondContact O-OG1 2.86Å; K442-T444 PolarHBondContact O-N 3.03Å; T444-H466 HydrophobicContact CG2-CB 3.98Å
445	S	94.1	Very high	94.8	Very high	64 Å²	64	44.5 Å²	44.5	45%	0.448	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	136.9	-177	-179.1	0	0	0	0	110.2	K421 I422	K421-S445 WeakPolarHBondContact CA-O 3.34Å; I422-S445 PolarHBondContact N-O 2.86Å; I422-S445 VanDerWaalsContact N-O 3.16Å
446	I	95.8	Very high	94.7	Very high	22 Å²	22	46.8 Å²	46.8	11%	0.113	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	131.3	172.1	-60.8	178.7	0	0	0	105.9	I422 I443 F451 I467 P471	I422-I446 HydrophobicContact CB-CB 4.5Å; I422-I446 HydrophobicContact CB-CG1 4.21Å; I422-I446 HydrophobicContact CB-CG2 4.22Å; I422-I446 HydrophobicContact CD1-CD1 3.9Å; I422-I446 HydrophobicContact CD1-CG1 3.9Å; I422-I446 HydrophobicContact CG1-CG1 4.14Å; I443-I446 HydrophobicContact CG2-CD1 4.22Å; I443-I446 HydrophobicContact CG2-CG1 3.76Å; I446-F451 HydrophobicContact CD1-CE2 4.14Å; I446-F451 HydrophobicContact CD1-CZ 4.39Å; I446-F451 HydrophobicContact CG2-CE2 4.05Å; I446-F451 HydrophobicContact CG2-CZ 4.3Å; I446-I467 HydrophobicContact CD1-CD1 3.85Å; I446-P471 HydrophobicContact CB-CB 4.28Å; I446-P471 HydrophobicContact CB-CG 4.37Å; I446-P471 HydrophobicContact CD1-CG 4.01Å; I446-P471 HydrophobicContact CG2-CB 3.89Å; I446-P471 HydrophobicContact CG2-CG 4.07Å
447	E	93.4	Very high	94.6	Very high	90 Å²	90	46.8 Å²	46.8	42%	0.421	25%	0.251	S	S	.	.			trans	-66	140.5	-178.8	-173.3	-171.8	162.4	0	0	111.8	I422 S423 K424 R449 T450	I422-E447 PolarHBondContact O-N 3.18Å; S423-E447 WeakPolarHBondContact CA-OE2 3.23Å; K424-E447 WeakPolarHBondContact CB-OE2 3.32Å; K424-E447 PolarHBondContact N-OE2 3.12Å; E447-R449 PolarHBondContact O-N 3.38Å; E447-T450 WeakPolarHBondContact CB-OG1 3.18Å; E447-T450 VanDerWaalsContact O-CB 3.31Å; E447-T450 WeakPolarHBondContact O-CB 3.41Å; E447-T450 PolarHBondContact O-N 3.18Å; E447-T450 VanDerWaalsContact O-N 3.11Å; E447-T450 PolarHBondContact O-OG1 2.78Å
448	D	85.9	Confident	94.6	Very high	114 Å²	114	49.8 Å²	49.8	61%	0.61	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.6	130.1	177.2	-110.9	15.5	0	0	0	112.3	T450	D448-T450 PolarHBondContact O-N 3.26Å
449	R	86.6	Confident	94.6	Very high	153 Å²	153	52.3 Å²	52.3	58%	0.577	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	62	16.8	178.7	-52.9	173.5	-178.5	71.5	2.5	115.2	E447 F451 M452	E447-R449 PolarHBondContact O-N 3.38Å; R449-F451 VanDerWaalsContact C-N 3.32Å; R449-F451 PolarHBondContact O-N 3.34Å; R449-M452 HydrophobicContact CB-CB 4.02Å; R449-M452 HydrophobicContact CB-CG 3.98Å; R449-M452 HydrophobicContact CG-CG 4.23Å; R449-M452 PolarHBondContact O-N 3.28Å
450	T	92.5	Very high	94.6	Very high	5 Å²	5	51.9 Å²	51.9	3%	0.031	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.1	-51.9	172.4	-67.4	0	0	0	0	111.9	I422 F427 E447 D448	I422-T450 HydrophobicContact CG2-CG2 3.87Å; F427-T450 HydrophobicContact CD2-CG2 3.92Å; E447-T450 WeakPolarHBondContact CB-OG1 3.18Å; E447-T450 VanDerWaalsContact O-CB 3.31Å; E447-T450 WeakPolarHBondContact O-CB 3.41Å; E447-T450 PolarHBondContact O-N 3.18Å; E447-T450 VanDerWaalsContact O-N 3.11Å; E447-T450 PolarHBondContact O-OG1 2.78Å; D448-T450 PolarHBondContact O-N 3.26Å
451	F	93.9	Very high	94.6	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-83.9	-14.9	-176.5	-56.1	-47.3	0	0	0	114.2	I422 F427 I436 I446 R449 G453 L454 L457 V460 P471 L473	I422-F451 HydrophobicContact CD1-CZ 4.14Å; F427-F451 HydrophobicContact CD2-CD1 4.46Å; F427-F451 HydrophobicContact CD2-CE1 4Å; F427-F451 AromaticContact CE2-CE1 3.83Å; F427-F451 HydrophobicContact CE2-CE1 3.83Å; I436-F451 HydrophobicContact CD1-CD1 3.92Å; I436-F451 HydrophobicContact CD1-CE1 3.65Å; I446-F451 HydrophobicContact CD1-CE2 4.14Å; I446-F451 HydrophobicContact CD1-CZ 4.39Å; I446-F451 HydrophobicContact CG2-CE2 4.05Å; I446-F451 HydrophobicContact CG2-CZ 4.3Å; R449-F451 VanDerWaalsContact C-N 3.32Å; R449-F451 PolarHBondContact O-N 3.34Å; F451-G453 PolarHBondContact O-N 3.25Å; F451-L454 HydrophobicContact CD1-CD1 4.06Å; F451-L454 WeakPolarHBondContact O-CB 3.24Å; F451-L454 PolarHBondContact O-N 3.26Å; F451-L454 VanDerWaalsContact O-N 3.17Å; F451-L457 HydrophobicContact CB-CD2 3.96Å; F451-L457 HydrophobicContact CD1-CD2 4.35Å; F451-L457 HydrophobicContact CG-CD2 4.31Å; F451-V460 HydrophobicContact CE2-CG1 4.46Å; F451-P471 HydrophobicContact CD2-CB 4.32Å; F451-P471 HydrophobicContact CD2-CG 3.77Å; F451-P471 HydrophobicContact CE2-CG 3.69Å; F451-L473 HydrophobicContact CB-CD2 3.98Å; F451-L473 HydrophobicContact CD2-CD2 3.57Å; F451-L473 HydrophobicContact CE2-CD2 4.41Å; F451-L473 HydrophobicContact CG-CD2 4.1Å
452	M	89.9	Confident	94.6	Very high	96 Å²	96	51.6 Å²	51.6	47%	0.473	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-65.6	-15.7	174.7	-64	-63.7	-62.4	0	0	113.2	R449 L454 A472 L473	R449-M452 HydrophobicContact CB-CB 4.02Å; R449-M452 HydrophobicContact CB-CG 3.98Å; R449-M452 HydrophobicContact CG-CG 4.23Å; R449-M452 PolarHBondContact O-N 3.28Å; M452-L454 VanDerWaalsContact C-N 3.28Å; M452-A472 HydrophobicContact CG-CB 3.85Å; M452-A472 HydrophobicContact SD-CB 4.08Å; M452-L473 VanDerWaalsContact SD-C 3.54Å; M452-L473 VanDerWaalsContact SD-O 3.42Å
453	G	86.1	Confident	94.6	Very high	43 Å²	43	48.9 Å²	48.9	44%	0.443	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-82.6	3.7	174.7	0	0	0	0	0	114.9	F451 P455	F451-G453 PolarHBondContact O-N 3.25Å; G453-P455 WeakPolarHBondContact O-CD 3.33Å
454	L	95.4	Very high	94.6	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.005	27%	0.272	C	S	.	.			trans	-117.2	88.5	-170.2	-57.5	176.2	0	0	0	110.5	F427 M430 L433 I436 F451 M452 E456 L457	F427-L454 HydrophobicContact CB-CD1 4.06Å; F427-L454 HydrophobicContact CB-CD2 4.14Å; F427-L454 HydrophobicContact CG-CD1 4.43Å; M430-L454 HydrophobicContact CB-CD2 3.89Å; L433-L454 HydrophobicContact CB-CD2 4.46Å; L433-L454 HydrophobicContact CD2-CD1 4.05Å; L433-L454 HydrophobicContact CD2-CD2 4.44Å; I436-L454 HydrophobicContact CD1-CD1 4.03Å; F451-L454 HydrophobicContact CD1-CD1 4.06Å; F451-L454 WeakPolarHBondContact O-CB 3.24Å; F451-L454 PolarHBondContact O-N 3.26Å; F451-L454 VanDerWaalsContact O-N 3.17Å; M452-L454 VanDerWaalsContact C-N 3.28Å; L454-E456 VanDerWaalsContact C-N 3.28Å; L454-E456 PolarHBondContact O-N 3.28Å; L454-L457 HydrophobicContact CB-CB 3.84Å; L454-L457 HydrophobicContact CB-CD2 4.26Å; L454-L457 HydrophobicContact CB-CG 4.48Å; L454-L457 HydrophobicContact CD1-CD1 4.25Å; L454-L457 HydrophobicContact CD1-CD2 3.97Å; L454-L457 WeakPolarHBondContact O-CB 3.17Å; L454-L457 PolarHBondContact O-N 3.17Å
455	P	93.9	Very high	94.7	Very high	80 Å²	80	49.2 Å²	49.2	52%	0.519	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-12.1	-168.5	31.2	-38	0	0	0	114.8	N431 G453	N431-P455 HydrophobicContact CB-CG 4.47Å; G453-P455 WeakPolarHBondContact O-CD 3.33Å
456	E	96.6	Very high	94.9	Very high	81 Å²	81	51 Å²	51	38%	0.379	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.6	10	175.5	-74	-163.5	-126.7	0	0	112.9	N431 L433 K434 L454 E458	N431-E456 WeakPolarHBondContact O-CG 3.49Å; L433-E456 CarbonylContact O-C 3.54Å; K434-E456 WeakPolarHBondContact CA-O 3.4Å; K434-E456 WeakPolarHBondContact CE-OE2 3.5Å; K434-E456 HydrophobicContact CG-CB 4.49Å; K434-E456 IonicContact NZ-OE2 2.72Å; K434-E456 PolarHBondContact NZ-OE2 3.33Å; L454-E456 VanDerWaalsContact C-N 3.28Å; L454-E456 PolarHBondContact O-N 3.28Å; E456-E458 PolarHBondContact O-N 2.95Å
457	L	97.8	Very high	94.9	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	25%	0.25	C	C	.	.			trans	-71.8	123.2	-176.6	-163.6	71.4	0	0	0	110.7	L433 I436 F451 L454 V460 P474 T476 M477	L433-L457 HydrophobicContact CG-CD1 4.26Å; L433-L457 VanDerWaalsContact O-CA 3.23Å; L433-L457 WeakPolarHBondContact O-CA 3.26Å; L433-L457 VanDerWaalsContact O-CD1 3.3Å; L433-L457 WeakPolarHBondContact O-CD1 2.93Å; L433-L457 PolarHBondContact O-N 2.71Å; I436-L457 HydrophobicContact CD1-CD1 3.9Å; I436-L457 HydrophobicContact CD1-CD2 4.45Å; I436-L457 HydrophobicContact CG1-CD1 3.99Å; F451-L457 HydrophobicContact CB-CD2 3.96Å; F451-L457 HydrophobicContact CD1-CD2 4.35Å; F451-L457 HydrophobicContact CG-CD2 4.31Å; L454-L457 HydrophobicContact CB-CB 3.84Å; L454-L457 HydrophobicContact CB-CD2 4.26Å; L454-L457 HydrophobicContact CB-CG 4.48Å; L454-L457 HydrophobicContact CD1-CD1 4.25Å; L454-L457 HydrophobicContact CD1-CD2 3.97Å; L454-L457 WeakPolarHBondContact O-CB 3.17Å; L454-L457 PolarHBondContact O-N 3.17Å; L457-V460 HydrophobicContact CD2-CG2 3.6Å; L457-V460 HydrophobicContact CG-CG2 4.1Å; L457-P474 HydrophobicContact CB-CG 4.1Å; L457-P474 HydrophobicContact CD2-CG 4.37Å; L457-T476 CarbonylContact O-C 3.56Å; L457-T476 VanDerWaalsContact O-CB 3.29Å; L457-T476 WeakPolarHBondContact O-CB 3.29Å; L457-T476 PolarHBondContact O-OG1 3.02Å; L457-M477 VanDerWaalsContact C-CE 3.48Å; L457-M477 HydrophobicContact CB-CE 3.9Å; L457-M477 HydrophobicContact CD2-CE 3.79Å; L457-M477 HydrophobicContact CG-CE 3.56Å; L457-M477 WeakPolarHBondContact O-CE 3.36Å
458	E	98.1	Very high	95	Very high	72 Å²	72	49 Å²	49	34%	0.336	25%	0.251	S	S	.	.			trans	-118.5	-30.3	-173.2	-73.3	165.5	-150.3	0	0	112.1	K434 E456 T478 L479	K434-E458 WeakPolarHBondContact CE-OE1 3.01Å; K434-E458 IonicContact NZ-OE1 2.72Å; K434-E458 PolarHBondContact NZ-OE1 3.23Å; K434-E458 PolarHBondContact O-N 3.04Å; E456-E458 PolarHBondContact O-N 2.95Å; E458-T478 HydrophobicContact CB-CG2 4.23Å; E458-T478 HydrophobicContact CG-CG2 4.41Å; E458-T478 WeakPolarHBondContact O-CA 3.47Å; E458-T478 PolarHBondContact O-N 3.38Å; E458-T478 PolarHBondContact O-OG1 2.94Å; E458-L479 PolarHBondContact O-N 3.05Å
459	E	98.6	Very high	95.5	Very high	53 Å²	53	49.6 Å²	49.6	25%	0.248	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	128.2	-177.7	-62.3	-165.6	-129.6	0	0	112.8	K434 K435 I436 L479	K434-E459 PolarHBondContact O-N 3.12Å; K435-E459 WeakPolarHBondContact CA-O 3.28Å; K435-E459 HydrophobicContact CB-CB 4.25Å; K435-E459 HydrophobicContact CD-CB 4.1Å; K435-E459 HydrophobicContact CD-CG 4.47Å; K435-E459 VanDerWaalsContact CE-OE2 3.3Å; K435-E459 WeakPolarHBondContact CE-OE2 3.25Å; K435-E459 HydrophobicContact CG-CB 3.94Å; K435-E459 IonicContact NZ-OE1 2.73Å; K435-E459 IonicContact NZ-OE2 3.16Å; K435-E459 PolarHBondContact NZ-OE2 3.26Å; I436-E459 PolarHBondContact N-O 3.08Å; E459-L479 WeakPolarHBondContact CA-O 3.35Å; E459-L479 HydrophobicContact CB-CB 4.48Å; E459-L479 HydrophobicContact CG-CB 4.07Å
460	V	98.3	Very high	95.8	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.006	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	120.2	170.8	176.7	0	0	0	0	110.4	F451 L457 I462 L473 M477 L479 D481	F451-V460 HydrophobicContact CE2-CG1 4.46Å; L457-V460 HydrophobicContact CD2-CG2 3.6Å; L457-V460 HydrophobicContact CG-CG2 4.1Å; V460-I462 HydrophobicContact CG1-CG1 4.4Å; V460-I462 HydrophobicContact CG1-CG2 3.98Å; V460-L473 HydrophobicContact CB-CD2 4.34Å; V460-L473 HydrophobicContact CG1-CD2 4.47Å; V460-L473 HydrophobicContact CG2-CD2 3.88Å; V460-M477 HydrophobicContact CB-SD 4.36Å; V460-M477 HydrophobicContact CG2-CE 4.02Å; V460-M477 HydrophobicContact CG2-SD 3.95Å; V460-L479 PolarHBondContact N-O 2.92Å; V460-D481 PolarHBondContact O-N 2.89Å
461	I	98.7	Very high	95.8	Very high	21 Å²	21	43.8 Å²	43.8	11%	0.108	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	106.1	177.2	-53.3	174.8	0	0	0	108.1	I436 D437 L438 T439 R463 L479 D481	I436-I461 PolarHBondContact O-N 2.98Å; D437-I461 HydrophobicContact CB-CB 4.37Å; L438-I461 PolarHBondContact N-O 2.67Å; T439-I461 VanDerWaalsContact OG1-CG2 3.27Å; T439-I461 WeakPolarHBondContact OG1-CG2 3.48Å; I461-R463 HydrophobicContact CG2-CB 4.13Å; I461-L479 HydrophobicContact CD1-CD2 4.28Å; I461-L479 HydrophobicContact CG1-CD2 3.72Å; I461-D481 HydrophobicContact CG1-CB 4.43Å; I461-D481 HydrophobicContact CG2-CB 4.23Å
462	I	98.1	Very high	95.8	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.005	25%	0.249	C	C	.	.			trans	-119.6	25.4	178.6	50.1	172.1	0	0	0	111.1	L438 V460 N465 I467 L470 D481 A482 N485	L438-I462 HydrophobicContact CB-CG2 4.43Å; V460-I462 HydrophobicContact CG1-CG1 4.4Å; V460-I462 HydrophobicContact CG1-CG2 3.98Å; I462-N465 PolarHBondContact O-ND2 3.21Å; I462-I467 HydrophobicContact CB-CD1 3.96Å; I462-I467 HydrophobicContact CD1-CD1 3.76Å; I462-I467 HydrophobicContact CG1-CD1 4.29Å; I462-L470 HydrophobicContact CD1-CD1 4.18Å; I462-D481 WeakPolarHBondContact CG1-O 3.25Å; I462-D481 PolarHBondContact N-O 2.92Å; I462-A482 HydrophobicContact CD1-CB 3.83Å; I462-A482 HydrophobicContact CG1-CB 3.76Å; I462-N485 PolarHBondContact O-ND2 3.07Å
463	R	98.3	Very high	96	Very high	57 Å²	57	42.1 Å²	42.1	22%	0.215	23%	0.231	C	C	.	.			trans	-56.8	148.1	179.6	-170.7	179.8	85.6	75.3	18.6	113	T439 A440 I461 N465 D481 S483	T439-R463 CarbonylContact C-O 3.27Å; T439-R463 VanDerWaalsContact CA-O 3.26Å; T439-R463 WeakPolarHBondContact CA-O 3.43Å; T439-R463 HydrophobicContact CG2-CB 4.26Å; T439-R463 VanDerWaalsContact CG2-NH2 3.28Å; A440-R463 PolarHBondContact N-O 2.91Å; I461-R463 HydrophobicContact CG2-CB 4.13Å; R463-N465 PolarHBondContact O-ND2 3.47Å; R463-N465 VanDerWaalsContact O-ND2 3.12Å; R463-D481 WeakPolarHBondContact CD-OD2 3.49Å; R463-D481 PolarHBondContact N-O 3.06Å; R463-S483 CarbonylContact C-O 3.45Å; R463-S483 WeakPolarHBondContact CA-O 3.19Å; R463-S483 WeakPolarHBondContact CD-OG 3.31Å; R463-S483 WeakPolarHBondContact CG-O 3.07Å; R463-S483 VanDerWaalsContact CG-OG 3.31Å; R463-S483 WeakPolarHBondContact CG-OG 3.48Å
464	E	98.4	Very high	96.3	Very high	73 Å²	73	40.7 Å²	40.7	34%	0.341	21%	0.213	S	C	.	.	S	Bend	trans	54.6	63.4	179.4	-74.5	169	-176.2	0	0	111.7	A440 N441 S483 H484	A440-E464 WeakPolarHBondContact CA-O 3.47Å; A440-E464 HydrophobicContact CB-CB 4.23Å; A440-E464 PolarHBondContact N-O 3.06Å; N441-E464 PolarHBondContact N-O 2.77Å; E464-S483 PolarHBondContact N-O 2.8Å; E464-H484 WeakPolarHBondContact CA-O 3.21Å; E464-H484 HydrophobicContact CB-CB 4.47Å; E464-H484 HydrophobicContact CG-CB 3.78Å; E464-H484 PolarHBondContact N-O 2.81Å
465	N	98.6	Very high	96.3	Very high	6 Å²	6	46.9 Å²	46.9	3%	0.032	24%	0.242	C	C	.	.	S	Bend	trans	-137.1	-168.9	175.7	-83.9	-80.8	0	0	0	109.8	L438 N441 K442 I443 I462 R463 I467 H484 N485	L438-N465 PolarHBondContact O-ND2 3.25Å; L438-N465 VanDerWaalsContact O-ND2 3.09Å; N441-N465 VanDerWaalsContact CA-OD1 3.29Å; N441-N465 WeakPolarHBondContact CA-OD1 3.21Å; N441-N465 WeakPolarHBondContact CB-OD1 3.2Å; N441-N465 PolarHBondContact N-OD1 2.91Å; N441-N465 PolarHBondContact O-OD1 2.83Å; K442-N465 PolarHBondContact N-OD1 2.88Å; I443-N465 HydrophobicContact CB-CB 4.29Å; I443-N465 VanDerWaalsContact CB-OD1 3.32Å; I443-N465 WeakPolarHBondContact CB-OD1 3.38Å; I443-N465 WeakPolarHBondContact CD1-OD1 3.3Å; I443-N465 WeakPolarHBondContact CG1-OD1 3.19Å; I443-N465 PolarHBondContact N-OD1 3.06Å; I462-N465 PolarHBondContact O-ND2 3.21Å; R463-N465 PolarHBondContact O-ND2 3.47Å; R463-N465 VanDerWaalsContact O-ND2 3.12Å; N465-I467 HydrophobicContact CB-CD1 4.08Å; N465-I467 HydrophobicContact CB-CG1 4.11Å; N465-H484 PolarHBondContact N-O 3.24Å; N465-N485 WeakPolarHBondContact CA-OD1 3.31Å; N465-N485 WeakPolarHBondContact CB-OD1 3.36Å; N465-N485 PolarHBondContact O-OD1 3.32Å
466	H	97.8	Very high	96.4	Very high	103 Å²	103	45.5 Å²	45.5	48%	0.477	23%	0.232	S	C	.	.			trans	-122.3	34.9	-175.9	-55.9	74.7	0	0	0	110.5	I443 T444 N485	I443-H466 CarbonylContact O-C 3.37Å; I443-H466 WeakPolarHBondContact O-CA 3.33Å; I443-H466 PolarHBondContact O-N 2.79Å; T444-H466 HydrophobicContact CG2-CB 3.98Å; H466-N485 PolarHBondContact N-OD1 3.21Å
467	I	96.7	Very high	96.5	Very high	3 Å²	3	41.6 Å²	41.6	2%	0.015	21%	0.214	C	C	.	.			trans	-81.5	126.7	-173.4	-61.9	168.1	0	0	0	109.2	I443 I446 I462 N465 Q469 N485 N486 I487	I443-I467 HydrophobicContact CB-CD1 4.17Å; I443-I467 HydrophobicContact CB-CG1 4.13Å; I443-I467 HydrophobicContact CG2-CD1 3.91Å; I443-I467 HydrophobicContact CG2-CG1 3.86Å; I443-I467 WeakPolarHBondContact O-CG1 3.42Å; I443-I467 PolarHBondContact O-N 2.6Å; I446-I467 HydrophobicContact CD1-CD1 3.85Å; I462-I467 HydrophobicContact CB-CD1 3.96Å; I462-I467 HydrophobicContact CD1-CD1 3.76Å; I462-I467 HydrophobicContact CG1-CD1 4.29Å; N465-I467 HydrophobicContact CB-CD1 4.08Å; N465-I467 HydrophobicContact CB-CG1 4.11Å; I467-Q469 WeakPolarHBondContact CG2-O 3.48Å; I467-N485 VanDerWaalsContact CB-OD1 3.28Å; I467-N485 WeakPolarHBondContact CB-OD1 3.46Å; I467-N485 PolarHBondContact N-OD1 3.27Å; I467-N486 CarbonylContact O-C 3.1Å; I467-N486 VanDerWaalsContact O-C 3.27Å; I467-N486 WeakPolarHBondContact O-CA 3.48Å; I467-N486 PolarHBondContact O-N 3.25Å; I467-I487 WeakPolarHBondContact O-CG1 3.25Å; I467-I487 PolarHBondContact O-N 3.04Å
468	S	95.8	Very high	96.5	Very high	65 Å²	65	43.3 Å²	43.3	46%	0.455	23%	0.225	S	C	.	.	S	Bend	trans	-98.2	-15.9	178	58.5	0	0	0	0	114.4	N486 G491	S468-N486 WeakPolarHBondContact CA-O 3.35Å; S468-G491 VanDerWaalsContact O-CA 3.26Å; S468-G491 WeakPolarHBondContact O-CA 3.48Å
469	Q	94.7	Very high	96.5	Very high	128 Å²	128	41.1 Å²	41.1	60%	0.598	22%	0.215	S	C	*	.	S	Bend	trans	-137	126.1	178.1	-75.9	-175.4	-47	0	0	110.9	I467 K490 G491	I467-Q469 WeakPolarHBondContact CG2-O 3.48Å; Q469-K490 PolarHBondContact NE2-O 2.71Å; Q469-K490 VanDerWaalsContact NE2-O 3.1Å; Q469-G491 CarbonylContact C-O 3.45Å; Q469-G491 WeakPolarHBondContact CA-O 3.23Å
470	L	94.3	Very high	96.5	Very high	20 Å²	20	38.6 Å²	38.6	11%	0.105	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-69.9	124.4	172.5	-168.7	74	0	0	0	108.7	I462 L473 I480 A482 I487 G491 F497	I462-L470 HydrophobicContact CD1-CD1 4.18Å; L470-L473 HydrophobicContact CG-CD1 4.45Å; L470-I480 HydrophobicContact CD1-CG2 4.43Å; L470-A482 HydrophobicContact CD1-CB 3.95Å; L470-I487 HydrophobicContact CB-CD1 4.45Å; L470-I487 HydrophobicContact CD1-CD1 4.31Å; L470-G491 PolarHBondContact N-O 2.76Å; L470-F497 HydrophobicContact CD2-CE1 3.76Å; L470-F497 HydrophobicContact CD2-CZ 3.59Å
471	P	92.4	Very high	96.5	Very high	15 Å²	15	39.5 Å²	39.5	10%	0.097	21%	0.208	C	C	.	.	P	Polyproline II helix	trans	-70.3	163.2	-178.8	29.6	-35.7	0	0	0	111.9	I446 F451 L473	I446-P471 HydrophobicContact CB-CB 4.28Å; I446-P471 HydrophobicContact CB-CG 4.37Å; I446-P471 HydrophobicContact CD1-CG 4.01Å; I446-P471 HydrophobicContact CG2-CB 3.89Å; I446-P471 HydrophobicContact CG2-CG 4.07Å; F451-P471 HydrophobicContact CD2-CB 4.32Å; F451-P471 HydrophobicContact CD2-CG 3.77Å; F451-P471 HydrophobicContact CE2-CG 3.69Å; P471-L473 PolarHBondContact O-N 3.33Å
472	A	92.6	Very high	96.5	Very high	45 Å²	45	38.5 Å²	38.5	37%	0.372	20%	0.203	S	C	.	.	P	Polyproline II helix	trans	-62.8	121	169.4	0	0	0	0	0	110.7	M452	M452-A472 HydrophobicContact CG-CB 3.85Å; M452-A472 HydrophobicContact SD-CB 4.08Å
473	L	94.1	Very high	96.5	Very high	17 Å²	17	38.9 Å²	38.9	9%	0.089	21%	0.206	C	C	.	.			trans	-113.9	149.1	-177.7	-71.6	165.2	0	0	0	110.3	F451 M452 V460 L470 P471 M477 I480 M500	F451-L473 HydrophobicContact CB-CD2 3.98Å; F451-L473 HydrophobicContact CD2-CD2 3.57Å; F451-L473 HydrophobicContact CE2-CD2 4.41Å; F451-L473 HydrophobicContact CG-CD2 4.1Å; M452-L473 VanDerWaalsContact SD-C 3.54Å; M452-L473 VanDerWaalsContact SD-O 3.42Å; V460-L473 HydrophobicContact CB-CD2 4.34Å; V460-L473 HydrophobicContact CG1-CD2 4.47Å; V460-L473 HydrophobicContact CG2-CD2 3.88Å; L470-L473 HydrophobicContact CG-CD1 4.45Å; P471-L473 PolarHBondContact O-N 3.33Å; L473-M477 HydrophobicContact CB-CG 4.02Å; L473-M477 HydrophobicContact CB-SD 4.38Å; L473-M477 HydrophobicContact CD1-SD 4.41Å; L473-M477 HydrophobicContact CD2-SD 4.05Å; L473-I480 HydrophobicContact CD1-CD1 3.77Å; L473-I480 HydrophobicContact CD1-CG1 4.06Å; L473-I480 HydrophobicContact CD1-CG2 4.07Å; L473-M500 HydrophobicContact CB-CE 3.71Å
474	P	94.1	Very high	96.5	Very high	12 Å²	12	39 Å²	39	8%	0.078	21%	0.209	C	C	.	.			trans	-73.1	160.2	-178.4	30.7	-35.1	0	0	0	113	L457 T476 M477	L457-P474 HydrophobicContact CB-CG 4.1Å; L457-P474 HydrophobicContact CD2-CG 4.37Å; P474-T476 PolarHBondContact O-N 2.89Å; P474-T476 VanDerWaalsContact O-N 3.13Å; P474-M477 HydrophobicContact CG-CE 4.06Å; P474-M477 VanDerWaalsContact O-CG 3.23Å; P474-M477 WeakPolarHBondContact O-CG 3.48Å; P474-M477 PolarHBondContact O-N 3.08Å
475	E	94.8	Very high	96.5	Very high	131 Å²	131	36 Å²	36	61%	0.612	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-17.3	179	-68.5	161.6	-144.2	0	0	113.8	M477 D499	E475-M477 VanDerWaalsContact C-N 3.26Å; E475-M477 PolarHBondContact O-N 3.01Å; E475-D499 HydrophobicContact CG-CB 4.27Å
476	T	96.3	Very high	96.5	Very high	51 Å²	51	39.4 Å²	39.4	31%	0.313	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-3.2	-179.1	50.6	0	0	0	0	114.8	L457 P474 T478	L457-T476 CarbonylContact O-C 3.56Å; L457-T476 VanDerWaalsContact O-CB 3.29Å; L457-T476 WeakPolarHBondContact O-CB 3.29Å; L457-T476 PolarHBondContact O-OG1 3.02Å; P474-T476 PolarHBondContact O-N 2.89Å; P474-T476 VanDerWaalsContact O-N 3.13Å; T476-T478 PolarHBondContact O-N 2.93Å
477	M	97.9	Very high	96.4	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.19	C	C	.	.			trans	-55	133.6	178.3	-71.6	-72.2	94.8	0	0	113.2	L457 V460 L473 P474 E475 I480 M500 S502 L503	L457-M477 VanDerWaalsContact C-CE 3.48Å; L457-M477 HydrophobicContact CB-CE 3.9Å; L457-M477 HydrophobicContact CD2-CE 3.79Å; L457-M477 HydrophobicContact CG-CE 3.56Å; L457-M477 WeakPolarHBondContact O-CE 3.36Å; V460-M477 HydrophobicContact CB-SD 4.36Å; V460-M477 HydrophobicContact CG2-CE 4.02Å; V460-M477 HydrophobicContact CG2-SD 3.95Å; L473-M477 HydrophobicContact CB-CG 4.02Å; L473-M477 HydrophobicContact CB-SD 4.38Å; L473-M477 HydrophobicContact CD1-SD 4.41Å; L473-M477 HydrophobicContact CD2-SD 4.05Å; P474-M477 HydrophobicContact CG-CE 4.06Å; P474-M477 VanDerWaalsContact O-CG 3.23Å; P474-M477 WeakPolarHBondContact O-CG 3.48Å; P474-M477 PolarHBondContact O-N 3.08Å; E475-M477 VanDerWaalsContact C-N 3.26Å; E475-M477 PolarHBondContact O-N 3.01Å; M477-I480 HydrophobicContact CB-CD1 4.07Å; M477-I480 HydrophobicContact CB-CG1 4.15Å; M477-I480 HydrophobicContact CG-CD1 3.98Å; M477-I480 HydrophobicContact CG-CG1 4.06Å; M477-I480 HydrophobicContact SD-CD1 4.36Å; M477-I480 HydrophobicContact SD-CG1 3.83Å; M477-M500 HydrophobicContact CB-SD 3.97Å; M477-M500 HydrophobicContact CG-CE 4.2Å; M477-M500 HydrophobicContact CG-SD 4.19Å; M477-S502 CarbonylContact O-C 3.35Å; M477-L503 HydrophobicContact CB-CD1 4.15Å; M477-L503 WeakPolarHBondContact O-CA 3.2Å; M477-L503 PolarHBondContact O-N 3.5Å
478	T	98.3	Very high	96.3	Very high	36 Å²	36	35.1 Å²	35.1	22%	0.221	20%	0.198	C	C	.	.	S	Bend	trans	-115.4	-32.7	172.2	71.4	0	0	0	0	111.9	E458 T476 L504 Y505	E458-T478 HydrophobicContact CB-CG2 4.23Å; E458-T478 HydrophobicContact CG-CG2 4.41Å; E458-T478 WeakPolarHBondContact O-CA 3.47Å; E458-T478 PolarHBondContact O-N 3.38Å; E458-T478 PolarHBondContact O-OG1 2.94Å; T476-T478 PolarHBondContact O-N 2.93Å; T478-L504 PolarHBondContact O-N 2.92Å; T478-Y505 PolarHBondContact O-N 2.65Å; T478-Y505 VanDerWaalsContact O-N 3.12Å
479	L	98.6	Very high	95.9	Very high	25 Å²	25	34.7 Å²	34.7	13%	0.131	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	128.8	175.8	-177.7	149.6	0	0	0	110.9	E458 E459 V460 I461 D481 Y505 Y507	E458-L479 PolarHBondContact O-N 3.05Å; E459-L479 WeakPolarHBondContact CA-O 3.35Å; E459-L479 HydrophobicContact CB-CB 4.48Å; E459-L479 HydrophobicContact CG-CB 4.07Å; V460-L479 PolarHBondContact N-O 2.92Å; I461-L479 HydrophobicContact CD1-CD2 4.28Å; I461-L479 HydrophobicContact CG1-CD2 3.72Å; L479-D481 HydrophobicContact CD2-CB 4.15Å; L479-Y505 WeakPolarHBondContact CA-O 3.18Å; L479-Y505 HydrophobicContact CB-CD2 4.31Å; L479-Y505 HydrophobicContact CD1-CD2 4.14Å; L479-Y505 HydrophobicContact CD1-CG 4.37Å; L479-Y507 HydrophobicContact CD1-CE2 4.46Å
480	I	98.4	Very high	95.6	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	113.4	171.5	-58.7	169.7	0	0	0	107.7	L470 L473 M477 F497 M500 L503 Y505 L506 Y507	L470-I480 HydrophobicContact CD1-CG2 4.43Å; L473-I480 HydrophobicContact CD1-CD1 3.77Å; L473-I480 HydrophobicContact CD1-CG1 4.06Å; L473-I480 HydrophobicContact CD1-CG2 4.07Å; M477-I480 HydrophobicContact CB-CD1 4.07Å; M477-I480 HydrophobicContact CB-CG1 4.15Å; M477-I480 HydrophobicContact CG-CD1 3.98Å; M477-I480 HydrophobicContact CG-CG1 4.06Å; M477-I480 HydrophobicContact SD-CD1 4.36Å; M477-I480 HydrophobicContact SD-CG1 3.83Å; I480-F497 HydrophobicContact CD1-CD1 4Å; I480-F497 HydrophobicContact CD1-CE1 3.84Å; I480-M500 HydrophobicContact CD1-CE 4.31Å; I480-M500 HydrophobicContact CD1-SD 3.78Å; I480-L503 HydrophobicContact CD1-CD1 3.79Å; I480-L503 HydrophobicContact CD1-CD2 4.3Å; I480-L503 HydrophobicContact CG1-CD1 3.86Å; I480-Y505 PolarHBondContact N-O 3.37Å; I480-L506 HydrophobicContact CB-CD1 3.93Å; I480-L506 HydrophobicContact CG2-CD1 3.99Å; I480-Y507 PolarHBondContact O-N 3.39Å
481	D	98.6	Very high	95.5	Very high	20 Å²	20	36.1 Å²	36.1	11%	0.107	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	107.3	171.5	-174.6	-0.3	0	0	0	110.5	V460 I461 I462 R463 L479 S483 Y507	V460-D481 PolarHBondContact O-N 2.89Å; I461-D481 HydrophobicContact CG1-CB 4.43Å; I461-D481 HydrophobicContact CG2-CB 4.23Å; I462-D481 WeakPolarHBondContact CG1-O 3.25Å; I462-D481 PolarHBondContact N-O 2.92Å; R463-D481 WeakPolarHBondContact CD-OD2 3.49Å; R463-D481 PolarHBondContact N-O 3.06Å; L479-D481 HydrophobicContact CD2-CB 4.15Å; D481-S483 WeakPolarHBondContact OD1-CB 3.22Å; D481-S483 PolarHBondContact OD1-N 3.27Å; D481-S483 PolarHBondContact OD1-OG 3.38Å; D481-Y507 HydrophobicContact CB-CD2 4.03Å
482	A	98.1	Very high	95.6	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.196	C	C	.	.			trans	-121	29.4	171.6	0	0	0	0	0	111.3	I462 L470 N485 I487 Y507 L508 N511	I462-A482 HydrophobicContact CD1-CB 3.83Å; I462-A482 HydrophobicContact CG1-CB 3.76Å; L470-A482 HydrophobicContact CD1-CB 3.95Å; A482-N485 PolarHBondContact O-ND2 3.38Å; A482-N485 VanDerWaalsContact O-ND2 3.08Å; A482-I487 HydrophobicContact CB-CD1 3.73Å; A482-Y507 PolarHBondContact N-O 2.99Å; A482-L508 HydrophobicContact CB-CD2 4.16Å; A482-N511 PolarHBondContact O-ND2 2.81Å
483	S	98.4	Very high	95.5	Very high	9 Å²	9	41 Å²	41	6%	0.063	21%	0.212	C	C	.	.			trans	-66.3	154.2	176.9	57	0	0	0	0	113	R463 E464 D481 N485 Y507 T509	R463-S483 CarbonylContact C-O 3.45Å; R463-S483 WeakPolarHBondContact CA-O 3.19Å; R463-S483 WeakPolarHBondContact CD-OG 3.31Å; R463-S483 WeakPolarHBondContact CG-O 3.07Å; R463-S483 VanDerWaalsContact CG-OG 3.31Å; R463-S483 WeakPolarHBondContact CG-OG 3.48Å; E464-S483 PolarHBondContact N-O 2.8Å; D481-S483 WeakPolarHBondContact OD1-CB 3.22Å; D481-S483 PolarHBondContact OD1-N 3.27Å; D481-S483 PolarHBondContact OD1-OG 3.38Å; S483-N485 PolarHBondContact O-ND2 2.94Å; S483-Y507 PolarHBondContact N-O 2.89Å; S483-T509 CarbonylContact C-O 3.54Å; S483-T509 WeakPolarHBondContact CA-O 3.38Å; S483-T509 WeakPolarHBondContact CB-O 3.42Å
484	H	98.4	Very high	95.2	Very high	61 Å²	61	47.2 Å²	47.2	28%	0.282	24%	0.239	S	C	.	.	S	Bend	trans	56.1	64.9	-174.6	-55.2	-93.2	0	0	0	111.7	E464 N465 T509 D510 R531	E464-H484 WeakPolarHBondContact CA-O 3.21Å; E464-H484 HydrophobicContact CB-CB 4.47Å; E464-H484 HydrophobicContact CG-CB 3.78Å; E464-H484 PolarHBondContact N-O 2.81Å; N465-H484 PolarHBondContact N-O 3.24Å; H484-T509 PolarHBondContact N-O 3.19Å; H484-D510 VanDerWaalsContact CA-O 3.22Å; H484-D510 WeakPolarHBondContact CA-O 3.18Å; H484-D510 HydrophobicContact CB-CB 4.42Å; H484-D510 IonicContact CE1-OD2 3.18Å; H484-D510 PolarHBondContact CE1-OD2 3.12Å; H484-D510 PolarHBondContact N-O 2.65Å; H484-D510 WeakPolarHBondContact ND1-CB 3.4Å; H484-D510 IonicContact ND1-OD2 2.87Å; H484-D510 PolarHBondContact ND1-OD2 3.2Å; H484-D510 IonicContact NE2-OD2 3.47Å; H484-R531 PolarHBondContact CE1-NH2 2.77Å
485	N	98.3	Very high	95	Very high	8 Å²	8	49.9 Å²	49.9	4%	0.043	25%	0.25	C	S	.	.	S	Bend	trans	-141.1	-167.3	177.3	-86.3	-81.4	0	0	0	109.4	I462 N465 H466 I467 A482 S483 I487 D510 N511	I462-N485 PolarHBondContact O-ND2 3.07Å; N465-N485 WeakPolarHBondContact CA-OD1 3.31Å; N465-N485 WeakPolarHBondContact CB-OD1 3.36Å; N465-N485 PolarHBondContact O-OD1 3.32Å; H466-N485 PolarHBondContact N-OD1 3.21Å; I467-N485 VanDerWaalsContact CB-OD1 3.28Å; I467-N485 WeakPolarHBondContact CB-OD1 3.46Å; I467-N485 PolarHBondContact N-OD1 3.27Å; A482-N485 PolarHBondContact O-ND2 3.38Å; A482-N485 VanDerWaalsContact O-ND2 3.08Å; S483-N485 PolarHBondContact O-ND2 2.94Å; N485-I487 HydrophobicContact CB-CD1 4.38Å; N485-I487 HydrophobicContact CB-CG1 4.13Å; N485-D510 PolarHBondContact N-O 3.17Å; N485-D510 VanDerWaalsContact N-O 3.09Å; N485-N511 WeakPolarHBondContact CA-OD1 3.46Å; N485-N511 WeakPolarHBondContact CB-OD1 3.29Å; N485-N511 PolarHBondContact O-OD1 3.04Å
486	N	97.3	Very high	94.9	Very high	78 Å²	78	45.3 Å²	45.3	42%	0.417	24%	0.235	S	C	.	.			trans	-118.9	33.4	180	-63.3	115.7	0	0	0	112.3	I467 S468 G488 N511	I467-N486 CarbonylContact O-C 3.1Å; I467-N486 VanDerWaalsContact O-C 3.27Å; I467-N486 WeakPolarHBondContact O-CA 3.48Å; I467-N486 PolarHBondContact O-N 3.25Å; S468-N486 WeakPolarHBondContact CA-O 3.35Å; N486-G488 PolarHBondContact O-N 3.35Å; N486-G488 VanDerWaalsContact O-N 3.1Å; N486-N511 PolarHBondContact N-OD1 3.02Å
487	I	96.9	Very high	94.9	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.221	C	C	.	.			trans	-71.7	105.9	-176.8	-57.7	175.6	0	0	0	108.4	I467 L470 A482 N485 I492 L508 N511 D512 V513	I467-I487 WeakPolarHBondContact O-CG1 3.25Å; I467-I487 PolarHBondContact O-N 3.04Å; L470-I487 HydrophobicContact CB-CD1 4.45Å; L470-I487 HydrophobicContact CD1-CD1 4.31Å; A482-I487 HydrophobicContact CB-CD1 3.73Å; N485-I487 HydrophobicContact CB-CD1 4.38Å; N485-I487 HydrophobicContact CB-CG1 4.13Å; I487-I492 HydrophobicContact CG2-CD1 4.21Å; I487-I492 HydrophobicContact CG2-CG1 3.67Å; I487-L508 HydrophobicContact CD1-CD2 4.22Å; I487-N511 HydrophobicContact CB-CB 4.35Å; I487-N511 VanDerWaalsContact CB-OD1 3.24Å; I487-N511 WeakPolarHBondContact CB-OD1 3.2Å; I487-N511 WeakPolarHBondContact CG1-OD1 3.49Å; I487-N511 PolarHBondContact N-OD1 3.3Å; I487-D512 CarbonylContact O-C 3.51Å; I487-D512 PolarHBondContact O-N 3.38Å; I487-V513 HydrophobicContact CG2-CG2 4.29Å; I487-V513 WeakPolarHBondContact O-CG2 3.36Å; I487-V513 PolarHBondContact O-N 3.13Å
488	G	93.3	Very high	94.6	Very high	17 Å²	17	47.3 Å²	47.3	18%	0.175	24%	0.239	C	C	.	.	B	Isolated β-bridge	trans	-93.5	-166.7	179.3	0	0	0	0	0	114.2	N486 K490 G491	N486-G488 PolarHBondContact O-N 3.35Å; N486-G488 VanDerWaalsContact O-N 3.1Å; G488-K490 PolarHBondContact O-N 2.66Å; G488-K490 VanDerWaalsContact O-N 3.12Å; G488-G491 VanDerWaalsContact O-CA 3.28Å; G488-G491 WeakPolarHBondContact O-CA 3.13Å; G488-G491 PolarHBondContact O-N 2.65Å
489	S	87.4	Confident	94.4	Very high	55 Å²	55	49.9 Å²	49.9	39%	0.385	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-21.2	179.1	67.7	0	0	0	0	116	D514 Y515	S489-D514 WeakPolarHBondContact CA-OD1 3.26Å; S489-D514 VanDerWaalsContact CB-CG 3.43Å; S489-D514 WeakPolarHBondContact CB-OD1 3.23Å; S489-D514 VanDerWaalsContact CB-OD2 3.32Å; S489-D514 WeakPolarHBondContact CB-OD2 3.35Å; S489-Y515 WeakPolarHBondContact O-CE1 3.49Å
490	K	89.3	Confident	94.2	Very high	176 Å²	176	49 Å²	49	77%	0.765	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.1	11.1	172.8	-58.3	179.6	-174.5	173.7	0	112.4	Q469 G488	Q469-K490 PolarHBondContact NE2-O 2.71Å; Q469-K490 VanDerWaalsContact NE2-O 3.1Å; G488-K490 PolarHBondContact O-N 2.66Å; G488-K490 VanDerWaalsContact O-N 3.12Å
491	G	91.3	Very high	94.1	Very high	3 Å²	3	54.2 Å²	54.2	3%	0.031	28%	0.279	C	S	.	.	S	Bend	trans	-83.1	-24.8	-175.2	0	0	0	0	0	113.9	S468 Q469 L470 G488	S468-G491 VanDerWaalsContact O-CA 3.26Å; S468-G491 WeakPolarHBondContact O-CA 3.48Å; Q469-G491 CarbonylContact C-O 3.45Å; Q469-G491 WeakPolarHBondContact CA-O 3.23Å; L470-G491 PolarHBondContact N-O 2.76Å; G488-G491 VanDerWaalsContact O-CA 3.28Å; G488-G491 WeakPolarHBondContact O-CA 3.13Å; G488-G491 PolarHBondContact O-N 2.65Å
492	I	94.9	Very high	94	Very high	8 Å²	8	56.1 Å²	56.1	4%	0.041	29%	0.294	C	S	.	.	S	Bend	trans	-121.1	126	-176.3	-54.7	177.3	0	0	0	108.5	I487 A496 F497 L508 V513 Y515 P517	I487-I492 HydrophobicContact CG2-CD1 4.21Å; I487-I492 HydrophobicContact CG2-CG1 3.67Å; I492-A496 HydrophobicContact CG2-CB 4.06Å; I492-F497 HydrophobicContact CG2-CE2 3.76Å; I492-F497 HydrophobicContact CG2-CZ 4.07Å; I492-L508 HydrophobicContact CD1-CD1 3.74Å; I492-L508 HydrophobicContact CD1-CD2 4.47Å; I492-V513 HydrophobicContact CD1-CG1 4.43Å; I492-V513 HydrophobicContact CD1-CG2 4.24Å; I492-Y515 PolarHBondContact O-OH 3.18Å; I492-Y515 VanDerWaalsContact O-OH 3.12Å; I492-P517 HydrophobicContact CD1-CB 4.25Å; I492-P517 HydrophobicContact CD1-CG 4.34Å; I492-P517 HydrophobicContact CG2-CB 4.14Å
493	H	91.8	Very high	94	Very high	153 Å²	153	56.1 Å²	56.1	71%	0.708	29%	0.294	S	S	*	.			trans	-64.7	146.9	177.2	-169.4	-87.5	0	0	0	110.9	E495 A496	H493-E495 PolarHBondContact O-N 3.38Å; H493-A496 HydrophobicContact CB-CB 4.2Å; H493-A496 WeakPolarHBondContact O-CB 3.45Å; H493-A496 PolarHBondContact O-N 3.17Å
494	K	87.5	Confident	94	Very high	148 Å²	148	57.5 Å²	57.5	64%	0.643	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	134.7	175.2	-159.6	-158.4	170.6	-148.1	0	109.3	A496	K494-A496 PolarHBondContact O-N 3.36Å
495	E	90	Very high	94	Very high	68 Å²	68	58.4 Å²	58.4	32%	0.318	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.3	15.3	-179.1	-41.1	-172.5	-160.9	0	0	114.5	H493 F497 K498 P519	H493-E495 PolarHBondContact O-N 3.38Å; E495-F497 PolarHBondContact O-N 2.88Å; E495-K498 HydrophobicContact CB-CB 4.14Å; E495-K498 HydrophobicContact CB-CD 3.91Å; E495-K498 HydrophobicContact CG-CD 4.49Å; E495-K498 WeakPolarHBondContact O-CB 3.49Å; E495-K498 PolarHBondContact O-N 3.23Å; E495-K498 WeakPolarHBondContact OE2-CD 3.33Å; E495-K498 IonicContact OE2-NZ 3.65Å; E495-K498 PolarHBondContact OE2-NZ 3.04Å; E495-P519 HydrophobicContact CB-CG 4.46Å; E495-P519 HydrophobicContact CG-CG 4.44Å
496	A	92.2	Very high	94	Very high	35 Å²	35	58 Å²	58	29%	0.289	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-27	-175.4	0	0	0	0	0	116.3	I492 H493 K494 M500	I492-A496 HydrophobicContact CG2-CB 4.06Å; H493-A496 HydrophobicContact CB-CB 4.2Å; H493-A496 WeakPolarHBondContact O-CB 3.45Å; H493-A496 PolarHBondContact O-N 3.17Å; K494-A496 PolarHBondContact O-N 3.36Å; A496-M500 VanDerWaalsContact O-CE 3.31Å; A496-M500 WeakPolarHBondContact O-CE 3.27Å
497	F	95	Very high	94.1	Very high	4 Å²	4	56.9 Å²	56.9	2%	0.018	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.3	-2.5	-177.8	-51.8	-64	0	0	0	113.5	L470 I480 I492 E495 D499 M500 L503 L506 P517 L520 P521	L470-F497 HydrophobicContact CD2-CE1 3.76Å; L470-F497 HydrophobicContact CD2-CZ 3.59Å; I480-F497 HydrophobicContact CD1-CD1 4Å; I480-F497 HydrophobicContact CD1-CE1 3.84Å; I492-F497 HydrophobicContact CG2-CE2 3.76Å; I492-F497 HydrophobicContact CG2-CZ 4.07Å; E495-F497 PolarHBondContact O-N 2.88Å; F497-D499 PolarHBondContact O-N 3.41Å; F497-M500 HydrophobicContact CB-SD 4.46Å; F497-M500 HydrophobicContact CD1-CE 4.47Å; F497-M500 HydrophobicContact CD1-SD 3.87Å; F497-M500 PolarHBondContact O-N 2.86Å; F497-L503 HydrophobicContact CB-CD2 4.23Å; F497-L503 HydrophobicContact CD1-CD2 4.12Å; F497-L503 HydrophobicContact CG-CD2 4.43Å; F497-L506 HydrophobicContact CD1-CD1 4.42Å; F497-L506 HydrophobicContact CD1-CD2 4.23Å; F497-L506 HydrophobicContact CD2-CD2 3.79Å; F497-L506 HydrophobicContact CE1-CD1 3.75Å; F497-L506 HydrophobicContact CE1-CD2 4.1Å; F497-L506 HydrophobicContact CE2-CD1 4.45Å; F497-L506 HydrophobicContact CE2-CD2 3.64Å; F497-L506 HydrophobicContact CG-CD2 4.09Å; F497-L506 HydrophobicContact CZ-CD1 3.76Å; F497-L506 HydrophobicContact CZ-CD2 3.8Å; F497-L506 HydrophobicContact CZ-CG 4.45Å; F497-P517 HydrophobicContact CD2-CB 4.17Å; F497-P517 HydrophobicContact CD2-CG 4.26Å; F497-P517 HydrophobicContact CE2-CB 3.83Å; F497-P517 HydrophobicContact CE2-CG 3.81Å; F497-L520 HydrophobicContact CD2-CD2 4.37Å; F497-P521 WeakPolarHBondContact O-CD 3.48Å; F497-P521 WeakPolarHBondContact O-CG 3.26Å
498	K	92.9	Very high	94.1	Very high	90 Å²	90	56.9 Å²	56.9	39%	0.391	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-51.1	-166.6	178.7	-179.3	168	-171.8	0	113.5	E495 M500 P519	E495-K498 HydrophobicContact CB-CB 4.14Å; E495-K498 HydrophobicContact CB-CD 3.91Å; E495-K498 HydrophobicContact CG-CD 4.49Å; E495-K498 WeakPolarHBondContact O-CB 3.49Å; E495-K498 PolarHBondContact O-N 3.23Å; E495-K498 WeakPolarHBondContact OE2-CD 3.33Å; E495-K498 IonicContact OE2-NZ 3.65Å; E495-K498 PolarHBondContact OE2-NZ 3.04Å; K498-M500 VanDerWaalsContact C-N 3.35Å; K498-P519 HydrophobicContact CB-CG 3.87Å; K498-P519 HydrophobicContact CD-CG 3.99Å; K498-P519 HydrophobicContact CG-CG 3.78Å
499	D	93.1	Very high	94.3	Very high	90 Å²	90	56.5 Å²	56.5	48%	0.481	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	1.3	-170.7	-51	-65	0	0	0	111.9	E475 F497 T501	E475-D499 HydrophobicContact CG-CB 4.27Å; F497-D499 PolarHBondContact O-N 3.41Å; D499-T501 PolarHBondContact O-N 3.05Å
500	M	95.9	Very high	94.9	Very high	7 Å²	7	56.5 Å²	56.5	3%	0.034	28%	0.28	C	S	.	.			trans	-76	67.2	176.4	-60.7	179.4	175.4	0	0	111.4	L473 M477 I480 A496 F497 K498 S502 L503 P521	L473-M500 HydrophobicContact CB-CE 3.71Å; M477-M500 HydrophobicContact CB-SD 3.97Å; M477-M500 HydrophobicContact CG-CE 4.2Å; M477-M500 HydrophobicContact CG-SD 4.19Å; I480-M500 HydrophobicContact CD1-CE 4.31Å; I480-M500 HydrophobicContact CD1-SD 3.78Å; A496-M500 VanDerWaalsContact O-CE 3.31Å; A496-M500 WeakPolarHBondContact O-CE 3.27Å; F497-M500 HydrophobicContact CB-SD 4.46Å; F497-M500 HydrophobicContact CD1-CE 4.47Å; F497-M500 HydrophobicContact CD1-SD 3.87Å; F497-M500 PolarHBondContact O-N 2.86Å; K498-M500 VanDerWaalsContact C-N 3.35Å; M500-S502 PolarHBondContact O-N 3.24Å; M500-L503 HydrophobicContact CB-CB 3.89Å; M500-L503 HydrophobicContact CB-CD2 4.45Å; M500-L503 WeakPolarHBondContact O-CB 3.3Å; M500-L503 PolarHBondContact O-N 3.34Å; M500-L503 HydrophobicContact SD-CD2 4.2Å; M500-P521 WeakPolarHBondContact O-CB 3.45Å
501	T	95.3	Very high	95.3	Very high	109 Å²	109	48.6 Å²	48.6	67%	0.669	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-17.4	-175.6	55.4	0	0	0	0	114.4	D499 S523	D499-T501 PolarHBondContact O-N 3.05Å; T501-S523 WeakPolarHBondContact O-CB 3.35Å; T501-S523 PolarHBondContact O-OG 3.45Å
502	S	96.8	Very high	95.6	Very high	59 Å²	59	52.8 Å²	52.8	41%	0.413	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-3.7	176.4	-63	0	0	0	0	115	M477 M500 L504	M477-S502 CarbonylContact O-C 3.35Å; M500-S502 PolarHBondContact O-N 3.24Å; S502-L504 PolarHBondContact O-N 3.49Å
503	L	98.1	Very high	95.6	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.266	C	S	.	.			trans	-70.8	118.5	-171.6	-174.9	67.1	0	0	0	111.8	M477 I480 F497 M500 L506 P521 S523 L524	M477-L503 HydrophobicContact CB-CD1 4.15Å; M477-L503 WeakPolarHBondContact O-CA 3.2Å; M477-L503 PolarHBondContact O-N 3.5Å; I480-L503 HydrophobicContact CD1-CD1 3.79Å; I480-L503 HydrophobicContact CD1-CD2 4.3Å; I480-L503 HydrophobicContact CG1-CD1 3.86Å; F497-L503 HydrophobicContact CB-CD2 4.23Å; F497-L503 HydrophobicContact CD1-CD2 4.12Å; F497-L503 HydrophobicContact CG-CD2 4.43Å; M500-L503 HydrophobicContact CB-CB 3.89Å; M500-L503 HydrophobicContact CB-CD2 4.45Å; M500-L503 WeakPolarHBondContact O-CB 3.3Å; M500-L503 PolarHBondContact O-N 3.34Å; M500-L503 HydrophobicContact SD-CD2 4.2Å; L503-L506 HydrophobicContact CD2-CB 4.5Å; L503-P521 HydrophobicContact CB-CG 3.97Å; L503-P521 HydrophobicContact CD2-CG 4.09Å; L503-S523 CarbonylContact O-C 3.55Å; L503-S523 VanDerWaalsContact O-C 3.32Å; L503-S523 PolarHBondContact O-OG 2.85Å; L503-L524 HydrophobicContact CD2-CD1 4.16Å; L503-L524 HydrophobicContact CG-CD1 4Å; L503-L524 WeakPolarHBondContact O-CA 3.12Å; L503-L524 PolarHBondContact O-N 3.48Å
504	L	98.2	Very high	95.7	Very high	38 Å²	38	48 Å²	48	20%	0.199	25%	0.247	C	C	.	.			trans	-105.8	-32.4	-179.7	-54.7	-173.2	0	0	0	112.7	T478 S502 S523 R525 S526	T478-L504 PolarHBondContact O-N 2.92Å; S502-L504 PolarHBondContact O-N 3.49Å; L504-S523 WeakPolarHBondContact CD2-O 3.49Å; L504-R525 HydrophobicContact CB-CG 4.43Å; L504-R525 HydrophobicContact CD2-CG 4.28Å; L504-R525 WeakPolarHBondContact O-CA 3.3Å; L504-R525 PolarHBondContact O-N 3.33Å; L504-S526 PolarHBondContact O-N 3.44Å; L504-S526 VanDerWaalsContact O-N 3.08Å
505	Y	98.6	Very high	96.1	Very high	81 Å²	81	44.7 Å²	44.7	32%	0.318	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	121.1	-171.9	-52	-75.2	0	0	0	111.2	T478 L479 I480 Y507	T478-Y505 PolarHBondContact O-N 2.65Å; T478-Y505 VanDerWaalsContact O-N 3.12Å; L479-Y505 WeakPolarHBondContact CA-O 3.18Å; L479-Y505 HydrophobicContact CB-CD2 4.31Å; L479-Y505 HydrophobicContact CD1-CD2 4.14Å; L479-Y505 HydrophobicContact CD1-CG 4.37Å; I480-Y505 PolarHBondContact N-O 3.37Å; Y505-Y507 HydrophobicContact CD1-CE1 4.5Å; Y505-Y507 VanDerWaalsContact CD1-OH 3.25Å; Y505-Y507 WeakPolarHBondContact CD1-OH 3.39Å
506	L	98.4	Very high	96.3	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	110.1	173.9	178.8	58.3	0	0	0	110.1	I480 F497 L503 L508 L520 L524 S526 L527 H528	I480-L506 HydrophobicContact CB-CD1 3.93Å; I480-L506 HydrophobicContact CG2-CD1 3.99Å; F497-L506 HydrophobicContact CD1-CD1 4.42Å; F497-L506 HydrophobicContact CD1-CD2 4.23Å; F497-L506 HydrophobicContact CD2-CD2 3.79Å; F497-L506 HydrophobicContact CE1-CD1 3.75Å; F497-L506 HydrophobicContact CE1-CD2 4.1Å; F497-L506 HydrophobicContact CE2-CD1 4.45Å; F497-L506 HydrophobicContact CE2-CD2 3.64Å; F497-L506 HydrophobicContact CG-CD2 4.09Å; F497-L506 HydrophobicContact CZ-CD1 3.76Å; F497-L506 HydrophobicContact CZ-CD2 3.8Å; F497-L506 HydrophobicContact CZ-CG 4.45Å; L503-L506 HydrophobicContact CD2-CB 4.5Å; L506-L508 HydrophobicContact CD1-CD1 4.02Å; L506-L508 HydrophobicContact CD1-CG 4.07Å; L506-L508 HydrophobicContact CD2-CD1 4.2Å; L506-L508 HydrophobicContact CG-CD1 4.05Å; L506-L508 HydrophobicContact CG-CG 4.33Å; L506-L520 HydrophobicContact CD2-CD2 4.12Å; L506-L524 HydrophobicContact CB-CD1 3.91Å; L506-S526 PolarHBondContact N-O 3.02Å; L506-L527 HydrophobicContact CB-CD1 4.16Å; L506-L527 HydrophobicContact CD2-CD1 3.85Å; L506-L527 HydrophobicContact CG-CD1 4.05Å; L506-L527 WeakPolarHBondContact O-CA 3.23Å; L506-H528 PolarHBondContact O-N 3.32Å
507	Y	98.6	Very high	96.3	Very high	54 Å²	54	40.4 Å²	40.4	21%	0.212	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	114.5	-177.6	-51.2	-34	0	0	0	111	L479 I480 D481 A482 S483 Y505 H528	L479-Y507 HydrophobicContact CD1-CE2 4.46Å; I480-Y507 PolarHBondContact O-N 3.39Å; D481-Y507 HydrophobicContact CB-CD2 4.03Å; A482-Y507 PolarHBondContact N-O 2.99Å; S483-Y507 PolarHBondContact N-O 2.89Å; Y505-Y507 HydrophobicContact CD1-CE1 4.5Å; Y505-Y507 VanDerWaalsContact CD1-OH 3.25Å; Y505-Y507 WeakPolarHBondContact CD1-OH 3.39Å; Y507-H528 HydrophobicContact CD1-CB 3.73Å; Y507-H528 AromaticContact CD1-CG 3.73Å; Y507-H528 HydrophobicContact CG-CB 4.43Å
508	L	98	Very high	96.2	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.223	C	C	.	.			trans	-129.6	19.3	-177.4	-67.6	168.9	0	0	0	111.4	A482 I487 I492 L506 N511 P517 H528 L529 N532	A482-L508 HydrophobicContact CB-CD2 4.16Å; I487-L508 HydrophobicContact CD1-CD2 4.22Å; I492-L508 HydrophobicContact CD1-CD1 3.74Å; I492-L508 HydrophobicContact CD1-CD2 4.47Å; L506-L508 HydrophobicContact CD1-CD1 4.02Å; L506-L508 HydrophobicContact CD1-CG 4.07Å; L506-L508 HydrophobicContact CD2-CD1 4.2Å; L506-L508 HydrophobicContact CG-CD1 4.05Å; L506-L508 HydrophobicContact CG-CG 4.33Å; L508-N511 PolarHBondContact O-ND2 3Å; L508-N511 VanDerWaalsContact O-ND2 3.08Å; L508-P517 HydrophobicContact CD1-CG 4.28Å; L508-H528 CarbonylContact C-O 3.18Å; L508-H528 WeakPolarHBondContact CA-O 3.5Å; L508-H528 PolarHBondContact N-O 3.01Å; L508-L529 HydrophobicContact CB-CD2 3.82Å; L508-L529 HydrophobicContact CD1-CD2 3.99Å; L508-N532 PolarHBondContact O-ND2 3.2Å
509	T	98.1	Very high	96.2	Very high	9 Å²	9	41.6 Å²	41.6	6%	0.055	22%	0.222	C	C	.	.			trans	-49.6	144.9	174.2	-65.2	0	0	0	0	112.9	S483 H484 N511 H528 Q530	S483-T509 CarbonylContact C-O 3.54Å; S483-T509 WeakPolarHBondContact CA-O 3.38Å; S483-T509 WeakPolarHBondContact CB-O 3.42Å; H484-T509 PolarHBondContact N-O 3.19Å; T509-N511 PolarHBondContact O-ND2 2.81Å; T509-H528 PolarHBondContact N-O 3.41Å; T509-Q530 VanDerWaalsContact CA-O 3.26Å; T509-Q530 WeakPolarHBondContact CA-O 3.24Å; T509-Q530 HydrophobicContact CG2-CG 3.86Å; T509-Q530 PolarHBondContact OG1-NE2 2.87Å; T509-Q530 PolarHBondContact OG1-OE1 3.04Å
510	D	98.1	Very high	96.3	Very high	54 Å²	54	38 Å²	38	29%	0.289	20%	0.202	S	C	.	.	S	Bend	trans	49.9	72.2	-179.4	-95	-25.8	0	0	0	111.9	H484 N485 Q530 R531	H484-D510 VanDerWaalsContact CA-O 3.22Å; H484-D510 WeakPolarHBondContact CA-O 3.18Å; H484-D510 HydrophobicContact CB-CB 4.42Å; H484-D510 IonicContact CE1-OD2 3.18Å; H484-D510 PolarHBondContact CE1-OD2 3.12Å; H484-D510 PolarHBondContact N-O 2.65Å; H484-D510 WeakPolarHBondContact ND1-CB 3.4Å; H484-D510 IonicContact ND1-OD2 2.87Å; H484-D510 PolarHBondContact ND1-OD2 3.2Å; H484-D510 IonicContact NE2-OD2 3.47Å; N485-D510 PolarHBondContact N-O 3.17Å; N485-D510 VanDerWaalsContact N-O 3.09Å; D510-Q530 PolarHBondContact N-O 2.96Å; D510-R531 VanDerWaalsContact CA-O 3.25Å; D510-R531 WeakPolarHBondContact CA-O 3.34Å; D510-R531 PolarHBondContact N-O 3.23Å; D510-R531 VanDerWaalsContact OD1-CB 3.29Å; D510-R531 WeakPolarHBondContact OD1-CB 3.31Å; D510-R531 IonicContact OD1-CZ 3.22Å; D510-R531 IonicContact OD1-NE 2.86Å; D510-R531 PolarHBondContact OD1-NE 2.85Å; D510-R531 IonicContact OD1-NH2 2.85Å; D510-R531 IonicContact OD2-CZ 3.42Å; D510-R531 IonicContact OD2-NE 3.62Å; D510-R531 PolarHBondContact OD2-NE 2.87Å; D510-R531 IonicContact OD2-NH2 2.84Å; D510-R531 PolarHBondContact OD2-NH2 3.46Å
511	N	98.3	Very high	96.2	Very high	11 Å²	11	38 Å²	38	6%	0.059	20%	0.203	C	C	.	.	S	Bend	trans	-147.3	-179.1	174.5	-84.1	-82.4	0	0	0	109.3	A482 N485 N486 I487 L508 T509 V513 R531 N532	A482-N511 PolarHBondContact O-ND2 2.81Å; N485-N511 WeakPolarHBondContact CA-OD1 3.46Å; N485-N511 WeakPolarHBondContact CB-OD1 3.29Å; N485-N511 PolarHBondContact O-OD1 3.04Å; N486-N511 PolarHBondContact N-OD1 3.02Å; I487-N511 HydrophobicContact CB-CB 4.35Å; I487-N511 VanDerWaalsContact CB-OD1 3.24Å; I487-N511 WeakPolarHBondContact CB-OD1 3.2Å; I487-N511 WeakPolarHBondContact CG1-OD1 3.49Å; I487-N511 PolarHBondContact N-OD1 3.3Å; L508-N511 PolarHBondContact O-ND2 3Å; L508-N511 VanDerWaalsContact O-ND2 3.08Å; T509-N511 PolarHBondContact O-ND2 2.81Å; N511-V513 HydrophobicContact CB-CG2 4.11Å; N511-R531 PolarHBondContact N-O 3.48Å; N511-N532 VanDerWaalsContact CB-OD1 3.23Å; N511-N532 WeakPolarHBondContact CB-OD1 3.49Å; N511-N532 WeakPolarHBondContact O-CA 3.21Å; N511-N532 PolarHBondContact O-OD1 2.77Å; N511-N532 VanDerWaalsContact O-OD1 3.06Å
512	D	97.1	Very high	96.1	Very high	91 Å²	91	37.9 Å²	37.9	49%	0.487	20%	0.198	S	C	.	.	B	Isolated β-bridge	trans	-102.1	22.3	-175.6	-64.5	-72.7	0	0	0	112.8	I487	I487-D512 CarbonylContact O-C 3.51Å; I487-D512 PolarHBondContact O-N 3.38Å
513	V	96.1	Very high	96.1	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.189	C	C	.	.			trans	-74.3	134.7	-173.3	-169.7	0	0	0	0	111.1	I487 I492 N511 Y515 N532 N533 I534	I487-V513 HydrophobicContact CG2-CG2 4.29Å; I487-V513 WeakPolarHBondContact O-CG2 3.36Å; I487-V513 PolarHBondContact O-N 3.13Å; I492-V513 HydrophobicContact CD1-CG1 4.43Å; I492-V513 HydrophobicContact CD1-CG2 4.24Å; N511-V513 HydrophobicContact CB-CG2 4.11Å; V513-Y515 WeakPolarHBondContact CG1-O 3.25Å; V513-N532 VanDerWaalsContact CB-OD1 3.26Å; V513-N532 WeakPolarHBondContact CB-OD1 3.45Å; V513-N532 WeakPolarHBondContact CG2-OD1 3.25Å; V513-N532 PolarHBondContact N-OD1 2.63Å; V513-N532 WeakPolarHBondContact O-CB 3.35Å; V513-N533 CarbonylContact O-C 3.48Å; V513-N533 WeakPolarHBondContact O-CA 3.32Å; V513-N533 PolarHBondContact O-N 3.07Å; V513-I534 PolarHBondContact O-N 3.07Å
514	D	94.8	Very high	96	Very high	60 Å²	60	36.5 Å²	36.5	32%	0.321	19%	0.189	S	C	.	.			trans	-111.5	-1.1	-176.6	59.3	-9.1	0	0	0	115.2	S489 N533	S489-D514 WeakPolarHBondContact CA-OD1 3.26Å; S489-D514 VanDerWaalsContact CB-CG 3.43Å; S489-D514 WeakPolarHBondContact CB-OD1 3.23Å; S489-D514 VanDerWaalsContact CB-OD2 3.32Å; S489-D514 WeakPolarHBondContact CB-OD2 3.35Å; D514-N533 HydrophobicContact CB-CB 4.38Å
515	Y	94.4	Very high	96	Very high	78 Å²	78	40.5 Å²	40.5	31%	0.306	20%	0.201	S	C	.	.	S	Bend	trans	-137.8	160.8	173.4	64.5	-84.1	0	0	0	112.7	S489 I492 V513 P517	S489-Y515 WeakPolarHBondContact O-CE1 3.49Å; I492-Y515 PolarHBondContact O-OH 3.18Å; I492-Y515 VanDerWaalsContact O-OH 3.12Å; V513-Y515 WeakPolarHBondContact CG1-O 3.25Å; Y515-P517 HydrophobicContact CE2-CB 4.15Å
516	I	94.6	Very high	96	Very high	9 Å²	9	37 Å²	37	5%	0.046	19%	0.188	C	C	.	.			trans	-82	123.4	171	-62.3	169.1	0	0	0	107.9	V518 L520 L527 L529 I534 M537 T541 F542 L560	I516-V518 HydrophobicContact CG2-CG1 4.38Å; I516-V518 PolarHBondContact O-N 2.84Å; I516-L520 HydrophobicContact CG2-CD1 4.13Å; I516-L527 HydrophobicContact CG2-CD2 4.27Å; I516-L529 HydrophobicContact CB-CD1 4.43Å; I516-L529 HydrophobicContact CG1-CD1 4.06Å; I516-L529 HydrophobicContact CG2-CD1 4.12Å; I516-I534 HydrophobicContact CG1-CD1 4.02Å; I516-I534 HydrophobicContact CG1-CG2 4.11Å; I516-M537 HydrophobicContact CD1-CB 3.82Å; I516-M537 HydrophobicContact CD1-SD 4.41Å; I516-T541 HydrophobicContact CB-CG2 3.93Å; I516-T541 HydrophobicContact CD1-CG2 3.85Å; I516-T541 HydrophobicContact CG1-CG2 4.49Å; I516-T541 HydrophobicContact CG2-CG2 3.7Å; I516-F542 HydrophobicContact CD1-CE2 4.35Å; I516-F542 HydrophobicContact CD1-CZ 3.97Å; I516-F542 HydrophobicContact CG2-CE1 4.04Å; I516-F542 HydrophobicContact CG2-CZ 4.08Å; I516-L560 HydrophobicContact CD1-CD1 4.19Å; I516-L560 HydrophobicContact CD1-CD2 4.05Å; I516-L560 HydrophobicContact CG1-CD2 4.21Å
517	P	92.9	Very high	95.9	Very high	5 Å²	5	37 Å²	37	3%	0.032	19%	0.188	C	C	.	.			trans	-77.9	79.9	-167	30.6	-35.8	0	0	0	113.1	I492 F497 L508 Y515 L520	I492-P517 HydrophobicContact CD1-CB 4.25Å; I492-P517 HydrophobicContact CD1-CG 4.34Å; I492-P517 HydrophobicContact CG2-CB 4.14Å; F497-P517 HydrophobicContact CD2-CB 4.17Å; F497-P517 HydrophobicContact CD2-CG 4.26Å; F497-P517 HydrophobicContact CE2-CB 3.83Å; F497-P517 HydrophobicContact CE2-CG 3.81Å; L508-P517 HydrophobicContact CD1-CG 4.28Å; Y515-P517 HydrophobicContact CE2-CB 4.15Å; P517-L520 HydrophobicContact CG-CD2 4.43Å; P517-L520 VanDerWaalsContact O-CD2 3.24Å; P517-L520 WeakPolarHBondContact O-CD2 3.36Å
518	V	92.6	Very high	95.9	Very high	63 Å²	63	35.5 Å²	35.5	38%	0.382	18%	0.184	S	C	.	.	S	Bend	trans	-85.5	155.2	178.2	-66	0	0	0	0	113.2	I516 T541	I516-V518 HydrophobicContact CG2-CG1 4.38Å; I516-V518 PolarHBondContact O-N 2.84Å; V518-T541 HydrophobicContact CG1-CG2 3.91Å; V518-T541 WeakPolarHBondContact CG1-O 3.31Å
519	P	93.3	Very high	95.9	Very high	56 Å²	56	35.5 Å²	35.5	36%	0.364	18%	0.184	S	C	.	.	S	Bend	cis	-70.7	145.4	-9.5	30.4	-36.5	0	0	0	112.9	E495 K498	E495-P519 HydrophobicContact CB-CG 4.46Å; E495-P519 HydrophobicContact CG-CG 4.44Å; K498-P519 HydrophobicContact CB-CG 3.87Å; K498-P519 HydrophobicContact CD-CG 3.99Å; K498-P519 HydrophobicContact CG-CG 3.78Å
520	L	94.6	Very high	95.8	Very high	13 Å²	13	35.8 Å²	35.8	7%	0.068	18%	0.184	C	C	.	.			trans	-104.3	139.7	175.2	-65.3	166.5	0	0	0	109.3	F497 L506 I516 P517 L524 L527 F542 R552	F497-L520 HydrophobicContact CD2-CD2 4.37Å; L506-L520 HydrophobicContact CD2-CD2 4.12Å; I516-L520 HydrophobicContact CG2-CD1 4.13Å; P517-L520 HydrophobicContact CG-CD2 4.43Å; P517-L520 VanDerWaalsContact O-CD2 3.24Å; P517-L520 WeakPolarHBondContact O-CD2 3.36Å; L520-L524 HydrophobicContact CB-CD2 4.16Å; L520-L524 HydrophobicContact CD1-CD2 4.3Å; L520-L524 HydrophobicContact CD2-CD2 4.04Å; L520-L524 HydrophobicContact CG-CD2 4.41Å; L520-L527 HydrophobicContact CD1-CD2 3.7Å; L520-F542 HydrophobicContact CD1-CD1 4.07Å; L520-F542 HydrophobicContact CD1-CE1 3.77Å; L520-R552 PolarHBondContact O-NH2 2.84Å
521	P	94.4	Very high	95.8	Very high	8 Å²	8	38 Å²	38	5%	0.052	19%	0.189	C	C	.	.			trans	-71	146.3	-174.5	28.2	-32.8	0	0	0	112.4	F497 M500 L503 S523 L524 R552	F497-P521 WeakPolarHBondContact O-CD 3.48Å; F497-P521 WeakPolarHBondContact O-CG 3.26Å; M500-P521 WeakPolarHBondContact O-CB 3.45Å; L503-P521 HydrophobicContact CB-CG 3.97Å; L503-P521 HydrophobicContact CD2-CG 4.09Å; P521-S523 PolarHBondContact O-N 3.14Å; P521-S523 VanDerWaalsContact O-N 3.13Å; P521-L524 HydrophobicContact CG-CB 4.43Å; P521-L524 VanDerWaalsContact O-CB 3.29Å; P521-L524 WeakPolarHBondContact O-CB 3.37Å; P521-L524 PolarHBondContact O-N 3.41Å; P521-L524 VanDerWaalsContact O-N 3.1Å; P521-R552 VanDerWaalsContact C-NH2 3.28Å; P521-R552 PolarHBondContact O-NH2 3.47Å
522	D	92.6	Very high	95.7	Very high	106 Å²	106	38 Å²	38	57%	0.567	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-22	-175.4	-77.6	-57.4	0	0	0	114.1	L524 Y550 A554	D522-L524 VanDerWaalsContact C-N 3.34Å; D522-Y550 PolarHBondContact OD1-OH 2.85Å; D522-A554 WeakPolarHBondContact O-CB 3.47Å
523	S	95.9	Very high	95.7	Very high	30 Å²	30	37.5 Å²	37.5	21%	0.21	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-15.7	177.1	43.4	0	0	0	0	114.7	T501 L503 L504 P521 R525	T501-S523 WeakPolarHBondContact O-CB 3.35Å; T501-S523 PolarHBondContact O-OG 3.45Å; L503-S523 CarbonylContact O-C 3.55Å; L503-S523 VanDerWaalsContact O-C 3.32Å; L503-S523 PolarHBondContact O-OG 2.85Å; L504-S523 WeakPolarHBondContact CD2-O 3.49Å; P521-S523 PolarHBondContact O-N 3.14Å; P521-S523 VanDerWaalsContact O-N 3.13Å; S523-R525 WeakPolarHBondContact O-CG 3.26Å; S523-R525 PolarHBondContact O-N 3.15Å
524	L	97.3	Very high	95.7	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	19%	0.186	C	C	.	.			trans	-60.8	127.2	-175.5	-171.2	70.7	0	0	0	111.3	L503 L506 L520 P521 D522 L527 L555	L503-L524 HydrophobicContact CD2-CD1 4.16Å; L503-L524 HydrophobicContact CG-CD1 4Å; L503-L524 WeakPolarHBondContact O-CA 3.12Å; L503-L524 PolarHBondContact O-N 3.48Å; L506-L524 HydrophobicContact CB-CD1 3.91Å; L520-L524 HydrophobicContact CB-CD2 4.16Å; L520-L524 HydrophobicContact CD1-CD2 4.3Å; L520-L524 HydrophobicContact CD2-CD2 4.04Å; L520-L524 HydrophobicContact CG-CD2 4.41Å; P521-L524 HydrophobicContact CG-CB 4.43Å; P521-L524 VanDerWaalsContact O-CB 3.29Å; P521-L524 WeakPolarHBondContact O-CB 3.37Å; P521-L524 PolarHBondContact O-N 3.41Å; P521-L524 VanDerWaalsContact O-N 3.1Å; D522-L524 VanDerWaalsContact C-N 3.34Å; L524-L527 HydrophobicContact CD2-CB 4.2Å; L524-L527 HydrophobicContact CD2-CD1 4.38Å; L524-L555 HydrophobicContact CD2-CD1 4.29Å; L524-L555 HydrophobicContact CG-CD1 4.15Å; L524-L555 WeakPolarHBondContact O-CA 3.5Å; L524-L555 WeakPolarHBondContact O-CB 3.45Å; L524-L555 WeakPolarHBondContact O-CD1 3.31Å
525	R	97.1	Very high	95.6	Very high	122 Å²	122	40.1 Å²	40.1	46%	0.46	20%	0.196	S	C	.	.			trans	-107.1	-33.6	-176.9	-54.8	-170.2	-173.8	170.7	4.9	114.2	L504 S523 A554 E556 D557	L504-R525 HydrophobicContact CB-CG 4.43Å; L504-R525 HydrophobicContact CD2-CG 4.28Å; L504-R525 WeakPolarHBondContact O-CA 3.3Å; L504-R525 PolarHBondContact O-N 3.33Å; S523-R525 WeakPolarHBondContact O-CG 3.26Å; S523-R525 PolarHBondContact O-N 3.15Å; R525-A554 VanDerWaalsContact CA-O 3.25Å; R525-A554 WeakPolarHBondContact CA-O 3.48Å; R525-E556 PolarHBondContact O-N 3.33Å; R525-D557 PolarHBondContact O-N 3.28Å
526	S	98.1	Very high	95.4	Very high	7 Å²	7	42.7 Å²	42.7	5%	0.049	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	133	178.3	-167.7	0	0	0	0	111.6	L504 L506 H528 D557	L504-S526 PolarHBondContact O-N 3.44Å; L504-S526 VanDerWaalsContact O-N 3.08Å; L506-S526 PolarHBondContact N-O 3.02Å; S526-H528 PolarHBondContact OG-CD2 3.31Å; S526-H528 VanDerWaalsContact OG-CD2 3.23Å; S526-H528 PolarHBondContact OG-NE2 3.23Å; S526-H528 VanDerWaalsContact OG-NE2 3.1Å; S526-D557 VanDerWaalsContact CA-O 3.31Å; S526-D557 WeakPolarHBondContact CA-O 3.34Å; S526-D557 PolarHBondContact OG-O 3.49Å; S526-D557 PolarHBondContact OG-OD2 3.13Å
527	L	97.9	Very high	95.4	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	106.4	179.5	178.4	64.7	0	0	0	108.8	L506 I516 L520 L524 L529 F542 L555 D557 I558 R559	L506-L527 HydrophobicContact CB-CD1 4.16Å; L506-L527 HydrophobicContact CD2-CD1 3.85Å; L506-L527 HydrophobicContact CG-CD1 4.05Å; L506-L527 WeakPolarHBondContact O-CA 3.23Å; I516-L527 HydrophobicContact CG2-CD2 4.27Å; L520-L527 HydrophobicContact CD1-CD2 3.7Å; L524-L527 HydrophobicContact CD2-CB 4.2Å; L524-L527 HydrophobicContact CD2-CD1 4.38Å; L527-L529 HydrophobicContact CD1-CD1 3.93Å; L527-L529 HydrophobicContact CD1-CG 4.07Å; L527-L529 HydrophobicContact CD2-CD1 3.78Å; L527-L529 HydrophobicContact CG-CD1 3.78Å; L527-L529 HydrophobicContact CG-CG 4.13Å; L527-F542 HydrophobicContact CD2-CE1 3.67Å; L527-F542 HydrophobicContact CD2-CZ 4.11Å; L527-L555 HydrophobicContact CB-CD1 4.42Å; L527-D557 PolarHBondContact N-O 3.44Å; L527-I558 HydrophobicContact CD2-CG2 4.41Å; L527-I558 WeakPolarHBondContact O-CA 3.24Å; L527-R559 PolarHBondContact O-N 2.89Å
528	H	98.3	Very high	95.3	Very high	24 Å²	24	48.3 Å²	48.3	11%	0.111	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	103.4	-179.6	-75.1	-160.1	0	0	0	110.1	L506 Y507 L508 T509 S526 Q530 D557 R559	L506-H528 PolarHBondContact O-N 3.32Å; Y507-H528 HydrophobicContact CD1-CB 3.73Å; Y507-H528 AromaticContact CD1-CG 3.73Å; Y507-H528 HydrophobicContact CG-CB 4.43Å; L508-H528 CarbonylContact C-O 3.18Å; L508-H528 WeakPolarHBondContact CA-O 3.5Å; L508-H528 PolarHBondContact N-O 3.01Å; T509-H528 PolarHBondContact N-O 3.41Å; S526-H528 PolarHBondContact OG-CD2 3.31Å; S526-H528 VanDerWaalsContact OG-CD2 3.23Å; S526-H528 PolarHBondContact OG-NE2 3.23Å; S526-H528 VanDerWaalsContact OG-NE2 3.1Å; H528-Q530 PolarHBondContact ND1-NE2 3.1Å; H528-D557 IonicContact CD2-OD2 3.5Å; H528-D557 IonicContact CE1-OD2 2.83Å; H528-D557 IonicContact NE2-OD2 3.62Å; H528-D557 PolarHBondContact NE2-OD2 3.21Å; H528-R559 PolarHBondContact NE2-NE 2.96Å
529	L	97.4	Very high	95.3	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.241	C	C	.	.			trans	-116.4	14.5	178.1	-72.4	163.6	0	0	0	111.5	L508 I516 L527 N532 I534 R559 L560 N563	L508-L529 HydrophobicContact CB-CD2 3.82Å; L508-L529 HydrophobicContact CD1-CD2 3.99Å; I516-L529 HydrophobicContact CB-CD1 4.43Å; I516-L529 HydrophobicContact CG1-CD1 4.06Å; I516-L529 HydrophobicContact CG2-CD1 4.12Å; L527-L529 HydrophobicContact CD1-CD1 3.93Å; L527-L529 HydrophobicContact CD1-CG 4.07Å; L527-L529 HydrophobicContact CD2-CD1 3.78Å; L527-L529 HydrophobicContact CG-CD1 3.78Å; L527-L529 HydrophobicContact CG-CG 4.13Å; L529-N532 WeakPolarHBondContact O-CB 3.45Å; L529-N532 PolarHBondContact O-ND2 3.08Å; L529-I534 HydrophobicContact CB-CD1 3.87Å; L529-I534 HydrophobicContact CD1-CD1 3.95Å; L529-I534 HydrophobicContact CD2-CD1 4.21Å; L529-I534 HydrophobicContact CG-CD1 4.25Å; L529-R559 CarbonylContact C-O 3.57Å; L529-R559 WeakPolarHBondContact CA-O 3.3Å; L529-R559 PolarHBondContact N-O 3.49Å; L529-L560 HydrophobicContact CB-CD2 3.92Å; L529-L560 HydrophobicContact CD1-CD2 4.12Å; L529-N563 PolarHBondContact O-ND2 3.39Å
530	Q	96.6	Very high	95.2	Very high	15 Å²	15	52 Å²	52	7%	0.07	25%	0.249	C	C	.	.			trans	-62.5	144.9	-178.4	61.9	-85.9	20.2	0	0	112.8	T509 D510 H528 N532 R559 D561	T509-Q530 VanDerWaalsContact CA-O 3.26Å; T509-Q530 WeakPolarHBondContact CA-O 3.24Å; T509-Q530 HydrophobicContact CG2-CG 3.86Å; T509-Q530 PolarHBondContact OG1-NE2 2.87Å; T509-Q530 PolarHBondContact OG1-OE1 3.04Å; D510-Q530 PolarHBondContact N-O 2.96Å; H528-Q530 PolarHBondContact ND1-NE2 3.1Å; Q530-N532 PolarHBondContact O-ND2 2.98Å; Q530-R559 HydrophobicContact CB-CB 4.43Å; Q530-R559 PolarHBondContact N-O 2.92Å; Q530-D561 CarbonylContact C-O 3.32Å; Q530-D561 WeakPolarHBondContact CA-O 3.42Å; Q530-D561 VanDerWaalsContact CB-O 3.26Å; Q530-D561 WeakPolarHBondContact CB-O 3.49Å; Q530-D561 WeakPolarHBondContact CB-OD1 3.48Å; Q530-D561 WeakPolarHBondContact CB-OD2 3.47Å
531	R	97.1	Very high	95.1	Very high	101 Å²	101	51.9 Å²	51.9	38%	0.381	25%	0.249	S	C	.	.	S	Bend	trans	54	67.8	-171.5	-56.7	-174.1	-57	-70.6	2	112	H484 D510 N511 D561	H484-R531 PolarHBondContact CE1-NH2 2.77Å; D510-R531 VanDerWaalsContact CA-O 3.25Å; D510-R531 WeakPolarHBondContact CA-O 3.34Å; D510-R531 PolarHBondContact N-O 3.23Å; D510-R531 VanDerWaalsContact OD1-CB 3.29Å; D510-R531 WeakPolarHBondContact OD1-CB 3.31Å; D510-R531 IonicContact OD1-CZ 3.22Å; D510-R531 IonicContact OD1-NE 2.86Å; D510-R531 PolarHBondContact OD1-NE 2.85Å; D510-R531 IonicContact OD1-NH2 2.85Å; D510-R531 IonicContact OD2-CZ 3.42Å; D510-R531 IonicContact OD2-NE 3.62Å; D510-R531 PolarHBondContact OD2-NE 2.87Å; D510-R531 IonicContact OD2-NH2 2.84Å; D510-R531 PolarHBondContact OD2-NH2 3.46Å; N511-R531 PolarHBondContact N-O 3.48Å; R531-D561 PolarHBondContact N-O 2.85Å
532	N	97.6	Very high	95	Very high	11 Å²	11	51.6 Å²	51.6	6%	0.059	25%	0.247	C	C	.	.	S	Bend	trans	-136.2	-175.4	171.1	-85.8	-89.4	0	0	0	108.4	L508 N511 V513 L529 Q530 I534 N563	L508-N532 PolarHBondContact O-ND2 3.2Å; N511-N532 VanDerWaalsContact CB-OD1 3.23Å; N511-N532 WeakPolarHBondContact CB-OD1 3.49Å; N511-N532 WeakPolarHBondContact O-CA 3.21Å; N511-N532 PolarHBondContact O-OD1 2.77Å; N511-N532 VanDerWaalsContact O-OD1 3.06Å; V513-N532 VanDerWaalsContact CB-OD1 3.26Å; V513-N532 WeakPolarHBondContact CB-OD1 3.45Å; V513-N532 WeakPolarHBondContact CG2-OD1 3.25Å; V513-N532 PolarHBondContact N-OD1 2.63Å; V513-N532 WeakPolarHBondContact O-CB 3.35Å; L529-N532 WeakPolarHBondContact O-CB 3.45Å; L529-N532 PolarHBondContact O-ND2 3.08Å; Q530-N532 PolarHBondContact O-ND2 2.98Å; N532-I534 HydrophobicContact CB-CD1 4.46Å; N532-I534 HydrophobicContact CB-CG1 4.27Å; N532-N563 WeakPolarHBondContact CA-OD1 3.48Å; N532-N563 WeakPolarHBondContact CB-OD1 3.48Å; N532-N563 PolarHBondContact N-OD1 3.16Å; N532-N563 PolarHBondContact O-OD1 3.01Å; N532-N563 VanDerWaalsContact O-OD1 3.05Å
533	N	96.5	Very high	95	Very high	79 Å²	79	47.1 Å²	47.1	42%	0.422	22%	0.224	S	C	.	.			trans	-103.1	23.9	-177.6	-166.6	28.6	0	0	0	113.4	V513 D514 Q535	V513-N533 CarbonylContact O-C 3.48Å; V513-N533 WeakPolarHBondContact O-CA 3.32Å; V513-N533 PolarHBondContact O-N 3.07Å; D514-N533 HydrophobicContact CB-CB 4.38Å; N533-Q535 PolarHBondContact O-N 3.17Å
534	I	95.5	Very high	94.5	Very high	0 Å²	0	49 Å²	49	0%	0	23%	0.232	C	C	.	.			trans	-68.7	119.1	-175.6	-56.1	170.9	0	0	0	109.9	V513 I516 L529 N532 L560 N563 P564 I565	V513-I534 PolarHBondContact O-N 3.07Å; I516-I534 HydrophobicContact CG1-CD1 4.02Å; I516-I534 HydrophobicContact CG1-CG2 4.11Å; L529-I534 HydrophobicContact CB-CD1 3.87Å; L529-I534 HydrophobicContact CD1-CD1 3.95Å; L529-I534 HydrophobicContact CD2-CD1 4.21Å; L529-I534 HydrophobicContact CG-CD1 4.25Å; N532-I534 HydrophobicContact CB-CD1 4.46Å; N532-I534 HydrophobicContact CB-CG1 4.27Å; I534-L560 HydrophobicContact CD1-CD2 3.89Å; I534-N563 HydrophobicContact CB-CB 4.28Å; I534-N563 VanDerWaalsContact CB-OD1 3.24Å; I534-N563 WeakPolarHBondContact CB-OD1 3.09Å; I534-N563 VanDerWaalsContact CG1-OD1 3.3Å; I534-N563 WeakPolarHBondContact CG1-OD1 3.37Å; I534-N563 PolarHBondContact N-OD1 3.46Å; I534-P564 CarbonylContact O-C 3.55Å; I534-P564 VanDerWaalsContact O-CD 3.25Å; I534-P564 WeakPolarHBondContact O-CD 3.38Å; I534-P564 WeakPolarHBondContact O-CG 3.44Å; I534-I565 HydrophobicContact CG2-CD1 4.22Å; I534-I565 WeakPolarHBondContact O-CB 3.3Å; I534-I565 PolarHBondContact O-N 3.32Å
535	Q	93.2	Very high	93.8	Very high	116 Å²	116	52.8 Å²	52.8	54%	0.542	25%	0.252	S	S	.	.			trans	-99.4	-27	-175.2	-72.6	166.4	61.2	0	0	114.1	N533 P564	N533-Q535 PolarHBondContact O-N 3.17Å; Q535-P564 HydrophobicContact CG-CB 4.23Å; Q535-P564 HydrophobicContact CG-CG 3.66Å
536	M	90.7	Very high	93.3	Very high	132 Å²	132	54 Å²	54	65%	0.65	27%	0.267	S	S	*	.			trans	-156.1	163.1	-175	64.3	-174.9	-173.6	0	0	111.7
537	M	93.3	Very high	92.7	Very high	11 Å²	11	56.7 Å²	56.7	5%	0.054	28%	0.281	C	S	.	.			trans	-139.9	146.6	172.4	69.3	-170.2	169.7	0	0	109.1	I516 T541 I565 L567 T570 A573 Y574	I516-M537 HydrophobicContact CD1-CB 3.82Å; I516-M537 HydrophobicContact CD1-SD 4.41Å; M537-T541 HydrophobicContact CB-CG2 4.38Å; M537-I565 HydrophobicContact CB-CD1 3.97Å; M537-I565 HydrophobicContact CG-CD1 3.92Å; M537-I565 HydrophobicContact SD-CD1 3.89Å; M537-L567 HydrophobicContact CE-CB 4.37Å; M537-L567 HydrophobicContact CE-CD2 3.59Å; M537-L567 HydrophobicContact SD-CD2 4.05Å; M537-T570 WeakPolarHBondContact CE-OG1 3.42Å; M537-T570 VanDerWaalsContact CG-OG1 3.32Å; M537-T570 WeakPolarHBondContact CG-OG1 3.29Å; M537-T570 PolarHBondContact O-OG1 3.39Å; M537-A573 HydrophobicContact CE-CB 4.02Å; M537-A573 HydrophobicContact CG-CB 4.02Å; M537-A573 HydrophobicContact SD-CB 4.02Å; M537-Y574 HydrophobicContact CE-CD1 3.6Å; M537-Y574 HydrophobicContact CE-CE1 3.63Å
538	H	92.4	Very high	91.8	Very high	121 Å²	121	66 Å²	66	56%	0.56	32%	0.322	S	S	*	.			trans	-87.5	161.2	177.8	-74.4	-98.2	0	0	0	111.6	D540 T541 A573	H538-D540 WeakPolarHBondContact CB-OD1 3.22Å; H538-D540 PolarHBondContact O-N 3.37Å; H538-T541 PolarHBondContact N-OG1 2.85Å; H538-T541 VanDerWaalsContact O-CB 3.3Å; H538-T541 WeakPolarHBondContact O-CB 3.44Å; H538-T541 PolarHBondContact O-N 3.21Å; H538-T541 PolarHBondContact O-OG1 3.1Å; H538-A573 WeakPolarHBondContact O-CB 3.25Å
539	E	91.6	Very high	91.2	Very high	95 Å²	95	71.4 Å²	71.4	44%	0.444	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-19.1	-176.6	-54.1	-174.1	143.9	0	0	113.4	L545 Q572 A573	E539-L545 HydrophobicContact CB-CD1 4.12Å; E539-L545 HydrophobicContact CB-CD2 3.84Å; E539-Q572 HydrophobicContact CB-CB 4.16Å; E539-Q572 HydrophobicContact CG-CB 4.3Å; E539-A573 WeakPolarHBondContact O-CA 3.35Å
540	D	90.6	Very high	90.8	Very high	100 Å²	100	74 Å²	74	54%	0.535	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	5.3	175.7	60.8	-18	0	0	0	114.4	H538 F542 C543 L545	H538-D540 WeakPolarHBondContact CB-OD1 3.22Å; H538-D540 PolarHBondContact O-N 3.37Å; D540-F542 PolarHBondContact O-N 3.38Å; D540-C543 WeakPolarHBondContact CA-O 3.47Å; D540-L545 HydrophobicContact CB-CD1 3.9Å; D540-L545 HydrophobicContact CB-CG 4.05Å
541	T	92.8	Very high	90.4	Very high	11 Å²	11	78 Å²	78	7%	0.067	38%	0.383	C	S	.	.	S	Bend	trans	-61.5	-43.9	-171.1	-58.7	0	0	0	0	113.5	I516 V518 M537 H538	I516-T541 HydrophobicContact CB-CG2 3.93Å; I516-T541 HydrophobicContact CD1-CG2 3.85Å; I516-T541 HydrophobicContact CG1-CG2 4.49Å; I516-T541 HydrophobicContact CG2-CG2 3.7Å; V518-T541 HydrophobicContact CG1-CG2 3.91Å; V518-T541 WeakPolarHBondContact CG1-O 3.31Å; M537-T541 HydrophobicContact CB-CG2 4.38Å; H538-T541 PolarHBondContact N-OG1 2.85Å; H538-T541 VanDerWaalsContact O-CB 3.3Å; H538-T541 WeakPolarHBondContact O-CB 3.44Å; H538-T541 PolarHBondContact O-N 3.21Å; H538-T541 PolarHBondContact O-OG1 3.1Å
542	F	93.3	Very high	90.3	Very high	3 Å²	3	74 Å²	74	1%	0.013	37%	0.368	C	S	.	.	S	Bend	trans	-119.9	-15	175.9	-51.2	-66.2	0	0	0	113.8	I516 L520 L527 D540 R552 L555 I558 A573 L577	I516-F542 HydrophobicContact CD1-CE2 4.35Å; I516-F542 HydrophobicContact CD1-CZ 3.97Å; I516-F542 HydrophobicContact CG2-CE1 4.04Å; I516-F542 HydrophobicContact CG2-CZ 4.08Å; L520-F542 HydrophobicContact CD1-CD1 4.07Å; L520-F542 HydrophobicContact CD1-CE1 3.77Å; L527-F542 HydrophobicContact CD2-CE1 3.67Å; L527-F542 HydrophobicContact CD2-CZ 4.11Å; D540-F542 PolarHBondContact O-N 3.38Å; F542-R552 PolarHBondContact O-NH1 2.77Å; F542-L555 HydrophobicContact CD1-CD2 3.9Å; F542-L555 HydrophobicContact CE1-CD2 4.41Å; F542-I558 HydrophobicContact CD1-CD1 4.01Å; F542-I558 HydrophobicContact CD2-CD1 4.07Å; F542-I558 HydrophobicContact CE1-CD1 3.84Å; F542-I558 HydrophobicContact CE2-CD1 3.91Å; F542-I558 HydrophobicContact CE2-CG2 4.49Å; F542-I558 HydrophobicContact CG-CD1 4.12Å; F542-I558 HydrophobicContact CZ-CD1 3.78Å; F542-I558 HydrophobicContact CZ-CG2 4.02Å; F542-A573 WeakPolarHBondContact CB-O 3.4Å; F542-A573 WeakPolarHBondContact CD2-O 3.35Å; F542-A573 PolarHBondContact N-O 3.3Å; F542-L577 HydrophobicContact CB-CD1 4.45Å; F542-L577 HydrophobicContact CB-CD2 4.08Å; F542-L577 HydrophobicContact CD2-CD1 4.32Å; F542-L577 HydrophobicContact CG-CD1 4.48Å
543	C	91.5	Very high	90	Very high	12 Å²	12	78.7 Å²	78.7	8%	0.081	39%	0.393	C	S	.	.	S	Bend	trans	-120	143.6	-170.3	-57	0	0	0	0	112.2	D540 L545 A573 C576	D540-C543 WeakPolarHBondContact CA-O 3.47Å; C543-L545 PolarHBondContact O-N 3.15Å; C543-A573 PolarHBondContact SG-O 3.18Å; C543-A573 VanDerWaalsContact SG-O 3.39Å; C543-C576 WeakPolarHBondContact CA-SG 3.39Å; C543-C576 HydrophobicContact CB-CB 3.77Å; C543-C576 WeakPolarHBondContact CB-SG 3.17Å; C543-C576 WeakPolarHBondContact SG-CB 3.44Å; C543-C576 PolarHBondContact SG-N 2.79Å; C543-C576 CovalentContact SG-SG 2.03Å; C543-C576 PolarHBondContact SG-SG 3.13Å
544	N	86.4	Confident	89.9	Confident	70 Å²	70	76.5 Å²	76.5	37%	0.374	39%	0.386	S	S	.	.			trans	-84.5	107.4	176.7	-177.1	4.3	0	0	0	111.4	N546 D547 Y550	N544-N546 PolarHBondContact O-N 2.67Å; N544-N546 WeakPolarHBondContact OD1-CB 3.38Å; N544-N546 PolarHBondContact OD1-N 2.71Å; N544-N546 PolarHBondContact OD1-ND2 3.43Å; N544-N546 VanDerWaalsContact OD1-ND2 3.11Å; N544-D547 CarbonylContact O-C 3.58Å; N544-D547 PolarHBondContact O-N 3.46Å; N544-Y550 HydrophobicContact CB-CD1 4.17Å; N544-Y550 HydrophobicContact CB-CD2 4.45Å; N544-Y550 HydrophobicContact CB-CG 4.02Å
545	L	82.7	Confident	89.9	Confident	78 Å²	78	76.6 Å²	76.6	41%	0.408	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-14.6	177.7	-61.6	179.1	0	0	0	114.7	E539 D540 C543	E539-L545 HydrophobicContact CB-CD1 4.12Å; E539-L545 HydrophobicContact CB-CD2 3.84Å; D540-L545 HydrophobicContact CB-CD1 3.9Å; D540-L545 HydrophobicContact CB-CG 4.05Å; C543-L545 PolarHBondContact O-N 3.15Å
546	N	85.6	Confident	89.9	Confident	148 Å²	148	75.3 Å²	75.3	79%	0.791	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-8.6	178.3	-52.2	-83.2	0	0	0	113.4	N544	N544-N546 PolarHBondContact O-N 2.67Å; N544-N546 WeakPolarHBondContact OD1-CB 3.38Å; N544-N546 PolarHBondContact OD1-N 2.71Å; N544-N546 PolarHBondContact OD1-ND2 3.43Å; N544-N546 VanDerWaalsContact OD1-ND2 3.11Å
547	D	86.3	Confident	90.1	Very high	63 Å²	63	70.9 Å²	70.9	34%	0.337	36%	0.359	S	S	.	.			trans	-138	99.1	177.7	-179	14.5	0	0	0	111.5	N544 N549 Y550	N544-D547 CarbonylContact O-C 3.58Å; N544-D547 PolarHBondContact O-N 3.46Å; D547-N549 PolarHBondContact O-N 2.94Å; D547-N549 VanDerWaalsContact O-N 3.11Å; D547-N549 WeakPolarHBondContact OD1-CB 3.44Å; D547-N549 PolarHBondContact OD1-N 3.35Å; D547-N549 PolarHBondContact OD1-ND2 2.83Å; D547-N549 VanDerWaalsContact OD1-ND2 3.17Å; D547-Y550 VanDerWaalsContact O-CB 3.27Å; D547-Y550 WeakPolarHBondContact O-CB 3.37Å; D547-Y550 PolarHBondContact O-N 2.98Å
548	F	79.2	Confident	90.3	Very high	195 Å²	195	70.7 Å²	70.7	86%	0.855	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-6.2	176.7	-57.5	-75.4	0	0	0	114.2
549	N	85.1	Confident	90.5	Very high	138 Å²	138	69 Å²	69	74%	0.738	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	-2.6	172.6	-47.5	-85	0	0	0	112.7	D547 I551	D547-N549 PolarHBondContact O-N 2.94Å; D547-N549 VanDerWaalsContact O-N 3.11Å; D547-N549 WeakPolarHBondContact OD1-CB 3.44Å; D547-N549 PolarHBondContact OD1-N 3.35Å; D547-N549 PolarHBondContact OD1-ND2 2.83Å; D547-N549 VanDerWaalsContact OD1-ND2 3.17Å; N549-I551 PolarHBondContact O-N 2.9Å
550	Y	87.9	Confident	90.8	Very high	54 Å²	54	64.4 Å²	64.4	21%	0.212	33%	0.326	C	S	.	.			trans	-66.1	116	175.6	176	-93.6	0	0	0	109.6	D522 N544 D547 R552 C576	D522-Y550 PolarHBondContact OD1-OH 2.85Å; N544-Y550 HydrophobicContact CB-CD1 4.17Å; N544-Y550 HydrophobicContact CB-CD2 4.45Å; N544-Y550 HydrophobicContact CB-CG 4.02Å; D547-Y550 VanDerWaalsContact O-CB 3.27Å; D547-Y550 WeakPolarHBondContact O-CB 3.37Å; D547-Y550 PolarHBondContact O-N 2.98Å; Y550-R552 HydrophobicContact CE1-CB 3.84Å; Y550-R552 HydrophobicContact CE1-CG 4.4Å; Y550-C576 HydrophobicContact CD1-CB 4.13Å; Y550-C576 WeakPolarHBondContact O-CB 3.38Å
551	I	90.2	Very high	91	Very high	101 Å²	101	62.5 Å²	62.5	52%	0.518	32%	0.315	S	S	.	.			trans	-121.7	115.2	175.8	-58.2	174.2	0	0	0	108.2	N549 N553 C576	N549-I551 PolarHBondContact O-N 2.9Å; I551-N553 WeakPolarHBondContact CG2-ND2 3.39Å; I551-N553 PolarHBondContact O-N 3.18Å; I551-N553 PolarHBondContact O-ND2 3.33Å; I551-N553 VanDerWaalsContact O-ND2 3.11Å; I551-C576 CarbonylContact C-O 3.48Å; I551-C576 WeakPolarHBondContact CA-O 3.41Å; I551-C576 WeakPolarHBondContact CG2-O 3.46Å
552	R	93.2	Very high	91.1	Very high	16 Å²	16	65 Å²	65	6%	0.06	34%	0.343	C	S	.	.			trans	-85.7	64.5	-175.4	-163.9	179.6	-173.9	137.2	4.1	111.3	L520 P521 F542 Y550 A554 L555 C576 L577 P578	L520-R552 PolarHBondContact O-NH2 2.84Å; P521-R552 VanDerWaalsContact C-NH2 3.28Å; P521-R552 PolarHBondContact O-NH2 3.47Å; F542-R552 PolarHBondContact O-NH1 2.77Å; Y550-R552 HydrophobicContact CE1-CB 3.84Å; Y550-R552 HydrophobicContact CE1-CG 4.4Å; R552-A554 PolarHBondContact O-N 2.78Å; R552-L555 HydrophobicContact CG-CB 4.08Å; R552-L555 PolarHBondContact O-N 2.87Å; R552-L555 VanDerWaalsContact O-N 3.16Å; R552-C576 PolarHBondContact N-O 2.96Å; R552-L577 HydrophobicContact CB-CD2 3.89Å; R552-P578 WeakPolarHBondContact O-CD 3.41Å
553	N	91.7	Very high	91.3	Very high	110 Å²	110	65.3 Å²	65.3	59%	0.588	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-24.2	-173.9	-69.5	-73.5	0	0	0	114.8	I551	I551-N553 WeakPolarHBondContact CG2-ND2 3.39Å; I551-N553 PolarHBondContact O-N 3.18Å; I551-N553 PolarHBondContact O-ND2 3.33Å; I551-N553 VanDerWaalsContact O-ND2 3.11Å
554	A	94.1	Very high	91.4	Very high	33 Å²	33	68.3 Å²	68.3	27%	0.273	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-33.9	-180	0	0	0	0	0	113.6	D522 R525 R552 E556	D522-A554 WeakPolarHBondContact O-CB 3.47Å; R525-A554 VanDerWaalsContact CA-O 3.25Å; R525-A554 WeakPolarHBondContact CA-O 3.48Å; R552-A554 PolarHBondContact O-N 2.78Å; A554-E556 PolarHBondContact O-N 3.13Å
555	L	95.4	Very high	91.8	Very high	1 Å²	1	65 Å²	65	1%	0.005	35%	0.347	C	S	.	.			trans	-88.1	94.6	-168.3	-172.5	55.4	0	0	0	110.7	L524 L527 F542 R552 I558 L577	L524-L555 HydrophobicContact CD2-CD1 4.29Å; L524-L555 HydrophobicContact CG-CD1 4.15Å; L524-L555 WeakPolarHBondContact O-CA 3.5Å; L524-L555 WeakPolarHBondContact O-CB 3.45Å; L524-L555 WeakPolarHBondContact O-CD1 3.31Å; L527-L555 HydrophobicContact CB-CD1 4.42Å; F542-L555 HydrophobicContact CD1-CD2 3.9Å; F542-L555 HydrophobicContact CE1-CD2 4.41Å; R552-L555 HydrophobicContact CG-CB 4.08Å; R552-L555 PolarHBondContact O-N 2.87Å; R552-L555 VanDerWaalsContact O-N 3.16Å; L555-I558 HydrophobicContact CD1-CD1 4.37Å; L555-I558 HydrophobicContact CD1-CG1 3.95Å; L555-I558 HydrophobicContact CD2-CD1 3.51Å; L555-I558 HydrophobicContact CD2-CG1 4.03Å; L555-I558 HydrophobicContact CG-CD1 3.72Å; L555-I558 HydrophobicContact CG-CG1 3.73Å; L555-L577 HydrophobicContact CB-CD2 4.46Å; L555-L577 HydrophobicContact CD2-CD2 4.37Å
556	E	93.2	Very high	92.3	Very high	90 Å²	90	62 Å²	62	42%	0.421	33%	0.331	S	S	.	.			trans	-103.1	-26.6	-166.9	-82.5	-162.1	-127.1	0	0	115.8	R525 A554 R579	R525-E556 PolarHBondContact O-N 3.33Å; A554-E556 PolarHBondContact O-N 3.13Å; E556-R579 PolarHBondContact O-NH1 3.02Å; E556-R579 IonicContact OE2-CZ 2.92Å; E556-R579 IonicContact OE2-NH1 3.06Å; E556-R579 PolarHBondContact OE2-NH1 3.11Å; E556-R579 IonicContact OE2-NH2 3.8Å; E556-R579 PolarHBondContact OE2-NH2 3.17Å
557	D	96.2	Very high	92.6	Very high	39 Å²	39	55 Å²	55	21%	0.209	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	90	-176.4	-176.8	26.2	0	0	0	110.5	R525 S526 L527 H528 R559	R525-D557 PolarHBondContact O-N 3.28Å; S526-D557 VanDerWaalsContact CA-O 3.31Å; S526-D557 WeakPolarHBondContact CA-O 3.34Å; S526-D557 PolarHBondContact OG-O 3.49Å; S526-D557 PolarHBondContact OG-OD2 3.13Å; L527-D557 PolarHBondContact N-O 3.44Å; H528-D557 IonicContact CD2-OD2 3.5Å; H528-D557 IonicContact CE1-OD2 2.83Å; H528-D557 IonicContact NE2-OD2 3.62Å; H528-D557 PolarHBondContact NE2-OD2 3.21Å; D557-R559 WeakPolarHBondContact OD1-CG 3.23Å; D557-R559 IonicContact OD1-CZ 3.46Å; D557-R559 IonicContact OD1-NE 3.94Å; D557-R559 PolarHBondContact OD1-NE 3.16Å; D557-R559 IonicContact OD1-NH2 2.92Å; D557-R559 PolarHBondContact OD1-NH2 3.35Å; D557-R559 IonicContact OD2-CZ 2.71Å; D557-R559 IonicContact OD2-NE 2.67Å; D557-R559 PolarHBondContact OD2-NE 3.04Å; D557-R559 IonicContact OD2-NH2 3.21Å; D557-R559 PolarHBondContact OD2-NH2 3.08Å
558	I	96.9	Very high	92.8	Very high	7 Å²	7	54.8 Å²	54.8	4%	0.036	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	129	172	-53.8	-175.7	0	0	0	109.1	L527 F542 L555 L560 L577 P581 I582	L527-I558 HydrophobicContact CD2-CG2 4.41Å; L527-I558 WeakPolarHBondContact O-CA 3.24Å; F542-I558 HydrophobicContact CD1-CD1 4.01Å; F542-I558 HydrophobicContact CD2-CD1 4.07Å; F542-I558 HydrophobicContact CE1-CD1 3.84Å; F542-I558 HydrophobicContact CE2-CD1 3.91Å; F542-I558 HydrophobicContact CE2-CG2 4.49Å; F542-I558 HydrophobicContact CG-CD1 4.12Å; F542-I558 HydrophobicContact CZ-CD1 3.78Å; F542-I558 HydrophobicContact CZ-CG2 4.02Å; L555-I558 HydrophobicContact CD1-CD1 4.37Å; L555-I558 HydrophobicContact CD1-CG1 3.95Å; L555-I558 HydrophobicContact CD2-CD1 3.51Å; L555-I558 HydrophobicContact CD2-CG1 4.03Å; L555-I558 HydrophobicContact CG-CD1 3.72Å; L555-I558 HydrophobicContact CG-CG1 3.73Å; I558-L560 HydrophobicContact CG2-CD1 4.21Å; I558-L560 HydrophobicContact CG2-CG 4.28Å; I558-L577 HydrophobicContact CD1-CD1 3.36Å; I558-L577 HydrophobicContact CG1-CD1 4.47Å; I558-P581 HydrophobicContact CB-CB 4.07Å; I558-P581 HydrophobicContact CB-CG 4.37Å; I558-P581 HydrophobicContact CD1-CG 4.38Å; I558-P581 HydrophobicContact CG2-CB 3.97Å; I558-P581 HydrophobicContact CG2-CG 4.37Å; I558-I582 PolarHBondContact O-N 2.9Å
559	R	97.1	Very high	93.5	Very high	84 Å²	84	52.8 Å²	52.8	32%	0.317	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	125	-180	-61.2	-172.1	-168.4	-167.8	12.1	111.7	L527 H528 L529 Q530 D557 I582	L527-R559 PolarHBondContact O-N 2.89Å; H528-R559 PolarHBondContact NE2-NE 2.96Å; L529-R559 CarbonylContact C-O 3.57Å; L529-R559 WeakPolarHBondContact CA-O 3.3Å; L529-R559 PolarHBondContact N-O 3.49Å; Q530-R559 HydrophobicContact CB-CB 4.43Å; Q530-R559 PolarHBondContact N-O 2.92Å; D557-R559 WeakPolarHBondContact OD1-CG 3.23Å; D557-R559 IonicContact OD1-CZ 3.46Å; D557-R559 IonicContact OD1-NE 3.94Å; D557-R559 PolarHBondContact OD1-NE 3.16Å; D557-R559 IonicContact OD1-NH2 2.92Å; D557-R559 PolarHBondContact OD1-NH2 3.35Å; D557-R559 IonicContact OD2-CZ 2.71Å; D557-R559 IonicContact OD2-NE 2.67Å; D557-R559 PolarHBondContact OD2-NE 3.04Å; D557-R559 IonicContact OD2-NH2 3.21Å; D557-R559 PolarHBondContact OD2-NH2 3.08Å; R559-I582 HydrophobicContact CG-CB 4.34Å; R559-I582 HydrophobicContact CG-CD1 4.29Å
560	L	96.5	Very high	93.8	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.261	C	S	.	.			trans	-133.8	9.8	-176.9	-68.3	165.2	0	0	0	110.6	I516 L529 I534 I558 N563 I565 L567 P581 I582	I516-L560 HydrophobicContact CD1-CD1 4.19Å; I516-L560 HydrophobicContact CD1-CD2 4.05Å; I516-L560 HydrophobicContact CG1-CD2 4.21Å; L529-L560 HydrophobicContact CB-CD2 3.92Å; L529-L560 HydrophobicContact CD1-CD2 4.12Å; I534-L560 HydrophobicContact CD1-CD2 3.89Å; I558-L560 HydrophobicContact CG2-CD1 4.21Å; I558-L560 HydrophobicContact CG2-CG 4.28Å; L560-N563 VanDerWaalsContact O-CB 3.31Å; L560-N563 WeakPolarHBondContact O-CB 3.21Å; L560-N563 PolarHBondContact O-N 2.94Å; L560-N563 PolarHBondContact O-ND2 2.03Å; L560-I565 HydrophobicContact CB-CG2 4.28Å; L560-L567 HydrophobicContact CD1-CD2 3.87Å; L560-P581 HydrophobicContact CD1-CB 4.2Å; L560-I582 CarbonylContact C-O 3.58Å; L560-I582 WeakPolarHBondContact CA-O 3.13Å; L560-I582 PolarHBondContact N-O 3.11Å
561	D	95.6	Very high	94	Very high	59 Å²	59	48 Å²	48	32%	0.316	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	149.7	176.6	58.5	-79.7	0	0	0	112.3	Q530 R531 N563 I582	Q530-D561 CarbonylContact C-O 3.32Å; Q530-D561 WeakPolarHBondContact CA-O 3.42Å; Q530-D561 VanDerWaalsContact CB-O 3.26Å; Q530-D561 WeakPolarHBondContact CB-O 3.49Å; Q530-D561 WeakPolarHBondContact CB-OD1 3.48Å; Q530-D561 WeakPolarHBondContact CB-OD2 3.47Å; R531-D561 PolarHBondContact N-O 2.85Å; D561-N563 PolarHBondContact O-N 3.24Å; D561-N563 PolarHBondContact O-ND2 3.29Å; D561-I582 PolarHBondContact N-O 3.24Å
562	G	95.1	Very high	94	Very high	63 Å²	63	47.5 Å²	47.5	65%	0.649	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	70	7.9	-174	0	0	0	0	0	115.7
563	N	96.6	Very high	94	Very high	11 Å²	11	46.8 Å²	46.8	6%	0.059	26%	0.263	C	S	.	.	S	Bend	trans	-94.7	156.2	168.7	-72.7	-97.4	0	0	0	111.7	L529 N532 I534 L560 D561 I565	L529-N563 PolarHBondContact O-ND2 3.39Å; N532-N563 WeakPolarHBondContact CA-OD1 3.48Å; N532-N563 WeakPolarHBondContact CB-OD1 3.48Å; N532-N563 PolarHBondContact N-OD1 3.16Å; N532-N563 PolarHBondContact O-OD1 3.01Å; N532-N563 VanDerWaalsContact O-OD1 3.05Å; I534-N563 HydrophobicContact CB-CB 4.28Å; I534-N563 VanDerWaalsContact CB-OD1 3.24Å; I534-N563 WeakPolarHBondContact CB-OD1 3.09Å; I534-N563 VanDerWaalsContact CG1-OD1 3.3Å; I534-N563 WeakPolarHBondContact CG1-OD1 3.37Å; I534-N563 PolarHBondContact N-OD1 3.46Å; L560-N563 VanDerWaalsContact O-CB 3.31Å; L560-N563 WeakPolarHBondContact O-CB 3.21Å; L560-N563 PolarHBondContact O-N 2.94Å; L560-N563 PolarHBondContact O-ND2 2.03Å; D561-N563 PolarHBondContact O-N 3.24Å; D561-N563 PolarHBondContact O-ND2 3.29Å; N563-I565 HydrophobicContact CB-CG2 3.9Å; N563-I565 PolarHBondContact O-N 3.16Å
564	P	94.9	Very high	94.1	Very high	74 Å²	74	43 Å²	43	48%	0.481	24%	0.241	S	C	.	.	S	Bend	trans	-73.1	4.4	172.3	28.9	-33.7	0	0	0	115.2	I534 Q535	I534-P564 CarbonylContact O-C 3.55Å; I534-P564 VanDerWaalsContact O-CD 3.25Å; I534-P564 WeakPolarHBondContact O-CD 3.38Å; I534-P564 WeakPolarHBondContact O-CG 3.44Å; Q535-P564 HydrophobicContact CG-CB 4.23Å; Q535-P564 HydrophobicContact CG-CG 3.66Å
565	I	94.3	Very high	94	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.01	26%	0.258	C	S	.	.			trans	-66.6	142.4	176	-166.6	167.2	0	0	0	112.1	I534 M537 L560 N563 L567	I534-I565 HydrophobicContact CG2-CD1 4.22Å; I534-I565 WeakPolarHBondContact O-CB 3.3Å; I534-I565 PolarHBondContact O-N 3.32Å; M537-I565 HydrophobicContact CB-CD1 3.97Å; M537-I565 HydrophobicContact CG-CD1 3.92Å; M537-I565 HydrophobicContact SD-CD1 3.89Å; L560-I565 HydrophobicContact CB-CG2 4.28Å; N563-I565 HydrophobicContact CB-CG2 3.9Å; N563-I565 PolarHBondContact O-N 3.16Å; I565-L567 HydrophobicContact CD1-CD2 4.25Å
566	N	92.4	Very high	93.9	Very high	14 Å²	14	47.7 Å²	47.7	8%	0.075	26%	0.261	C	S	.	.			trans	-111.3	116.3	161.7	172.6	13	0	0	0	109.1	S568 K569 L585 I586	N566-S568 VanDerWaalsContact C-N 3.34Å; N566-S568 VanDerWaalsContact CG-OG 3.31Å; N566-S568 PolarHBondContact ND2-OG 3.11Å; N566-S568 PolarHBondContact O-N 3.4Å; N566-S568 PolarHBondContact OD1-N 3.05Å; N566-S568 PolarHBondContact OD1-OG 3.02Å; N566-K569 HydrophobicContact CB-CD 4.19Å; N566-K569 HydrophobicContact CB-CG 4.35Å; N566-L585 WeakPolarHBondContact OD1-CA 3.43Å; N566-L585 PolarHBondContact OD1-O 3.43Å; N566-I586 PolarHBondContact ND2-O 3.36Å; N566-I586 PolarHBondContact ND2-OXT 2.73Å; N566-I586 VanDerWaalsContact ND2-OXT 3.15Å; N566-I586 PolarHBondContact OD1-N 2.72Å
567	L	92	Very high	93.9	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.005	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-67.7	-29	179.4	-59.3	175.6	0	0	0	113.1	M537 L560 I565 K569 T570 Y574 P581 N584 L585	M537-L567 HydrophobicContact CE-CB 4.37Å; M537-L567 HydrophobicContact CE-CD2 3.59Å; M537-L567 HydrophobicContact SD-CD2 4.05Å; L560-L567 HydrophobicContact CD1-CD2 3.87Å; I565-L567 HydrophobicContact CD1-CD2 4.25Å; L567-K569 PolarHBondContact O-N 2.86Å; L567-K569 VanDerWaalsContact O-N 3.13Å; L567-T570 PolarHBondContact O-N 3.03Å; L567-Y574 HydrophobicContact CB-CE1 4.17Å; L567-Y574 PolarHBondContact O-OH 2.61Å; L567-P581 HydrophobicContact CD1-CB 4.22Å; L567-P581 WeakPolarHBondContact CD1-O 3.02Å; L567-N584 WeakPolarHBondContact CB-O 3.45Å; L567-N584 WeakPolarHBondContact CG-O 3.27Å; L567-N584 PolarHBondContact N-O 3.47Å; L567-L585 HydrophobicContact CB-CD2 3.91Å
568	S	91.8	Very high	93.7	Very high	58 Å²	58	45.5 Å²	45.5	41%	0.406	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-69.2	-10.7	-176.6	69.1	0	0	0	0	114.1	N566 L585	N566-S568 VanDerWaalsContact C-N 3.34Å; N566-S568 VanDerWaalsContact CG-OG 3.31Å; N566-S568 PolarHBondContact ND2-OG 3.11Å; N566-S568 PolarHBondContact O-N 3.4Å; N566-S568 PolarHBondContact OD1-N 3.05Å; N566-S568 PolarHBondContact OD1-OG 3.02Å; S568-L585 WeakPolarHBondContact CB-O 3.4Å; S568-L585 PolarHBondContact OG-O 3.34Å
569	K	92.2	Very high	93.5	Very high	153 Å²	153	51.9 Å²	51.9	67%	0.665	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-76.5	-30.6	175.1	-67.7	176.1	-176.3	170.7	0	113.9	N566 L567	N566-K569 HydrophobicContact CB-CD 4.19Å; N566-K569 HydrophobicContact CB-CG 4.35Å; L567-K569 PolarHBondContact O-N 2.86Å; L567-K569 VanDerWaalsContact O-N 3.13Å
570	T	92.4	Very high	93.3	Very high	28 Å²	28	53.6 Å²	53.6	17%	0.172	29%	0.293	C	S	.	.			trans	-136.1	61.3	-173.7	47.1	0	0	0	0	112.3	M537 L567 Q572 A573	M537-T570 WeakPolarHBondContact CE-OG1 3.42Å; M537-T570 VanDerWaalsContact CG-OG1 3.32Å; M537-T570 WeakPolarHBondContact CG-OG1 3.29Å; M537-T570 PolarHBondContact O-OG1 3.39Å; L567-T570 PolarHBondContact O-N 3.03Å; T570-Q572 PolarHBondContact O-N 3.35Å; T570-Q572 VanDerWaalsContact O-N 3.16Å; T570-A573 VanDerWaalsContact O-CB 3.23Å; T570-A573 WeakPolarHBondContact O-CB 3.04Å; T570-A573 PolarHBondContact O-N 3.33Å
571	P	91.7	Very high	93.2	Very high	63 Å²	63	54 Å²	54	41%	0.409	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-61.2	-25.9	-177.4	25.9	-35.4	0	0	0	114.1	A573 Y574 I575	P571-A573 PolarHBondContact O-N 3.29Å; P571-Y574 PolarHBondContact O-N 3.3Å; P571-I575 PolarHBondContact O-N 3.28Å
572	Q	91.3	Very high	93.2	Very high	92 Å²	92	55.3 Å²	55.3	43%	0.43	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-62.8	-27.6	176.2	-53.2	-60.6	7.2	0	0	112.6	E539 T570 Y574	E539-Q572 HydrophobicContact CB-CB 4.16Å; E539-Q572 HydrophobicContact CG-CB 4.3Å; T570-Q572 PolarHBondContact O-N 3.35Å; T570-Q572 VanDerWaalsContact O-N 3.16Å; Q572-Y574 PolarHBondContact O-N 2.85Å; Q572-Y574 VanDerWaalsContact O-N 3.08Å
573	A	93.1	Very high	92.9	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-61.9	-19.5	-179.1	0	0	0	0	0	113.9	M537 H538 E539 F542 C543 T570 P571	M537-A573 HydrophobicContact CE-CB 4.02Å; M537-A573 HydrophobicContact CG-CB 4.02Å; M537-A573 HydrophobicContact SD-CB 4.02Å; H538-A573 WeakPolarHBondContact O-CB 3.25Å; E539-A573 WeakPolarHBondContact O-CA 3.35Å; F542-A573 WeakPolarHBondContact CB-O 3.4Å; F542-A573 WeakPolarHBondContact CD2-O 3.35Å; F542-A573 PolarHBondContact N-O 3.3Å; C543-A573 PolarHBondContact SG-O 3.18Å; C543-A573 VanDerWaalsContact SG-O 3.39Å; T570-A573 VanDerWaalsContact O-CB 3.23Å; T570-A573 WeakPolarHBondContact O-CB 3.04Å; T570-A573 PolarHBondContact O-N 3.33Å; P571-A573 PolarHBondContact O-N 3.29Å
574	Y	93.3	Very high	92.4	Very high	30 Å²	30	56.8 Å²	56.8	12%	0.118	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-134.4	10.2	-176.1	57.9	-97.9	0	0	0	114.6	M537 L567 P571 Q572 C576 L577 I580 P581	M537-Y574 HydrophobicContact CE-CD1 3.6Å; M537-Y574 HydrophobicContact CE-CE1 3.63Å; L567-Y574 HydrophobicContact CB-CE1 4.17Å; L567-Y574 PolarHBondContact O-OH 2.61Å; P571-Y574 PolarHBondContact O-N 3.3Å; Q572-Y574 PolarHBondContact O-N 2.85Å; Q572-Y574 VanDerWaalsContact O-N 3.08Å; Y574-C576 PolarHBondContact O-N 3.45Å; Y574-L577 WeakPolarHBondContact O-CB 3.31Å; Y574-L577 WeakPolarHBondContact O-CG 3.48Å; Y574-L577 PolarHBondContact O-N 2.92Å; Y574-I580 HydrophobicContact CD2-CG2 4.29Å; Y574-I580 HydrophobicContact CE2-CG2 3.91Å; Y574-P581 HydrophobicContact CD1-CG 4.34Å; Y574-P581 HydrophobicContact CG-CG 4.06Å
575	I	92.1	Very high	91.7	Very high	123 Å²	123	58.1 Å²	58.1	63%	0.631	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-23.7	-178.6	-162.3	168.7	0	0	0	113.4	P571 L577	P571-I575 PolarHBondContact O-N 3.28Å; I575-L577 VanDerWaalsContact C-N 3.28Å; I575-L577 PolarHBondContact O-N 3.03Å
576	C	92.6	Very high	90.4	Very high	11 Å²	11	66.2 Å²	66.2	7%	0.074	35%	0.345	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-1.5	175.4	65.6	0	0	0	0	114.6	C543 Y550 I551 R552 Y574	C543-C576 WeakPolarHBondContact CA-SG 3.39Å; C543-C576 HydrophobicContact CB-CB 3.77Å; C543-C576 WeakPolarHBondContact CB-SG 3.17Å; C543-C576 WeakPolarHBondContact SG-CB 3.44Å; C543-C576 PolarHBondContact SG-N 2.79Å; C543-C576 CovalentContact SG-SG 2.03Å; C543-C576 PolarHBondContact SG-SG 3.13Å; Y550-C576 HydrophobicContact CD1-CB 4.13Å; Y550-C576 WeakPolarHBondContact O-CB 3.38Å; I551-C576 CarbonylContact C-O 3.48Å; I551-C576 WeakPolarHBondContact CA-O 3.41Å; I551-C576 WeakPolarHBondContact CG2-O 3.46Å; R552-C576 PolarHBondContact N-O 2.96Å; Y574-C576 PolarHBondContact O-N 3.45Å
577	L	94.4	Very high	90.3	Very high	19 Å²	19	68.9 Å²	68.9	10%	0.099	36%	0.359	C	S	.	.	S	Bend	trans	-92.2	147.3	-173.3	-58.6	-172.1	0	0	0	112.3	F542 R552 L555 I558 Y574 I575 R579 P581	F542-L577 HydrophobicContact CB-CD1 4.45Å; F542-L577 HydrophobicContact CB-CD2 4.08Å; F542-L577 HydrophobicContact CD2-CD1 4.32Å; F542-L577 HydrophobicContact CG-CD1 4.48Å; R552-L577 HydrophobicContact CB-CD2 3.89Å; L555-L577 HydrophobicContact CB-CD2 4.46Å; L555-L577 HydrophobicContact CD2-CD2 4.37Å; I558-L577 HydrophobicContact CD1-CD1 3.36Å; I558-L577 HydrophobicContact CG1-CD1 4.47Å; Y574-L577 WeakPolarHBondContact O-CB 3.31Å; Y574-L577 WeakPolarHBondContact O-CG 3.48Å; Y574-L577 PolarHBondContact O-N 2.92Å; I575-L577 VanDerWaalsContact C-N 3.28Å; I575-L577 PolarHBondContact O-N 3.03Å; L577-R579 VanDerWaalsContact CB-O 3.31Å; L577-R579 WeakPolarHBondContact CB-O 3.31Å; L577-R579 PolarHBondContact O-N 3.2Å; L577-P581 HydrophobicContact CD1-CG 4.28Å
578	P	92.1	Very high	90.2	Very high	64 Å²	64	72.4 Å²	72.4	42%	0.416	38%	0.378	S	S	.	.	S	Bend	trans	-69	-15.8	173.4	30.2	-36.3	0	0	0	113.2	R552	R552-P578 WeakPolarHBondContact O-CD 3.41Å
579	R	92.3	Very high	90.2	Very high	141 Å²	141	73.2 Å²	73.2	53%	0.532	38%	0.376	S	S	.	.	S	Bend	trans	-144.1	147	176.9	-62.4	-168.8	-171.8	122.3	12.6	111.1	E556 L577	E556-R579 PolarHBondContact O-NH1 3.02Å; E556-R579 IonicContact OE2-CZ 2.92Å; E556-R579 IonicContact OE2-NH1 3.06Å; E556-R579 PolarHBondContact OE2-NH1 3.11Å; E556-R579 IonicContact OE2-NH2 3.8Å; E556-R579 PolarHBondContact OE2-NH2 3.17Å; L577-R579 VanDerWaalsContact CB-O 3.31Å; L577-R579 WeakPolarHBondContact CB-O 3.31Å; L577-R579 PolarHBondContact O-N 3.2Å
580	I	92.3	Very high	90	Very high	120 Å²	120	68.5 Å²	68.5	62%	0.615	36%	0.359	S	S	*	.			trans	-71.9	137.5	174.9	-58.2	175	0	0	0	109.1	Y574	Y574-I580 HydrophobicContact CD2-CG2 4.29Å; Y574-I580 HydrophobicContact CE2-CG2 3.91Å
581	P	94.8	Very high	89.9	Confident	7 Å²	7	71.1 Å²	71.1	5%	0.045	37%	0.371	C	S	.	.			trans	-56.7	140.8	175	-25.1	34.3	0	0	0	112.9	I558 L560 L567 Y574 L577 G583	I558-P581 HydrophobicContact CB-CB 4.07Å; I558-P581 HydrophobicContact CB-CG 4.37Å; I558-P581 HydrophobicContact CD1-CG 4.38Å; I558-P581 HydrophobicContact CG2-CB 3.97Å; I558-P581 HydrophobicContact CG2-CG 4.37Å; L560-P581 HydrophobicContact CD1-CB 4.2Å; L567-P581 HydrophobicContact CD1-CB 4.22Å; L567-P581 WeakPolarHBondContact CD1-O 3.02Å; Y574-P581 HydrophobicContact CD1-CG 4.34Å; Y574-P581 HydrophobicContact CG-CG 4.06Å; L577-P581 HydrophobicContact CD1-CG 4.28Å; P581-G583 PolarHBondContact O-N 3.49Å
582	I	94.8	Very high	89.8	Confident	88 Å²	88	71.6 Å²	71.6	45%	0.451	37%	0.368	S	S	.	.	B	Isolated β-bridge	trans	-77.1	113.4	173.1	-56.7	-179.5	0	0	0	108	I558 R559 L560 D561	I558-I582 PolarHBondContact O-N 2.9Å; R559-I582 HydrophobicContact CG-CB 4.34Å; R559-I582 HydrophobicContact CG-CD1 4.29Å; L560-I582 CarbonylContact C-O 3.58Å; L560-I582 WeakPolarHBondContact CA-O 3.13Å; L560-I582 PolarHBondContact N-O 3.11Å; D561-I582 PolarHBondContact N-O 3.24Å
583	G	89.8	Confident	89.7	Confident	27 Å²	27	70.1 Å²	70.1	28%	0.278	36%	0.364	S	S	.	.	S	Bend	trans	-176.8	-168	-177.9	0	0	0	0	0	112.4	P581	P581-G583 PolarHBondContact O-N 3.49Å
584	N	87.1	Confident	89.4	Confident	78 Å²	78	75.5 Å²	75.5	42%	0.417	39%	0.392	S	S	.	.			trans	-91.5	147	-174.7	-159.2	14	0	0	0	112.4	L567 I586	L567-N584 WeakPolarHBondContact CB-O 3.45Å; L567-N584 WeakPolarHBondContact CG-O 3.27Å; L567-N584 PolarHBondContact N-O 3.47Å; N584-I586 WeakPolarHBondContact OD1-CD1 3.41Å; N584-I586 WeakPolarHBondContact OD1-CG1 3.5Å
585	L	79.4	Confident	89.1	Confident	101 Å²	101	79.3 Å²	79.3	53%	0.529	42%	0.415	S	S	.	.			trans	-124.2	5.7	-168.3	-75.7	162.8	0	0	0	114.6	N566 L567 S568	N566-L585 WeakPolarHBondContact OD1-CA 3.43Å; N566-L585 PolarHBondContact OD1-O 3.43Å; L567-L585 HydrophobicContact CB-CD2 3.91Å; S568-L585 WeakPolarHBondContact CB-O 3.4Å; S568-L585 PolarHBondContact OG-O 3.34Å
586	I	67.6	Low	88.8	Confident	173 Å²	173	75.4 Å²	75.4	89%	0.887	40%	0.395	S	S	*	.			trans	-77.6	0	-170.8	-52.9	169.2	0	0	0	112.3	N566 N584	N566-I586 PolarHBondContact ND2-O 3.36Å; N566-I586 PolarHBondContact ND2-OXT 2.73Å; N566-I586 VanDerWaalsContact ND2-OXT 3.15Å; N566-I586 PolarHBondContact OD1-N 2.72Å; N584-I586 WeakPolarHBondContact OD1-CD1 3.41Å; N584-I586 WeakPolarHBondContact OD1-CG1 3.5Å

Retrieved 586 of 586 residues in 1114.5 ms (Link to these results)

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