A0A087XUG4_POEFO Loading...

Molybdenum cofactor biosynthesis protein 1

Isoform MOCS1A and isoform MOCS1B probably form a complex that catalyzes the conversion of 5'-GTP to cyclic pyranopterin monophosphate (cPMP). MOCS1A catalyzes the cyclization of GTP to (8S)-3',8-cyclo-7,8-dihydroguanosine 5'-triphosphate and MOCS1B catalyzes the subsequent conversion of (8S)-3',8-cyclo-7,8-dihydroguanosine 5'-triphosphate to cPMP.

AlphaFold DB , UniProt , Accession A0A087XUG4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 397 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.6	Very low	28.9	Very low	240 Å²	240	139.8 Å²	139.8	100%	1.182	84%	0.842	S	S	*	*				0	92.1	0	-61	177.7	-161.5	0	0	105.8
2	A	29.1	Very low	28.7	Very low	107 Å²	107	145.6 Å²	145.6	88%	0.884	84%	0.837	S	S	*	*				58	128.2	99.3	0	0	0	0	0	111.4
3	A	29.8	Very low	28.5	Very low	101 Å²	101	145.8 Å²	145.8	84%	0.835	83%	0.834	S	S	*	*			cis	-156.8	161.4	11.1	0	0	0	0	0	105.7
4	G	26.9	Very low	28.3	Very low	69 Å²	69	141.7 Å²	141.7	71%	0.711	83%	0.827	S	S	*	*			cis	92.8	98.1	39	0	0	0	0	0	110.4
5	T	30.8	Very low	28.2	Very low	145 Å²	145	147.8 Å²	147.8	89%	0.89	83%	0.83	S	S	*	*			trans	-150.2	115.9	151.4	-42	0	0	0	0	110.8
6	R	32.1	Very low	28.2	Very low	233 Å²	233	145.9 Å²	145.9	88%	0.879	82%	0.823	S	S	*	*			trans	-90.2	148	164.4	-68.5	174.3	176.5	178.5	-1.4	107.9
7	I	30.2	Very low	27.9	Very low	171 Å²	171	148.6 Å²	148.6	88%	0.877	82%	0.824	S	S	*	*			trans	-133.7	136.6	142.7	-64	-176.5	0	0	0	108.3
8	C	25.1	Very low	27.8	Very low	113 Å²	113	150.3 Å²	150.3	76%	0.764	82%	0.822	S	S	*	*			trans	-129.9	136.9	-169.5	-173.7	0	0	0	0	107.4
9	C	25.3	Very low	27.7	Very low	126 Å²	126	146.8 Å²	146.8	85%	0.851	82%	0.816	S	S	*	*			trans	171.1	150.2	154.1	-97.8	0	0	0	0	108.4
10	S	26.6	Very low	27.5	Very low	93 Å²	93	152 Å²	152	65%	0.65	82%	0.822	S	S	*	*			cis	-173.3	120.4	-17.5	58	0	0	0	0	104.2
11	L	27.3	Very low	27.2	Very low	140 Å²	140	150 Å²	150	73%	0.733	82%	0.819	S	S	*	*				69.7	121.5	104.6	-74.5	161.2	0	0	0	118.1
12	R	26.5	Very low	26.7	Very low	209 Å²	209	148 Å²	148	79%	0.789	81%	0.806	S	S	*	*			trans	75.8	142	137.4	-69.6	176.2	-177.5	-167	4	116.7
13	N	26	Very low	26.4	Very low	148 Å²	148	150 Å²	150	79%	0.791	80%	0.802	S	S	*	*			cis	-171.7	175.8	25.5	-122.7	-6.2	0	0	0	112.2
14	A	26.6	Very low	26.1	Very low	89 Å²	89	155.6 Å²	155.6	74%	0.736	80%	0.801	S	S	*	*			trans	93.3	107.7	163.1	0	0	0	0	0	116.2
15	R	25.9	Very low	25.9	Very low	233 Å²	233	157.5 Å²	157.5	88%	0.879	80%	0.804	S	S	*	*				47.8	124.2	50.3	-80.2	-171.9	179.1	-173.1	0.2	111
16	T	27.8	Very low	25.6	Very low	117 Å²	117	158.5 Å²	158.5	72%	0.718	80%	0.798	S	S	*	*			cis	177	160.3	44.5	2.1	0	0	0	0	107.6
17	F	24.6	Very low	25.1	Very low	193 Å²	193	155 Å²	155	85%	0.846	79%	0.792	S	S	*	*			trans	160.8	138	145	-106.8	-91.5	0	0	0	108.3
18	F	25.7	Very low	24.7	Very low	179 Å²	179	156.6 Å²	156.6	79%	0.785	79%	0.787	S	S	*	*			cis	-165.6	153	-29.5	-139.5	-85.5	0	0	0	105.6
19	A	25.6	Very low	24.6	Very low	84 Å²	84	159.4 Å²	159.4	69%	0.694	79%	0.793	S	S	*	*			trans	-78.9	160.4	-179.4	0	0	0	0	0	113.9
20	R	23.5	Very low	24.5	Very low	249 Å²	249	162.5 Å²	162.5	94%	0.94	79%	0.793	S	S	*	*			trans	-158.2	130.5	142.3	-121.9	175.7	-179.1	-179.6	-0.3	113.5
21	C	21.9	Very low	24.4	Very low	112 Å²	112	163.4 Å²	163.4	76%	0.757	80%	0.799	S	S	*	*			trans	-71.5	157.3	174.2	-55.5	0	0	0	0	113.3
22	H	24.2	Very low	24.2	Very low	196 Å²	196	161.9 Å²	161.9	91%	0.907	80%	0.8	S	S	*	*			trans	-153.5	130.8	131.4	-114.6	42.5	0	0	0	113.6
23	N	22.8	Very low	24.2	Very low	151 Å²	151	157.4 Å²	157.4	81%	0.807	80%	0.801	S	S	*	*			trans	-57.2	147.8	163	-88.1	-28.7	0	0	0	111.4
24	R	23.1	Very low	24.2	Very low	218 Å²	218	156.6 Å²	156.6	82%	0.823	80%	0.801	S	S	*	*			trans	-153.5	107.1	136.3	-108.4	-178.8	-167.6	-130.9	7	110.8	E26	R24-E26 IonicContact NH1-OE1 2.92Å; R24-E26 PolarHBondContact NH1-OE1 2.87Å
25	S	21.8	Very low	24.2	Very low	109 Å²	109	160.9 Å²	160.9	76%	0.762	81%	0.806	S	S	*	*			trans	-69.7	130.5	152.3	48.9	0	0	0	0	109.6
26	E	25.1	Very low	24.1	Very low	166 Å²	166	158.5 Å²	158.5	78%	0.776	81%	0.805	S	S	*	*			trans	-133.8	127.4	154.2	-94.7	175.6	-158.2	0	0	109.6	R24	R24-E26 IonicContact NH1-OE1 2.92Å; R24-E26 PolarHBondContact NH1-OE1 2.87Å
27	Q	21.9	Very low	24	Very low	158 Å²	158	160.9 Å²	160.9	74%	0.738	81%	0.808	S	S	*	*			trans	-105.5	147.2	-179.6	-116.5	-174.7	14.3	0	0	107.7
28	R	22.3	Very low	24	Very low	205 Å²	205	159.4 Å²	159.4	77%	0.774	81%	0.809	S	S	*	*			trans	75.2	126.2	155.5	-61.1	171.8	-165.8	-151.8	-0.2	117.6
29	L	22.6	Very low	24	Very low	173 Å²	173	159.7 Å²	159.7	91%	0.906	81%	0.812	S	S	*	*				-160.9	133.1	96.2	-95	155.1	0	0	0	110.8
30	F	22.6	Very low	24	Very low	191 Å²	191	163.3 Å²	163.3	84%	0.838	82%	0.819	S	S	*	*			trans	-64.9	145.1	167.3	-87.1	-109.1	0	0	0	110.3
31	S	24.5	Very low	24.1	Very low	112 Å²	112	161 Å²	161	78%	0.783	82%	0.819	S	S	*	*			trans	-150.4	98.7	137.7	66.6	0	0	0	0	110
32	S	23.9	Very low	24.2	Very low	108 Å²	108	162 Å²	162	76%	0.755	82%	0.816	S	S	*	*			trans	-65.8	128.6	154.5	47	0	0	0	0	109.3
33	S	25.4	Very low	24.2	Very low	114 Å²	114	162.7 Å²	162.7	80%	0.797	81%	0.811	S	S	*	*			trans	-134.3	125.3	160.9	43.4	0	0	0	0	109
34	T	27.1	Very low	24.4	Very low	132 Å²	132	161.8 Å²	161.8	81%	0.81	81%	0.806	S	S	*	*			trans	-77.1	156.8	-165.8	31.6	0	0	0	0	114.1
35	H	25.6	Very low	24.5	Very low	179 Å²	179	157.2 Å²	157.2	83%	0.829	81%	0.808	S	S	*	*			trans	-30.4	136.7	153.5	-67.7	-85.4	0	0	0	115.1
36	Q	24.4	Very low	24.7	Very low	183 Å²	183	157.2 Å²	157.2	86%	0.855	81%	0.807	S	S	*	*				-171.8	156.4	126.3	-112.3	172.6	-17.9	0	0	112
37	E	25.1	Very low	24.8	Very low	167 Å²	167	156 Å²	156	78%	0.78	81%	0.811	S	S	*	*			trans	88.8	84.7	164.8	-64.8	170.5	-167.3	0	0	118.1
38	N	25.7	Very low	25.1	Very low	162 Å²	162	152.8 Å²	152.8	87%	0.866	81%	0.812	S	S	*	*				177.7	100.1	93.3	-92.4	-18.9	0	0	0	111.8
39	E	24.9	Very low	25.3	Very low	185 Å²	185	148 Å²	148	86%	0.864	82%	0.816	S	S	*	*			trans	-120.3	119.7	153.9	-102.9	-172.9	163.9	0	0	106.2
40	L	25.2	Very low	25.4	Very low	160 Å²	160	144.1 Å²	144.1	84%	0.838	81%	0.809	S	S	*	*			trans	168.7	106.5	143.6	-96.8	144.7	0	0	0	108.7
41	E	25.5	Very low	25.7	Very low	200 Å²	200	142.7 Å²	142.7	94%	0.935	81%	0.81	S	S	*	*				-161.3	131.3	106.5	-102.2	178.6	-176.4	0	0	110.1
42	L	24.5	Very low	25.7	Very low	133 Å²	133	147.3 Å²	147.3	70%	0.696	82%	0.816	S	S	*	*			trans	-124.3	142.4	-169.8	-115.6	144.4	0	0	0	106.5
43	R	24.9	Very low	26	Very low	210 Å²	210	151.4 Å²	151.4	79%	0.792	82%	0.824	S	S	*	*			trans	78.7	148	156.2	-59.9	171.7	-175.5	-172	1.5	115.4
44	D	25.6	Very low	26.3	Very low	133 Å²	133	152.3 Å²	152.3	71%	0.711	82%	0.824	S	S	*	*			cis	-163.2	155.8	10.1	-127.1	-31	0	0	0	106.6
45	S	25.4	Very low	26.6	Very low	122 Å²	122	156.6 Å²	156.6	85%	0.853	83%	0.826	S	S	*	*			trans	171.4	96	140.6	-76.7	0	0	0	0	111.2
46	S	26.5	Very low	27	Very low	108 Å²	108	153.9 Å²	153.9	76%	0.755	82%	0.824	S	S	*	*			trans	-72.7	130.6	164.6	51.7	0	0	0	0	112.4
47	V	27.9	Very low	27.3	Very low	141 Å²	141	149.6 Å²	149.6	86%	0.855	81%	0.814	S	S	*	*			trans	-146.4	111.4	150.7	-170	0	0	0	0	111.8
48	A	26.9	Very low	28.1	Very low	91 Å²	91	149.2 Å²	149.2	75%	0.752	82%	0.817	S	S	*	*			trans	35.7	112.3	144.5	0	0	0	0	0	123.1
49	A	27.4	Very low	28.4	Very low	104 Å²	104	150 Å²	150	86%	0.86	82%	0.815	S	S	*	*				17.8	124.8	126.6	0	0	0	0	0	121.4
50	A	25.3	Very low	28.9	Very low	92 Å²	92	152 Å²	152	76%	0.76	81%	0.814	S	S	*	*			trans	-157.1	132.8	135.5	0	0	0	0	0	112.8
51	N	27.5	Very low	29.5	Very low	161 Å²	161	152.9 Å²	152.9	86%	0.861	82%	0.819	S	S	*	*			trans	80.2	89.3	153.6	-62.6	-11.9	0	0	0	121
52	F	24.9	Very low	30.1	Very low	208 Å²	208	148.1 Å²	148.1	91%	0.912	80%	0.804	S	S	*	*			trans	-71.5	121.3	149.7	-113.7	-104.3	0	0	0	110.3
53	Q	29.5	Very low	30.9	Very low	195 Å²	195	148.8 Å²	148.8	91%	0.911	81%	0.808	S	S	*	*			trans	-133	136.2	150.8	-84.3	-172.4	-13.5	0	0	109.1
54	T	33	Very low	31.4	Very low	132 Å²	132	146.9 Å²	146.9	81%	0.81	81%	0.808	S	S	*	*			trans	-75.7	153	-167.7	36.6	0	0	0	0	114.7
55	R	33.7	Very low	32.3	Very low	223 Å²	223	150.3 Å²	150.3	84%	0.842	82%	0.817	S	S	*	*			trans	-40.9	159.7	-179.3	-64.9	176.5	173.6	174.8	-2.6	117
56	P	33.1	Very low	33.2	Very low	121 Å²	121	149.9 Å²	149.9	79%	0.786	81%	0.809	S	S	*	*				-129.1	167.4	93.4	37.3	-27.8	0	0	0	109.6
57	S	30.7	Very low	34.5	Very low	93 Å²	93	151.2 Å²	151.2	65%	0.65	81%	0.807	S	S	*	*			cis	-163.3	155.3	-4.7	30.8	0	0	0	0	104.3	E59	S57-E59 PolarHBondContact O-N 3.5Å
58	L	42.7	Very low	36.5	Very low	160 Å²	160	150 Å²	150	84%	0.838	80%	0.802	S	S	*	*			trans	-57.7	100	171.2	-86.7	85.6	0	0	0	109.7	R60	L58-R60 PolarHBondContact O-N 2.96Å
59	E	31.8	Very low	39.3	Very low	177 Å²	177	147.9 Å²	147.9	83%	0.827	78%	0.776	S	S	*	*			trans	-78	112.5	156	-79.3	-176.3	162.4	0	0	107.4	S57 L61	S57-E59 PolarHBondContact O-N 3.5Å; E59-L61 PolarHBondContact O-N 2.83Å; E59-L61 VanDerWaalsContact O-N 3.12Å
60	R	34.3	Very low	42.3	Very low	227 Å²	227	143.7 Å²	143.7	86%	0.857	74%	0.74	S	S	*	*			trans	-47.9	117.3	167.9	-72.2	172.4	179.6	172.3	-0.6	107.6	L58 T62	L58-R60 PolarHBondContact O-N 2.96Å; R60-T62 PolarHBondContact O-N 3.25Å
61	L	39.1	Very low	45.4	Very low	180 Å²	180	143.3 Å²	143.3	94%	0.942	74%	0.737	S	S	*	*			trans	-55.7	98.6	157.4	-71.9	162.6	0	0	0	106.2	E59	E59-L61 PolarHBondContact O-N 2.83Å; E59-L61 VanDerWaalsContact O-N 3.12Å
62	T	38	Very low	48.7	Very low	99 Å²	99	137.8 Å²	137.8	61%	0.607	71%	0.705	S	S	*	*			trans	-62.2	149.3	175.6	37.7	0	0	0	0	109	R60 E64	R60-T62 PolarHBondContact O-N 3.25Å; T62-E64 PolarHBondContact O-N 3.48Å
63	D	39.9	Very low	52.1	Low	148 Å²	148	127.9 Å²	127.9	79%	0.791	66%	0.662	S	S	*	*			trans	-59.8	40.1	-177.5	-115.9	-30.3	0	0	0	114.6	K65	D63-K65 PolarHBondContact O-N 3.47Å
64	E	36.8	Very low	55.2	Low	170 Å²	170	120.6 Å²	120.6	79%	0.794	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	19	-168.8	-70.2	-161.3	161.6	0	0	115.6	T62	T62-E64 PolarHBondContact O-N 3.48Å
65	K	43.3	Very low	58.2	Low	205 Å²	205	114.7 Å²	114.7	89%	0.891	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.7	21.7	173.5	-75.7	-172.8	-179.9	177.7	0	114.7	D63	D63-K65 PolarHBondContact O-N 3.47Å
66	V	44.6	Very low	61.1	Low	113 Å²	113	108 Å²	108	69%	0.685	58%	0.582	S	S	*	*			trans	-96.5	93.8	163.1	-171.7	0	0	0	0	107.6
67	L	53.9	Low	64	Low	136 Å²	136	107.2 Å²	107.2	71%	0.712	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-53.2	136.2	167.7	-70.1	170.5	0	0	0	108.5	F69	L67-F69 PolarHBondContact O-N 3.19Å
68	P	69.9	Low	67	Low	116 Å²	116	105.4 Å²	105.4	75%	0.753	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-58.7	141.4	177.1	25.2	-33.2	0	0	0	109.8	S70	P68-S70 PolarHBondContact O-N 3.15Å
69	F	84.9	Confident	69.4	Low	46 Å²	46	98.8 Å²	98.8	20%	0.202	53%	0.526	C	S	.	.	P	Polyproline II helix	trans	-56.5	129.4	179.5	-172.2	-83.3	0	0	0	110.5	L67 L73 T74 R80 H81 N82 G130	L67-F69 PolarHBondContact O-N 3.19Å; F69-L73 HydrophobicContact CE1-CB 3.63Å; F69-L73 WeakPolarHBondContact CE1-O 3.37Å; F69-L73 HydrophobicContact CZ-CB 3.59Å; F69-L73 HydrophobicContact CZ-CD1 4.41Å; F69-T74 WeakPolarHBondContact CE1-OG1 3.39Å; F69-R80 HydrophobicContact CD1-CB 3.8Å; F69-R80 HydrophobicContact CD1-CG 3.62Å; F69-R80 HydrophobicContact CD2-CB 4.4Å; F69-R80 HydrophobicContact CE1-CB 3.52Å; F69-R80 HydrophobicContact CE1-CG 3.79Å; F69-R80 HydrophobicContact CE2-CB 4.16Å; F69-R80 HydrophobicContact CG-CB 4.25Å; F69-R80 HydrophobicContact CG-CG 4.15Å; F69-R80 HydrophobicContact CZ-CB 3.73Å; F69-R80 HydrophobicContact CZ-CG 4.47Å; F69-H81 VanDerWaalsContact CZ-N 3.35Å; F69-N82 HydrophobicContact CE2-CB 3.8Å; F69-G130 WeakPolarHBondContact CE2-O 3.34Å
70	S	90.4	Very high	72.5	Confident	15 Å²	15	98.1 Å²	98.1	11%	0.105	52%	0.516	C	S	.	.	P	Polyproline II helix	trans	-65.7	144.3	-168.8	-178.2	0	0	0	0	113.9	P68 F72 L73 T74 E129	P68-S70 PolarHBondContact O-N 3.15Å; S70-F72 PolarHBondContact O-N 2.91Å; S70-F72 WeakPolarHBondContact OG-CD2 3.34Å; S70-F72 PolarHBondContact OG-N 2.82Å; S70-F72 VanDerWaalsContact OG-N 3.1Å; S70-L73 PolarHBondContact O-N 3.15Å; S70-T74 PolarHBondContact O-OG1 2.72Å; S70-E129 WeakPolarHBondContact CB-O 3.31Å; S70-E129 WeakPolarHBondContact CB-OE2 3.27Å; S70-E129 PolarHBondContact N-O 3.47Å; S70-E129 VanDerWaalsContact N-O 3.1Å; S70-E129 PolarHBondContact OG-OE2 2.96Å
71	A	92.2	Very high	75.5	Confident	84 Å²	84	87.3 Å²	87.3	69%	0.694	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-63.5	-31.3	169.6	0	0	0	0	0	111.8	L73 T74	A71-L73 PolarHBondContact O-N 2.96Å; A71-T74 PolarHBondContact O-N 2.86Å; A71-T74 VanDerWaalsContact O-N 3.1Å
72	F	95.1	Very high	78.2	Confident	45 Å²	45	80.6 Å²	80.6	20%	0.197	44%	0.44	C	S	.	.	G	3₁₀ helix	trans	-64	-27.4	178.7	-63.7	-63.5	0	0	0	113	S70 L364 Q365 G368	S70-F72 PolarHBondContact O-N 2.91Å; S70-F72 WeakPolarHBondContact OG-CD2 3.34Å; S70-F72 PolarHBondContact OG-N 2.82Å; S70-F72 VanDerWaalsContact OG-N 3.1Å; F72-L364 HydrophobicContact CD1-CB 4.31Å; F72-L364 WeakPolarHBondContact CD1-O 3.47Å; F72-L364 HydrophobicContact CD2-CB 3.92Å; F72-L364 HydrophobicContact CD2-CD1 4.2Å; F72-L364 HydrophobicContact CD2-CD2 4.4Å; F72-L364 HydrophobicContact CD2-CG 4.4Å; F72-L364 HydrophobicContact CE1-CB 4.36Å; F72-L364 HydrophobicContact CE2-CB 3.96Å; F72-L364 HydrophobicContact CE2-CD1 4.15Å; F72-L364 HydrophobicContact CG-CB 4.1Å; F72-L364 HydrophobicContact CZ-CB 4.18Å; F72-Q365 HydrophobicContact CE1-CG 4.44Å; F72-G368 WeakPolarHBondContact O-CA 3.33Å
73	L	96.5	Very high	81	Confident	1 Å²	1	76.7 Å²	76.7	1%	0.005	42%	0.415	C	S	.	.	G	3₁₀ helix	trans	-101.6	13.8	177.7	-59.5	-169.9	0	0	0	113.1	F69 S70 A71 H81 F126 E129 V131 L330 I367	F69-L73 HydrophobicContact CE1-CB 3.63Å; F69-L73 WeakPolarHBondContact CE1-O 3.37Å; F69-L73 HydrophobicContact CZ-CB 3.59Å; F69-L73 HydrophobicContact CZ-CD1 4.41Å; S70-L73 PolarHBondContact O-N 3.15Å; A71-L73 PolarHBondContact O-N 2.96Å; L73-H81 PolarHBondContact O-CD2 3.18Å; L73-H81 PolarHBondContact O-N 2.93Å; L73-F126 HydrophobicContact CD1-CD1 4.15Å; L73-F126 HydrophobicContact CD2-CD1 3.83Å; L73-F126 HydrophobicContact CD2-CE1 3.72Å; L73-E129 HydrophobicContact CD1-CB 3.53Å; L73-E129 HydrophobicContact CG-CB 3.81Å; L73-V131 HydrophobicContact CD1-CG2 3.77Å; L73-L330 HydrophobicContact CD2-CD1 3.99Å; L73-I367 HydrophobicContact CD2-CG2 3.8Å
74	T	95.9	Very high	83.8	Confident	41 Å²	41	69.7 Å²	69.7	25%	0.252	38%	0.377	S	S	.	.	B	Isolated β-bridge	trans	-111.4	126.3	175.9	-57.6	0	0	0	0	109.4	F69 S70 A71 R79	F69-T74 WeakPolarHBondContact CE1-OG1 3.39Å; S70-T74 PolarHBondContact O-OG1 2.72Å; A71-T74 PolarHBondContact O-N 2.86Å; A71-T74 VanDerWaalsContact O-N 3.1Å; T74-R79 WeakPolarHBondContact CA-O 3.41Å
75	D	95.4	Very high	86.7	Confident	9 Å²	9	63.2 Å²	63.2	5%	0.048	35%	0.345	C	S	.	.			trans	-87.5	175.7	179.1	67.8	32	0	0	0	113.9	F77 G78 R79 H81 V371 K374	D75-F77 PolarHBondContact O-N 3.31Å; D75-F77 WeakPolarHBondContact OD1-CA 3.37Å; D75-F77 WeakPolarHBondContact OD1-CB 3.37Å; D75-F77 PolarHBondContact OD1-N 3.11Å; D75-G78 PolarHBondContact O-N 3.17Å; D75-G78 PolarHBondContact OD1-N 3.32Å; D75-R79 PolarHBondContact N-O 3.32Å; D75-R79 VanDerWaalsContact N-O 3.15Å; D75-R79 PolarHBondContact OD1-N 3.17Å; D75-R79 VanDerWaalsContact OD1-N 3.13Å; D75-R79 IonicContact OD1-NE 3.89Å; D75-R79 PolarHBondContact OD1-NE 3.38Å; D75-R79 IonicContact OD1-NH2 2.75Å; D75-R79 IonicContact OD2-CZ 2.81Å; D75-R79 IonicContact OD2-NE 2.71Å; D75-R79 PolarHBondContact OD2-NE 2.99Å; D75-R79 IonicContact OD2-NH2 3.23Å; D75-R79 PolarHBondContact OD2-NH2 3.43Å; D75-H81 IonicContact OD2-CE1 2.62Å; D75-H81 PolarHBondContact OD2-CE1 2.98Å; D75-H81 IonicContact OD2-NE2 3.58Å; D75-H81 PolarHBondContact OD2-NE2 3.46Å; D75-V371 HydrophobicContact CB-CG1 3.97Å; D75-V371 WeakPolarHBondContact CB-O 3.48Å; D75-K374 HydrophobicContact CB-CB 4.36Å
76	S	94.3	Very high	89.4	Confident	83 Å²	83	53.5 Å²	53.5	58%	0.58	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-5.7	-179	65.6	0	0	0	0	114.8
77	F	94.4	Very high	91.9	Very high	103 Å²	103	48.2 Å²	48.2	45%	0.452	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108	8.1	176.4	-55.8	-79.1	0	0	0	112	D75 R79 K374 K376	D75-F77 PolarHBondContact O-N 3.31Å; D75-F77 WeakPolarHBondContact OD1-CA 3.37Å; D75-F77 WeakPolarHBondContact OD1-CB 3.37Å; D75-F77 PolarHBondContact OD1-N 3.11Å; F77-R79 VanDerWaalsContact C-N 3.29Å; F77-R79 HydrophobicContact CB-CG 4.47Å; F77-R79 PolarHBondContact O-N 2.69Å; F77-K374 VanDerWaalsContact CE2-O 3.28Å; F77-K374 WeakPolarHBondContact CE2-O 3.44Å; F77-K376 HydrophobicContact CD1-CB 4.17Å; F77-K376 HydrophobicContact CD1-CD 4.39Å; F77-K376 HydrophobicContact CD1-CG 4.12Å; F77-K376 HydrophobicContact CD2-CB 4.42Å; F77-K376 HydrophobicContact CE1-CB 3.7Å; F77-K376 HydrophobicContact CE1-CD 4.17Å; F77-K376 HydrophobicContact CE1-CG 4.04Å; F77-K376 HydrophobicContact CE2-CB 3.98Å; F77-K376 VanDerWaalsContact CE2-N 3.26Å; F77-K376 HydrophobicContact CZ-CB 3.59Å; F77-K376 HydrophobicContact CZ-CG 4.42Å
78	G	92.7	Very high	94	Very high	55 Å²	55	42 Å²	42	57%	0.567	24%	0.239	S	C	*	.			trans	76.3	11.8	179.9	0	0	0	0	0	114.2	D75 R80	D75-G78 PolarHBondContact O-N 3.17Å; D75-G78 PolarHBondContact OD1-N 3.32Å; G78-R80 PolarHBondContact O-N 2.96Å
79	R	94.9	Very high	95.3	Very high	22 Å²	22	37.2 Å²	37.2	8%	0.083	21%	0.207	C	C	.	.			trans	-78.8	123.6	177.7	-58.5	173.5	-64.7	-166.9	-4.1	109.2	T74 D75 F77 H81 C324 G325 K374 K375 K376	T74-R79 WeakPolarHBondContact CA-O 3.41Å; D75-R79 PolarHBondContact N-O 3.32Å; D75-R79 VanDerWaalsContact N-O 3.15Å; D75-R79 PolarHBondContact OD1-N 3.17Å; D75-R79 VanDerWaalsContact OD1-N 3.13Å; D75-R79 IonicContact OD1-NE 3.89Å; D75-R79 PolarHBondContact OD1-NE 3.38Å; D75-R79 IonicContact OD1-NH2 2.75Å; D75-R79 IonicContact OD2-CZ 2.81Å; D75-R79 IonicContact OD2-NE 2.71Å; D75-R79 PolarHBondContact OD2-NE 2.99Å; D75-R79 IonicContact OD2-NH2 3.23Å; D75-R79 PolarHBondContact OD2-NH2 3.43Å; F77-R79 VanDerWaalsContact C-N 3.29Å; F77-R79 HydrophobicContact CB-CG 4.47Å; F77-R79 PolarHBondContact O-N 2.69Å; R79-H81 PolarHBondContact O-CD2 3.23Å; R79-H81 PolarHBondContact O-NE2 3.1Å; R79-C324 PolarHBondContact NH1-O 3.26Å; R79-G325 VanDerWaalsContact CD-O 3.29Å; R79-G325 WeakPolarHBondContact CD-O 3.27Å; R79-K374 PolarHBondContact NH2-O 3.39Å; R79-K375 PolarHBondContact NH1-O 3.05Å; R79-K375 PolarHBondContact NH2-O 2.79Å; R79-K376 PolarHBondContact NH1-O 2.84Å
80	R	95.4	Very high	95.8	Very high	162 Å²	162	35.2 Å²	35.2	61%	0.611	20%	0.198	S	C	*	.	B	Isolated β-bridge	trans	-86	118.9	175.2	-66.3	-177.4	179.9	177.4	0.1	110.1	F69 G78 N82 N328	F69-R80 HydrophobicContact CD1-CB 3.8Å; F69-R80 HydrophobicContact CD1-CG 3.62Å; F69-R80 HydrophobicContact CD2-CB 4.4Å; F69-R80 HydrophobicContact CE1-CB 3.52Å; F69-R80 HydrophobicContact CE1-CG 3.79Å; F69-R80 HydrophobicContact CE2-CB 4.16Å; F69-R80 HydrophobicContact CG-CB 4.25Å; F69-R80 HydrophobicContact CG-CG 4.15Å; F69-R80 HydrophobicContact CZ-CB 3.73Å; F69-R80 HydrophobicContact CZ-CG 4.47Å; G78-R80 PolarHBondContact O-N 2.96Å; R80-N82 PolarHBondContact O-N 3.46Å; R80-N328 WeakPolarHBondContact O-CB 3.18Å
81	H	96.9	Very high	96	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.221	C	C	.	.			trans	-92.9	76.1	-176.7	-60.7	-73.1	0	0	0	112.6	F69 L73 D75 R79 Y83 C327 N328 L330 K374	F69-H81 VanDerWaalsContact CZ-N 3.35Å; L73-H81 PolarHBondContact O-CD2 3.18Å; L73-H81 PolarHBondContact O-N 2.93Å; D75-H81 IonicContact OD2-CE1 2.62Å; D75-H81 PolarHBondContact OD2-CE1 2.98Å; D75-H81 IonicContact OD2-NE2 3.58Å; D75-H81 PolarHBondContact OD2-NE2 3.46Å; R79-H81 PolarHBondContact O-CD2 3.23Å; R79-H81 PolarHBondContact O-NE2 3.1Å; H81-Y83 VanDerWaalsContact C-N 3.34Å; H81-C327 PolarHBondContact CE1-O 3.41Å; H81-C327 PolarHBondContact ND1-O 2.85Å; H81-N328 CarbonylContact C-O 3.51Å; H81-N328 VanDerWaalsContact CA-O 3.25Å; H81-N328 WeakPolarHBondContact CA-O 3.35Å; H81-N328 VanDerWaalsContact ND1-C 3.32Å; H81-N328 WeakPolarHBondContact ND1-CA 3.37Å; H81-L330 HydrophobicContact CB-CD1 3.79Å; H81-L330 HydrophobicContact CB-CD2 4.39Å; H81-L330 HydrophobicContact CB-CG 3.79Å; H81-K374 VanDerWaalsContact CE1-CD 3.45Å; H81-K374 WeakPolarHBondContact CE1-CD 3.37Å; H81-K374 PolarHBondContact CE1-NZ 3.28Å; H81-K374 PolarHBondContact ND1-NZ 3.3Å
82	N	96.8	Very high	96.2	Very high	40 Å²	40	37.9 Å²	37.9	21%	0.214	20%	0.195	C	C	.	.			trans	-85.6	1.7	179.5	70	-24.3	0	0	0	114.8	F69 R80 G130 V131 D132 K133 N328	F69-N82 HydrophobicContact CE2-CB 3.8Å; R80-N82 PolarHBondContact O-N 3.46Å; N82-G130 WeakPolarHBondContact CB-O 3.38Å; N82-V131 WeakPolarHBondContact O-CA 3.38Å; N82-V131 WeakPolarHBondContact O-CG1 3.48Å; N82-D132 PolarHBondContact ND2-OD1 3.42Å; N82-D132 PolarHBondContact ND2-OD2 3.44Å; N82-D132 PolarHBondContact O-N 3.35Å; N82-D132 VanDerWaalsContact O-N 3.12Å; N82-K133 PolarHBondContact O-N 3.47Å; N82-N328 PolarHBondContact OD1-ND2 3.35Å
83	Y	97.5	Very high	96.2	Very high	17 Å²	17	37.9 Å²	37.9	7%	0.067	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	105.1	-175.1	-177.7	-172	0	0	0	111.9	H81 R85 K133 R135 N328 R329 L330	H81-Y83 VanDerWaalsContact C-N 3.34Å; Y83-R85 HydrophobicContact CE2-CG 4.06Å; Y83-K133 WeakPolarHBondContact CA-O 3.36Å; Y83-K133 HydrophobicContact CD1-CD 4.33Å; Y83-K133 HydrophobicContact CD2-CB 4.19Å; Y83-K133 HydrophobicContact CD2-CD 3.99Å; Y83-K133 HydrophobicContact CD2-CG 3.77Å; Y83-K133 HydrophobicContact CE1-CD 4.49Å; Y83-K133 HydrophobicContact CE2-CD 4.17Å; Y83-K133 HydrophobicContact CE2-CG 4.04Å; Y83-K133 HydrophobicContact CG-CD 4.11Å; Y83-K133 HydrophobicContact CG-CG 4.3Å; Y83-R135 HydrophobicContact CE2-CB 3.67Å; Y83-R135 WeakPolarHBondContact OH-CD 3.38Å; Y83-R135 PolarHBondContact OH-NE 3.16Å; Y83-N328 PolarHBondContact N-O 2.99Å; Y83-N328 VanDerWaalsContact N-O 3.16Å; Y83-R329 HydrophobicContact CD1-CG 3.39Å; Y83-R329 HydrophobicContact CE1-CG 3.87Å; Y83-R329 HydrophobicContact CG-CG 3.87Å; Y83-R329 VanDerWaalsContact O-CA 3.3Å; Y83-R329 WeakPolarHBondContact O-CA 3.45Å; Y83-L330 PolarHBondContact O-N 3.44Å
84	L	98.4	Very high	96.1	Very high	1 Å²	1	38.1 Å²	38.1	1%	0.005	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	135	177	-175.4	64.3	0	0	0	111.6	I86 F126 V131 K133 I134 R135 L330 I332	L84-I86 HydrophobicContact CD2-CD1 3.86Å; L84-I86 HydrophobicContact CD2-CG1 3.9Å; L84-I86 HydrophobicContact CG-CD1 4.41Å; L84-I86 HydrophobicContact CG-CG1 3.92Å; L84-F126 HydrophobicContact CD1-CD1 4.32Å; L84-F126 HydrophobicContact CD1-CD2 4.49Å; L84-F126 HydrophobicContact CD1-CE1 4.38Å; L84-F126 HydrophobicContact CD1-CG 4.39Å; L84-F126 HydrophobicContact CD2-CB 3.79Å; L84-F126 HydrophobicContact CD2-CD1 4.41Å; L84-F126 HydrophobicContact CD2-CD2 3.87Å; L84-F126 HydrophobicContact CD2-CG 3.76Å; L84-V131 HydrophobicContact CB-CG1 3.76Å; L84-V131 HydrophobicContact CB-CG2 4.29Å; L84-K133 PolarHBondContact N-O 3.38Å; L84-I134 HydrophobicContact CB-CG1 4.26Å; L84-I134 HydrophobicContact CD2-CG1 4.45Å; L84-I134 CarbonylContact O-C 3.55Å; L84-I134 WeakPolarHBondContact O-CA 3.44Å; L84-R135 PolarHBondContact O-N 3.09Å; L84-L330 HydrophobicContact CD1-CB 4.06Å; L84-I332 HydrophobicContact CD1-CD1 4.03Å; L84-I332 HydrophobicContact CD1-CG1 4.08Å; L84-I332 HydrophobicContact CD2-CD1 4.14Å
85	R	98.4	Very high	96	Very high	34 Å²	34	40.3 Å²	40.3	13%	0.128	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	134	164.6	-54.7	-171.9	176.1	-174.7	-1.6	110	Y83 R135 L330 R331 I332 G397	Y83-R85 HydrophobicContact CE2-CG 4.06Å; R85-R135 CarbonylContact C-O 3.59Å; R85-R135 VanDerWaalsContact CA-O 3.28Å; R85-R135 WeakPolarHBondContact CA-O 3.31Å; R85-R135 HydrophobicContact CG-CB 4.29Å; R85-L330 PolarHBondContact N-O 3.28Å; R85-R331 HydrophobicContact CB-CG 4.15Å; R85-R331 CarbonylContact O-C 3.44Å; R85-R331 VanDerWaalsContact O-CA 3.29Å; R85-R331 WeakPolarHBondContact O-CA 3.31Å; R85-I332 PolarHBondContact O-N 2.94Å; R85-G397 PolarHBondContact NH1-OXT 3.38Å
86	I	98.5	Very high	95.9	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.005	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	120.1	178.1	-51.7	179	0	0	0	107.8	L84 L88 V119 A123 I134 R135 L136 T137	L84-I86 HydrophobicContact CD2-CD1 3.86Å; L84-I86 HydrophobicContact CD2-CG1 3.9Å; L84-I86 HydrophobicContact CG-CD1 4.41Å; L84-I86 HydrophobicContact CG-CG1 3.92Å; I86-L88 HydrophobicContact CG2-CD2 4.07Å; I86-V119 HydrophobicContact CD1-CG1 4.43Å; I86-V119 HydrophobicContact CG2-CG1 4.22Å; I86-V119 HydrophobicContact CG2-CG2 4.5Å; I86-A123 HydrophobicContact CD1-CB 4.13Å; I86-I134 HydrophobicContact CD1-CG2 3.98Å; I86-I134 HydrophobicContact CG1-CG2 4.3Å; I86-R135 PolarHBondContact N-O 2.85Å; I86-L136 HydrophobicContact CB-CD2 4.3Å; I86-T137 PolarHBondContact O-N 2.76Å; I86-T137 PolarHBondContact O-OG1 2.92Å; I86-T137 VanDerWaalsContact O-OG1 3.09Å
87	S	98.1	Very high	95.8	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.007	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	116.3	171.5	-177.9	0	0	0	0	108.4	T137 G138 I332 A334	S87-T137 WeakPolarHBondContact CA-OG1 3.27Å; S87-G138 WeakPolarHBondContact OG-CA 3.4Å; S87-I332 PolarHBondContact N-O 3.21Å; S87-A334 WeakPolarHBondContact O-CA 3.39Å
88	L	97.7	Very high	95.6	Very high	7 Å²	7	36.1 Å²	36.1	4%	0.037	18%	0.175	C	C	.	.			trans	-87.6	-20.2	-173.2	-68.1	-175.5	0	0	0	113.6	I86 V119 L136 T137 P141 R144 V147 I150	I86-L88 HydrophobicContact CG2-CD2 4.07Å; L88-V119 HydrophobicContact CD2-CG1 4.1Å; L88-V119 HydrophobicContact CD2-CG2 4.29Å; L88-L136 HydrophobicContact CD1-CB 4.04Å; L88-L136 HydrophobicContact CD1-CD1 4.16Å; L88-L136 HydrophobicContact CD1-CD2 4.16Å; L88-L136 HydrophobicContact CD1-CG 4.34Å; L88-L136 HydrophobicContact CD2-CD2 4.13Å; L88-L136 HydrophobicContact CG-CB 4.46Å; L88-L136 HydrophobicContact CG-CD2 4.24Å; L88-T137 PolarHBondContact N-O 3.27Å; L88-P141 HydrophobicContact CD1-CB 4.32Å; L88-R144 PolarHBondContact O-NH1 2.84Å; L88-V147 HydrophobicContact CD1-CG2 4Å; L88-I150 HydrophobicContact CD1-CD1 4.29Å; L88-I150 HydrophobicContact CD2-CD1 4.13Å
89	T	96.4	Very high	95.5	Very high	15 Å²	15	34.8 Å²	34.8	9%	0.092	16%	0.156	C	C	.	.			trans	-162.5	152.7	-177	-172.5	0	0	0	0	109.2	K91 G138 G139 E140 I143	T89-K91 PolarHBondContact OG1-N 3.04Å; T89-G138 CarbonylContact O-C 3.52Å; T89-G138 WeakPolarHBondContact O-CA 3.43Å; T89-G139 PolarHBondContact O-N 3Å; T89-E140 WeakPolarHBondContact CG2-O 3.39Å; T89-I143 HydrophobicContact CG2-CG1 4.42Å
90	E	95.6	Very high	95.2	Very high	3 Å²	3	34.2 Å²	34.2	1%	0.014	16%	0.155	C	C	.	.	S	Bend	trans	-90.7	-10.7	170.2	-59.5	176.4	168.1	0	0	112	L107 T108 L113 A334 L394	E90-L107 HydrophobicContact CB-CD2 3.75Å; E90-L107 WeakPolarHBondContact OE2-CA 3.29Å; E90-T108 WeakPolarHBondContact OE1-CB 3.48Å; E90-T108 PolarHBondContact OE1-OG1 3.32Å; E90-T108 WeakPolarHBondContact OE2-CB 3.49Å; E90-T108 PolarHBondContact OE2-N 2.86Å; E90-T108 PolarHBondContact OE2-OG1 3.43Å; E90-L113 HydrophobicContact CG-CD2 4.37Å; E90-A334 HydrophobicContact CG-CB 3.82Å; E90-L394 HydrophobicContact CB-CD2 3.83Å; E90-L394 HydrophobicContact CG-CD2 3.78Å
91	K	95.4	Very high	94.7	Very high	133 Å²	133	27 Å²	27	58%	0.578	13%	0.129	S	C	*	.			trans	-73.6	140.9	179.4	-69.2	-179	-179.9	-179.7	0	109.7	T89 L107 G139 E140 I143	T89-K91 PolarHBondContact OG1-N 3.04Å; K91-L107 HydrophobicContact CG-CD1 4.02Å; K91-G139 CarbonylContact O-C 3.47Å; K91-G139 WeakPolarHBondContact O-CA 3.38Å; K91-E140 PolarHBondContact O-N 3.41Å; K91-I143 HydrophobicContact CB-CD1 3.6Å; K91-I143 WeakPolarHBondContact O-CD1 3.35Å
92	C	95.7	Very high	94	Very high	22 Å²	22	33.2 Å²	33.2	15%	0.149	16%	0.158	C	C	.	.			trans	-136.5	145.1	172.3	-167.5	0	0	0	0	109.3	L94 R95 E140 V393	C92-L94 VanDerWaalsContact C-N 3.29Å; C92-L94 PolarHBondContact SG-N 3.23Å; C92-L94 VanDerWaalsContact SG-N 3.37Å; C92-R95 PolarHBondContact O-NH1 3.36Å; C92-E140 HydrophobicContact CB-CB 4.49Å; C92-V393 HydrophobicContact CB-CG2 4.43Å
93	N	94.8	Very high	93.4	Very high	46 Å²	46	38.7 Å²	38.7	25%	0.246	18%	0.182	C	C	.	.	S	Bend	trans	-83.8	-3.7	170.9	57.4	-21.6	0	0	0	112.9	I143 N168	N93-I143 HydrophobicContact CB-CG2 4.41Å; N93-N168 PolarHBondContact OD1-ND2 2.8Å
94	L	94.7	Very high	92.9	Very high	5 Å²	5	38.9 Å²	38.9	3%	0.026	19%	0.189	C	C	.	.			trans	-112.8	168.8	172.8	-65.9	-175.2	0	0	0	112.6	C92 N168 I170 V203 R205	C92-L94 VanDerWaalsContact C-N 3.29Å; C92-L94 PolarHBondContact SG-N 3.23Å; C92-L94 VanDerWaalsContact SG-N 3.37Å; L94-N168 HydrophobicContact CD1-CB 3.39Å; L94-N168 HydrophobicContact CG-CB 4.35Å; L94-I170 HydrophobicContact CD1-CD1 4.23Å; L94-I170 HydrophobicContact CD2-CD1 3.5Å; L94-I170 VanDerWaalsContact CD2-CD1 3.5Å; L94-I170 HydrophobicContact CG-CD1 4Å; L94-V203 HydrophobicContact CB-CB 4.41Å; L94-V203 HydrophobicContact CD1-CB 3.96Å; L94-V203 HydrophobicContact CD1-CG1 4.15Å; L94-V203 HydrophobicContact CD1-CG2 4.27Å; L94-V203 HydrophobicContact CD2-CB 3.98Å; L94-V203 HydrophobicContact CD2-CG2 3.69Å; L94-V203 HydrophobicContact CG-CB 4.36Å; L94-R205 HydrophobicContact CD2-CB 3.63Å; L94-R205 HydrophobicContact CD2-CG 4Å
95	R	94.2	Very high	92.4	Very high	88 Å²	88	40.4 Å²	40.4	33%	0.332	20%	0.199	S	C	.	.			trans	-137.4	51.7	-179	-65	-66.5	-178.3	-83.7	3.2	111	C92 Q97 M100 V203 R204	C92-R95 PolarHBondContact O-NH1 3.36Å; R95-Q97 PolarHBondContact O-N 3.46Å; R95-M100 WeakPolarHBondContact CD-SD 3.38Å; R95-V203 CarbonylContact C-O 3.59Å; R95-V203 PolarHBondContact N-O 2.85Å; R95-R204 HydrophobicContact CB-CB 4.15Å; R95-R204 WeakPolarHBondContact O-CD 2.99Å
96	C	93.9	Very high	92	Very high	15 Å²	15	48.2 Å²	48.2	10%	0.101	23%	0.234	C	C	.	.			trans	-60.9	132.5	-171.5	-44.2	0	0	0	0	112.8	Y98 C99 M100 V202	C96-Y98 VanDerWaalsContact C-N 3.25Å; C96-Y98 HydrophobicContact CB-CD1 4.39Å; C96-Y98 HydrophobicContact CB-CE1 4.02Å; C96-Y98 PolarHBondContact O-N 3.23Å; C96-Y98 VanDerWaalsContact O-N 3.17Å; C96-C99 HydrophobicContact CB-CB 4.04Å; C96-C99 PolarHBondContact O-N 3.3Å; C96-M100 PolarHBondContact O-N 3.17Å; C96-V202 VanDerWaalsContact CA-O 3.27Å; C96-V202 WeakPolarHBondContact CA-O 3.29Å
97	Q	91.4	Very high	91.8	Very high	60 Å²	60	51.9 Å²	51.9	28%	0.28	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-33	-173.9	-64.2	-175.6	31.1	0	0	114	R95 F201 V202	R95-Q97 PolarHBondContact O-N 3.46Å; Q97-F201 PolarHBondContact NE2-O 3.15Å; Q97-V202 PolarHBondContact N-O 3.21Å
98	Y	90.1	Very high	91.6	Very high	32 Å²	32	53.2 Å²	53.2	13%	0.125	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-8.1	-180	60.8	-98	0	0	0	114.3	C96 D192 V202 V231 M233 N266	C96-Y98 VanDerWaalsContact C-N 3.25Å; C96-Y98 HydrophobicContact CB-CD1 4.39Å; C96-Y98 HydrophobicContact CB-CE1 4.02Å; C96-Y98 PolarHBondContact O-N 3.23Å; C96-Y98 VanDerWaalsContact O-N 3.17Å; Y98-D192 WeakPolarHBondContact CE1-OD2 3.43Å; Y98-D192 PolarHBondContact OH-OD2 3.28Å; Y98-V202 HydrophobicContact CD1-CG1 4.15Å; Y98-V202 HydrophobicContact CE1-CG1 3.78Å; Y98-V231 HydrophobicContact CD2-CG2 4.45Å; Y98-V231 HydrophobicContact CE2-CG2 4.04Å; Y98-M233 HydrophobicContact CD1-CE 3.63Å; Y98-M233 HydrophobicContact CE1-CE 4.33Å; Y98-M233 HydrophobicContact CG-CE 4.38Å; Y98-N266 VanDerWaalsContact O-CB 3.29Å; Y98-N266 WeakPolarHBondContact O-CB 3.34Å; Y98-N266 PolarHBondContact O-ND2 2.77Å
99	C	91	Very high	91.5	Very high	27 Å²	27	56.5 Å²	56.5	18%	0.182	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116	-42.7	-170.6	-179.5	0	0	0	0	112.8	C96 M392	C96-C99 HydrophobicContact CB-CB 4.04Å; C96-C99 PolarHBondContact O-N 3.3Å; C99-M392 HydrophobicContact CB-CB 4.35Å
100	M	88.3	Confident	91.2	Very high	10 Å²	10	66.9 Å²	66.9	5%	0.049	32%	0.32	C	S	.	.	S	Bend	trans	-122.2	128.1	-179.7	-169.8	-179.8	-65.7	0	0	110	R95 C96 V105 V393	R95-M100 WeakPolarHBondContact CD-SD 3.38Å; C96-M100 PolarHBondContact O-N 3.17Å; M100-V105 HydrophobicContact CE-CG2 4.37Å; M100-V105 HydrophobicContact CG-CG1 4.35Å; M100-V393 HydrophobicContact CE-CB 4.3Å; M100-V393 HydrophobicContact CE-CG1 4.18Å; M100-V393 HydrophobicContact CE-CG2 3.73Å; M100-V393 HydrophobicContact CG-CG1 4.45Å
101	P	85.8	Confident	91.1	Very high	11 Å²	11	69.5 Å²	69.5	7%	0.071	35%	0.348	C	S	.	.			trans	-55.7	159.8	172.3	-22.2	33.6	0	0	0	112.1	E103 G104 V105	P101-E103 VanDerWaalsContact C-N 3.35Å; P101-E103 VanDerWaalsContact CB-CD 3.42Å; P101-E103 HydrophobicContact CB-CG 4.06Å; P101-E103 WeakPolarHBondContact CB-OE1 3.5Å; P101-E103 WeakPolarHBondContact CB-OE2 3.39Å; P101-G104 WeakPolarHBondContact O-CA 3.44Å; P101-G104 PolarHBondContact O-N 2.78Å; P101-V105 HydrophobicContact CG-CG1 4.32Å
102	E	81.4	Confident	91.1	Very high	129 Å²	129	67.9 Å²	67.9	60%	0.603	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-38	-175.8	-172.6	163.8	-162.9	0	0	112.4	G104 K267	E102-G104 PolarHBondContact O-N 2.67Å; E102-K267 IonicContact OE2-NZ 3.23Å; E102-K267 PolarHBondContact OE2-NZ 3.27Å
103	E	84.2	Confident	91.1	Very high	156 Å²	156	68.6 Å²	68.6	73%	0.729	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-9	169.9	63.5	-87.6	-152.1	0	0	113.6	P101	P101-E103 VanDerWaalsContact C-N 3.35Å; P101-E103 VanDerWaalsContact CB-CD 3.42Å; P101-E103 HydrophobicContact CB-CG 4.06Å; P101-E103 WeakPolarHBondContact CB-OE1 3.5Å; P101-E103 WeakPolarHBondContact CB-OE2 3.39Å
104	G	86.9	Confident	91.3	Very high	21 Å²	21	66.8 Å²	66.8	22%	0.216	34%	0.335	C	S	.	.			trans	80.3	-164.1	-175.4	0	0	0	0	0	113.2	P101 E102	P101-G104 WeakPolarHBondContact O-CA 3.44Å; P101-G104 PolarHBondContact O-N 2.78Å; E102-G104 PolarHBondContact O-N 2.67Å
105	V	87.9	Confident	91.4	Very high	33 Å²	33	68.7 Å²	68.7	20%	0.2	35%	0.349	C	S	.	.			trans	-131.6	145.4	177.1	-65.2	0	0	0	0	109.9	M100 P101 L107 P391 V393 L394	M100-V105 HydrophobicContact CE-CG2 4.37Å; M100-V105 HydrophobicContact CG-CG1 4.35Å; P101-V105 HydrophobicContact CG-CG1 4.32Å; V105-L107 HydrophobicContact CG2-CD2 3.86Å; V105-L107 PolarHBondContact O-N 3.48Å; V105-P391 HydrophobicContact CG1-CB 4.04Å; V105-P391 HydrophobicContact CG1-CG 4Å; V105-V393 HydrophobicContact CB-CG1 4.45Å; V105-V393 HydrophobicContact CG1-CG1 3.89Å; V105-V393 HydrophobicContact CG2-CG1 3.76Å; V105-L394 HydrophobicContact CB-CD1 4.49Å; V105-L394 HydrophobicContact CB-CD2 4.48Å; V105-L394 HydrophobicContact CG2-CD2 4Å; V105-L394 HydrophobicContact CG2-CG 4.5Å
106	K	90.8	Very high	91.6	Very high	198 Å²	198	66.1 Å²	66.1	86%	0.861	34%	0.343	S	S	*	.	P	Polyproline II helix	trans	-71	117.6	170.1	-174.4	178.5	-179.6	-179.2	0	108.5
107	L	93.5	Very high	91.8	Very high	77 Å²	77	69.2 Å²	69.2	40%	0.403	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-82.4	143.7	179.5	-58.3	179.4	0	0	0	111.2	E90 K91 V105	E90-L107 HydrophobicContact CB-CD2 3.75Å; E90-L107 WeakPolarHBondContact OE2-CA 3.29Å; K91-L107 HydrophobicContact CG-CD1 4.02Å; V105-L107 HydrophobicContact CG2-CD2 3.86Å; V105-L107 PolarHBondContact O-N 3.48Å
108	T	94	Very high	92.2	Very high	29 Å²	29	67.4 Å²	67.4	18%	0.178	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-65	132.5	172.8	-59.7	0	0	0	0	109.9	E90 Q112 L113 D335	E90-T108 WeakPolarHBondContact OE1-CB 3.48Å; E90-T108 PolarHBondContact OE1-OG1 3.32Å; E90-T108 WeakPolarHBondContact OE2-CB 3.49Å; E90-T108 PolarHBondContact OE2-N 2.86Å; E90-T108 PolarHBondContact OE2-OG1 3.43Å; T108-Q112 HydrophobicContact CG2-CB 3.42Å; T108-Q112 VanDerWaalsContact CG2-CB 3.42Å; T108-L113 HydrophobicContact CG2-CD2 3.89Å; T108-L113 HydrophobicContact CG2-CG 4.32Å; T108-D335 HydrophobicContact CG2-CB 4.04Å
109	P	94.8	Very high	92.6	Very high	77 Å²	77	65.9 Å²	65.9	50%	0.5	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-56.3	147.9	175.7	-25.2	34.2	0	0	0	112.1	G111 Q112 L113	P109-G111 VanDerWaalsContact C-N 3.26Å; P109-G111 PolarHBondContact O-N 3.5Å; P109-G111 VanDerWaalsContact O-N 3.13Å; P109-Q112 WeakPolarHBondContact O-CA 3.07Å; P109-Q112 WeakPolarHBondContact O-CB 3.21Å; P109-Q112 PolarHBondContact O-N 2.94Å; P109-L113 PolarHBondContact O-N 3.11Å
110	R	91.5	Very high	92.9	Very high	232 Å²	232	66.5 Å²	66.5	88%	0.875	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-53.7	-40	-175.5	-173.6	-179.4	-179.7	-175.4	-0.4	113.4	Q112 L113	R110-Q112 PolarHBondContact O-N 2.81Å; R110-L113 PolarHBondContact O-N 3.39Å; R110-L113 VanDerWaalsContact O-N 3.14Å
111	G	92.9	Very high	93.4	Very high	59 Å²	59	68.5 Å²	68.5	61%	0.608	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	-67.5	-14.4	178.4	0	0	0	0	0	114.3	P109 R355	P109-G111 VanDerWaalsContact C-N 3.26Å; P109-G111 PolarHBondContact O-N 3.5Å; P109-G111 VanDerWaalsContact O-N 3.13Å; G111-R355 PolarHBondContact O-NH1 3.18Å
112	Q	95	Very high	94	Very high	98 Å²	98	68 Å²	68	46%	0.458	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-103.3	4.3	176.1	-65.8	176.6	15.4	0	0	111.8	T108 P109 R110 R351	T108-Q112 HydrophobicContact CG2-CB 3.42Å; T108-Q112 VanDerWaalsContact CG2-CB 3.42Å; P109-Q112 WeakPolarHBondContact O-CA 3.07Å; P109-Q112 WeakPolarHBondContact O-CB 3.21Å; P109-Q112 PolarHBondContact O-N 2.94Å; R110-Q112 PolarHBondContact O-N 2.81Å; Q112-R351 PolarHBondContact O-NH1 2.99Å
113	L	97.1	Very high	94.8	Very high	38 Å²	38	61.9 Å²	61.9	20%	0.199	33%	0.333	C	S	.	.	S	Bend	trans	-88.8	156	169	-63.9	175.6	0	0	0	109.8	E90 T108 P109 R110 S115 A334 R355	E90-L113 HydrophobicContact CG-CD2 4.37Å; T108-L113 HydrophobicContact CG2-CD2 3.89Å; T108-L113 HydrophobicContact CG2-CG 4.32Å; P109-L113 PolarHBondContact O-N 3.11Å; R110-L113 PolarHBondContact O-N 3.39Å; R110-L113 VanDerWaalsContact O-N 3.14Å; L113-S115 PolarHBondContact O-N 3.03Å; L113-A334 HydrophobicContact CD2-CB 4.08Å; L113-R355 PolarHBondContact O-NH2 3.04Å; L113-R355 VanDerWaalsContact O-NH2 3.12Å
114	L	97.9	Very high	95.4	Very high	8 Å²	8	58.2 Å²	58.2	4%	0.042	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-62.1	126.8	170	-73.2	172.1	0	0	0	110.3	E118 V119 L122 I332 A334 R351	L114-E118 WeakPolarHBondContact CA-OE2 3.36Å; L114-E118 HydrophobicContact CB-CB 4.49Å; L114-E118 HydrophobicContact CD2-CB 3.77Å; L114-V119 HydrophobicContact CB-CG2 3.85Å; L114-V119 HydrophobicContact CD1-CG2 4.24Å; L114-L122 HydrophobicContact CD1-CD1 4.14Å; L114-L122 HydrophobicContact CD2-CD1 3.97Å; L114-I332 HydrophobicContact CD1-CG2 3.58Å; L114-A334 PolarHBondContact N-O 3.17Å; L114-R351 HydrophobicContact CD2-CB 3.83Å; L114-R351 HydrophobicContact CD2-CG 4Å
115	S	97.9	Very high	95.9	Very high	45 Å²	45	57.4 Å²	57.4	32%	0.315	31%	0.306	S	S	.	.	P	Polyproline II helix	trans	-68.9	170	168.7	84.6	0	0	0	0	110.6	L113 S117 E118 V119	L113-S115 PolarHBondContact O-N 3.03Å; S115-S117 PolarHBondContact OG-N 3.44Å; S115-S117 PolarHBondContact OG-OG 2.94Å; S115-E118 PolarHBondContact N-OE2 3.11Å; S115-E118 PolarHBondContact O-N 3.16Å; S115-E118 VanDerWaalsContact OG-CG 3.28Å; S115-E118 WeakPolarHBondContact OG-CG 3.47Å; S115-E118 PolarHBondContact OG-N 3.31Å; S115-E118 VanDerWaalsContact OG-N 3.1Å; S115-V119 WeakPolarHBondContact O-CG2 3.13Å; S115-V119 PolarHBondContact O-N 3.37Å
116	T	98	Very high	96.4	Very high	34 Å²	34	56 Å²	56	21%	0.209	30%	0.297	C	S	.	.	H	α-helix	trans	-66.3	-40	176.3	-64.4	0	0	0	0	112.1	E118 V119 L120 R144 D146 I150	T116-E118 PolarHBondContact O-N 3.42Å; T116-V119 PolarHBondContact O-N 3.26Å; T116-L120 HydrophobicContact CG2-CD1 4.2Å; T116-L120 VanDerWaalsContact O-CG 3.31Å; T116-L120 WeakPolarHBondContact O-CG 3.32Å; T116-L120 PolarHBondContact O-N 2.85Å; T116-R144 PolarHBondContact OG1-NH2 3.32Å; T116-D146 PolarHBondContact OG1-OD2 2.91Å; T116-I150 HydrophobicContact CG2-CD1 4.31Å; T116-I150 HydrophobicContact CG2-CG1 3.73Å
117	S	97.9	Very high	96.8	Very high	80 Å²	80	47 Å²	47	56%	0.559	26%	0.259	S	S	*	.	H	α-helix	trans	-62.1	-44.4	174	55.2	0	0	0	0	111.3	S115 V119 L120 T121	S115-S117 PolarHBondContact OG-N 3.44Å; S115-S117 PolarHBondContact OG-OG 2.94Å; S117-V119 PolarHBondContact O-N 2.96Å; S117-L120 PolarHBondContact O-N 2.51Å; S117-T121 WeakPolarHBondContact O-CB 3.07Å; S117-T121 PolarHBondContact O-N 3.27Å; S117-T121 PolarHBondContact O-OG1 3.31Å
118	E	98.4	Very high	96.9	Very high	21 Å²	21	49.3 Å²	49.3	10%	0.098	26%	0.263	C	S	.	.	H	α-helix	trans	-63.7	-40	178.9	-65.3	172.3	146.5	0	0	112.1	L114 S115 T116 L122 L354 R355	L114-E118 WeakPolarHBondContact CA-OE2 3.36Å; L114-E118 HydrophobicContact CB-CB 4.49Å; L114-E118 HydrophobicContact CD2-CB 3.77Å; S115-E118 PolarHBondContact N-OE2 3.11Å; S115-E118 PolarHBondContact O-N 3.16Å; S115-E118 VanDerWaalsContact OG-CG 3.28Å; S115-E118 WeakPolarHBondContact OG-CG 3.47Å; S115-E118 PolarHBondContact OG-N 3.31Å; S115-E118 VanDerWaalsContact OG-N 3.1Å; T116-E118 PolarHBondContact O-N 3.42Å; E118-L122 WeakPolarHBondContact O-CB 3.49Å; E118-L122 VanDerWaalsContact O-CG 3.31Å; E118-L122 WeakPolarHBondContact O-CG 3.43Å; E118-L122 PolarHBondContact O-N 2.8Å; E118-L354 HydrophobicContact CB-CD2 3.92Å; E118-L354 HydrophobicContact CG-CD2 3.82Å; E118-R355 WeakPolarHBondContact OE1-CG 3.31Å; E118-R355 IonicContact OE1-CZ 3.31Å; E118-R355 IonicContact OE1-NE 2.87Å; E118-R355 PolarHBondContact OE1-NE 2.85Å; E118-R355 IonicContact OE1-NH2 3.89Å; E118-R355 PolarHBondContact OE1-NH2 2.91Å; E118-R355 IonicContact OE2-CZ 3.09Å; E118-R355 IonicContact OE2-NE 2.71Å; E118-R355 IonicContact OE2-NH2 2.69Å; E118-R355 PolarHBondContact OE2-NH2 3.44Å
119	V	98.5	Very high	97	Very high	1 Å²	1	49.6 Å²	49.6	1%	0.006	26%	0.262	C	S	.	.	H	α-helix	trans	-59.4	-46.4	173.2	167.1	0	0	0	0	111.1	I86 L88 L114 S115 T116 S117 A123 I150	I86-V119 HydrophobicContact CD1-CG1 4.43Å; I86-V119 HydrophobicContact CG2-CG1 4.22Å; I86-V119 HydrophobicContact CG2-CG2 4.5Å; L88-V119 HydrophobicContact CD2-CG1 4.1Å; L88-V119 HydrophobicContact CD2-CG2 4.29Å; L114-V119 HydrophobicContact CB-CG2 3.85Å; L114-V119 HydrophobicContact CD1-CG2 4.24Å; S115-V119 WeakPolarHBondContact O-CG2 3.13Å; S115-V119 PolarHBondContact O-N 3.37Å; T116-V119 PolarHBondContact O-N 3.26Å; S117-V119 PolarHBondContact O-N 2.96Å; V119-A123 VanDerWaalsContact O-CB 3.26Å; V119-A123 WeakPolarHBondContact O-CB 3.42Å; V119-A123 PolarHBondContact O-N 3.4Å; V119-I150 HydrophobicContact CG1-CG2 4.37Å
120	L	98.6	Very high	97.1	Very high	40 Å²	40	47 Å²	47	21%	0.209	25%	0.25	C	C	.	.	H	α-helix	trans	-69.9	-39.9	-178.1	-66.9	175.2	0	0	0	112.1	T116 S117 A123 Q124 E153 L154	T116-L120 HydrophobicContact CG2-CD1 4.2Å; T116-L120 VanDerWaalsContact O-CG 3.31Å; T116-L120 WeakPolarHBondContact O-CG 3.32Å; T116-L120 PolarHBondContact O-N 2.85Å; S117-L120 PolarHBondContact O-N 2.51Å; L120-A123 PolarHBondContact O-N 3.49Å; L120-Q124 WeakPolarHBondContact O-CB 3.3Å; L120-Q124 PolarHBondContact O-N 3.45Å; L120-E153 HydrophobicContact CD1-CB 3.76Å; L120-E153 HydrophobicContact CD1-CG 3.88Å; L120-E153 HydrophobicContact CD2-CB 3.66Å; L120-E153 HydrophobicContact CG-CB 4.38Å; L120-L154 HydrophobicContact CD2-CD2 4Å; L120-L154 HydrophobicContact CD2-CG 4.13Å
121	T	98.2	Very high	97.4	Very high	52 Å²	52	36 Å²	36	32%	0.319	21%	0.208	S	C	.	.	H	α-helix	trans	-59.1	-50	174.2	-61.7	0	0	0	0	111	S117 Q124 L125 L354	S117-T121 WeakPolarHBondContact O-CB 3.07Å; S117-T121 PolarHBondContact O-N 3.27Å; S117-T121 PolarHBondContact O-OG1 3.31Å; T121-Q124 PolarHBondContact O-N 2.9Å; T121-L125 PolarHBondContact O-N 3.25Å; T121-L354 HydrophobicContact CG2-CD1 4.01Å; T121-L354 HydrophobicContact CG2-CD2 4.5Å
122	L	98.3	Very high	97.6	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	19%	0.19	C	C	.	.	H	α-helix	trans	-63.5	-44.8	177.5	-67.8	174.9	0	0	0	111.2	L114 E118 Q124 L125 F126 I332 L350	L114-L122 HydrophobicContact CD1-CD1 4.14Å; L114-L122 HydrophobicContact CD2-CD1 3.97Å; E118-L122 WeakPolarHBondContact O-CB 3.49Å; E118-L122 VanDerWaalsContact O-CG 3.31Å; E118-L122 WeakPolarHBondContact O-CG 3.43Å; E118-L122 PolarHBondContact O-N 2.8Å; L122-Q124 VanDerWaalsContact C-N 3.33Å; L122-Q124 PolarHBondContact O-N 2.89Å; L122-L125 WeakPolarHBondContact O-CB 3.41Å; L122-L125 PolarHBondContact O-N 3.09Å; L122-F126 VanDerWaalsContact O-CD2 3.27Å; L122-F126 WeakPolarHBondContact O-CD2 3.37Å; L122-F126 PolarHBondContact O-N 3.36Å; L122-I332 HydrophobicContact CB-CD1 4.17Å; L122-I332 HydrophobicContact CD1-CD1 4.28Å; L122-I332 HydrophobicContact CD1-CG2 4.5Å; L122-L350 HydrophobicContact CD1-CB 4.3Å; L122-L350 HydrophobicContact CD2-CB 4.14Å; L122-L350 HydrophobicContact CD2-CD1 4.21Å
123	A	98.5	Very high	97.7	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-58.9	-44.2	177.5	0	0	0	0	0	112.2	I86 V119 L120 F126 V127 I134 L154 L157	I86-A123 HydrophobicContact CD1-CB 4.13Å; V119-A123 VanDerWaalsContact O-CB 3.26Å; V119-A123 WeakPolarHBondContact O-CB 3.42Å; V119-A123 PolarHBondContact O-N 3.4Å; L120-A123 PolarHBondContact O-N 3.49Å; A123-F126 PolarHBondContact O-N 3.41Å; A123-V127 WeakPolarHBondContact O-CB 3.45Å; A123-V127 WeakPolarHBondContact O-CG2 3.39Å; A123-V127 PolarHBondContact O-N 3.02Å; A123-I134 HydrophobicContact CB-CD1 3.87Å; A123-L154 HydrophobicContact CB-CD2 3.36Å; A123-L157 HydrophobicContact CB-CD1 4.24Å
124	Q	97.9	Very high	97.8	Very high	78 Å²	78	31.5 Å²	31.5	36%	0.364	17%	0.171	S	C	.	.	H	α-helix	trans	-61	-44.5	176.5	-176.9	175.5	39.4	0	0	111.6	L120 T121 L122 V127 R128 L157	L120-Q124 WeakPolarHBondContact O-CB 3.3Å; L120-Q124 PolarHBondContact O-N 3.45Å; T121-Q124 PolarHBondContact O-N 2.9Å; L122-Q124 VanDerWaalsContact C-N 3.33Å; L122-Q124 PolarHBondContact O-N 2.89Å; Q124-V127 PolarHBondContact O-N 3.27Å; Q124-R128 WeakPolarHBondContact O-CG 3.48Å; Q124-R128 PolarHBondContact O-N 3.18Å; Q124-L157 HydrophobicContact CB-CD2 4.05Å; Q124-L157 HydrophobicContact CG-CD2 4.1Å
125	L	97.4	Very high	97.8	Very high	5 Å²	5	31.4 Å²	31.4	3%	0.026	17%	0.17	C	C	.	.	H	α-helix	trans	-57.2	-53.1	176.1	-174.1	66.6	0	0	0	110.9	T121 L122 V127 R128 E129 D360 L363 L364 I367	T121-L125 PolarHBondContact O-N 3.25Å; L122-L125 WeakPolarHBondContact O-CB 3.41Å; L122-L125 PolarHBondContact O-N 3.09Å; L125-V127 VanDerWaalsContact C-N 3.33Å; L125-V127 PolarHBondContact O-N 2.82Å; L125-R128 PolarHBondContact O-N 3.21Å; L125-E129 WeakPolarHBondContact O-CG 3.2Å; L125-E129 PolarHBondContact O-N 2.87Å; L125-D360 HydrophobicContact CD1-CB 3.95Å; L125-L363 HydrophobicContact CD2-CB 3.83Å; L125-L363 HydrophobicContact CD2-CD1 4.28Å; L125-L364 HydrophobicContact CD1-CD1 4.19Å; L125-L364 HydrophobicContact CD1-CD2 3.85Å; L125-L364 HydrophobicContact CD1-CG 3.91Å; L125-L364 HydrophobicContact CD2-CD2 4.19Å; L125-L364 HydrophobicContact CD2-CG 4.49Å; L125-L364 HydrophobicContact CG-CD2 3.89Å; L125-L364 HydrophobicContact CG-CG 4.4Å; L125-I367 HydrophobicContact CD2-CD1 3.9Å
126	F	98.2	Very high	97.8	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.009	16%	0.155	C	C	.	.	H	α-helix	trans	-61.9	-37.6	179.5	-86.2	-82	0	0	0	113.3	L73 L84 L122 A123 E129 G130 V131 L330 I332 L338 L350 I367	L73-F126 HydrophobicContact CD1-CD1 4.15Å; L73-F126 HydrophobicContact CD2-CD1 3.83Å; L73-F126 HydrophobicContact CD2-CE1 3.72Å; L84-F126 HydrophobicContact CD1-CD1 4.32Å; L84-F126 HydrophobicContact CD1-CD2 4.49Å; L84-F126 HydrophobicContact CD1-CE1 4.38Å; L84-F126 HydrophobicContact CD1-CG 4.39Å; L84-F126 HydrophobicContact CD2-CB 3.79Å; L84-F126 HydrophobicContact CD2-CD1 4.41Å; L84-F126 HydrophobicContact CD2-CD2 3.87Å; L84-F126 HydrophobicContact CD2-CG 3.76Å; L122-F126 VanDerWaalsContact O-CD2 3.27Å; L122-F126 WeakPolarHBondContact O-CD2 3.37Å; L122-F126 PolarHBondContact O-N 3.36Å; A123-F126 PolarHBondContact O-N 3.41Å; F126-E129 PolarHBondContact O-N 3.22Å; F126-G130 PolarHBondContact O-N 2.61Å; F126-V131 HydrophobicContact CB-CB 4.19Å; F126-V131 HydrophobicContact CB-CG2 3.85Å; F126-V131 HydrophobicContact CD1-CG2 4.05Å; F126-V131 HydrophobicContact CG-CG2 4.42Å; F126-V131 VanDerWaalsContact O-CB 3.27Å; F126-V131 WeakPolarHBondContact O-CB 3.31Å; F126-V131 WeakPolarHBondContact O-CG2 3.47Å; F126-V131 PolarHBondContact O-N 3.26Å; F126-L330 HydrophobicContact CD1-CD1 4.45Å; F126-L330 HydrophobicContact CE1-CD1 3.78Å; F126-I332 HydrophobicContact CD2-CD1 4.12Å; F126-I332 HydrophobicContact CE2-CD1 3.74Å; F126-L338 HydrophobicContact CZ-CD1 4.06Å; F126-L350 HydrophobicContact CE2-CD1 4.05Å; F126-L350 HydrophobicContact CZ-CD1 4.32Å; F126-I367 HydrophobicContact CE1-CG2 3.96Å; F126-I367 HydrophobicContact CE2-CD1 3.94Å; F126-I367 HydrophobicContact CZ-CD1 3.79Å; F126-I367 HydrophobicContact CZ-CG1 4.12Å; F126-I367 HydrophobicContact CZ-CG2 3.99Å
127	V	97.9	Very high	97.8	Very high	10 Å²	10	27.7 Å²	27.7	6%	0.061	15%	0.145	C	C	.	.	H	α-helix	trans	-67.1	-41	178.7	170.9	0	0	0	0	111.4	A123 Q124 L125 E129 G130 V131 I134 L157 V158 L160	A123-V127 WeakPolarHBondContact O-CB 3.45Å; A123-V127 WeakPolarHBondContact O-CG2 3.39Å; A123-V127 PolarHBondContact O-N 3.02Å; Q124-V127 PolarHBondContact O-N 3.27Å; L125-V127 VanDerWaalsContact C-N 3.33Å; L125-V127 PolarHBondContact O-N 2.82Å; V127-E129 PolarHBondContact O-N 3.01Å; V127-G130 PolarHBondContact O-N 3.17Å; V127-V131 WeakPolarHBondContact CA-O 3.41Å; V127-V131 HydrophobicContact CG2-CG1 4.5Å; V127-I134 HydrophobicContact CG2-CD1 3.91Å; V127-L157 HydrophobicContact CG1-CB 4.26Å; V127-L157 HydrophobicContact CG2-CD1 4.08Å; V127-V158 VanDerWaalsContact CG1-O 3.31Å; V127-V158 WeakPolarHBondContact CG1-O 3.49Å; V127-L160 HydrophobicContact CG1-CB 4.13Å; V127-L160 HydrophobicContact CG2-CB 4.08Å; V127-L160 HydrophobicContact CG2-CD1 3.97Å; V127-L160 HydrophobicContact CG2-CG 4.44Å
128	R	96.1	Very high	97.5	Very high	125 Å²	125	24.1 Å²	24.1	47%	0.472	12%	0.121	S	C	.	.	H	α-helix	trans	-58.2	-34.3	174.7	-74.4	175.5	179.7	169.6	2.1	112.3	Q124 L125 G130 D360	Q124-R128 WeakPolarHBondContact O-CG 3.48Å; Q124-R128 PolarHBondContact O-N 3.18Å; L125-R128 PolarHBondContact O-N 3.21Å; R128-G130 VanDerWaalsContact C-N 3.31Å; R128-G130 PolarHBondContact O-N 2.9Å; R128-D360 IonicContact NH1-OD2 2.62Å; R128-D360 PolarHBondContact NH1-OD2 3.44Å
129	E	96.4	Very high	97.3	Very high	35 Å²	35	24 Å²	24	16%	0.164	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	-0.6	179.1	-60.8	-51.1	118.8	0	0	114.6	S70 L73 L125 F126 V127 L364	S70-E129 WeakPolarHBondContact CB-O 3.31Å; S70-E129 WeakPolarHBondContact CB-OE2 3.27Å; S70-E129 PolarHBondContact N-O 3.47Å; S70-E129 VanDerWaalsContact N-O 3.1Å; S70-E129 PolarHBondContact OG-OE2 2.96Å; L73-E129 HydrophobicContact CD1-CB 3.53Å; L73-E129 HydrophobicContact CG-CB 3.81Å; L125-E129 WeakPolarHBondContact O-CG 3.2Å; L125-E129 PolarHBondContact O-N 2.87Å; F126-E129 PolarHBondContact O-N 3.22Å; V127-E129 PolarHBondContact O-N 3.01Å; E129-L364 HydrophobicContact CG-CD1 4.4Å; E129-L364 HydrophobicContact CG-CD2 3.38Å
130	G	95.8	Very high	97.2	Very high	24 Å²	24	24.1 Å²	24.1	25%	0.247	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	113.6	8.9	173.1	0	0	0	0	0	115.8	F69 N82 F126 V127 R128 D132	F69-G130 WeakPolarHBondContact CE2-O 3.34Å; N82-G130 WeakPolarHBondContact CB-O 3.38Å; F126-G130 PolarHBondContact O-N 2.61Å; V127-G130 PolarHBondContact O-N 3.17Å; R128-G130 VanDerWaalsContact C-N 3.31Å; R128-G130 PolarHBondContact O-N 2.9Å; G130-D132 PolarHBondContact O-N 3.16Å
131	V	97.8	Very high	97.2	Very high	1 Å²	1	22.3 Å²	22.3	1%	0.006	12%	0.117	C	C	.	.			trans	-66.6	118.2	166.3	170.4	0	0	0	0	109.7	L73 N82 L84 F126 V127 K133 I134	L73-V131 HydrophobicContact CD1-CG2 3.77Å; N82-V131 WeakPolarHBondContact O-CA 3.38Å; N82-V131 WeakPolarHBondContact O-CG1 3.48Å; L84-V131 HydrophobicContact CB-CG1 3.76Å; L84-V131 HydrophobicContact CB-CG2 4.29Å; F126-V131 HydrophobicContact CB-CB 4.19Å; F126-V131 HydrophobicContact CB-CG2 3.85Å; F126-V131 HydrophobicContact CD1-CG2 4.05Å; F126-V131 HydrophobicContact CG-CG2 4.42Å; F126-V131 VanDerWaalsContact O-CB 3.27Å; F126-V131 WeakPolarHBondContact O-CB 3.31Å; F126-V131 WeakPolarHBondContact O-CG2 3.47Å; F126-V131 PolarHBondContact O-N 3.26Å; V127-V131 WeakPolarHBondContact CA-O 3.41Å; V127-V131 HydrophobicContact CG2-CG1 4.5Å; V131-K133 WeakPolarHBondContact CG1-O 3.49Å; V131-I134 HydrophobicContact CG1-CG1 3.97Å
132	D	97.3	Very high	97.1	Very high	41 Å²	41	20 Å²	20	22%	0.219	10%	0.103	C	C	.	.			trans	-107.7	-6.1	177.8	64	8.8	0	0	0	112.6	N82 G130 K161 T162	N82-D132 PolarHBondContact ND2-OD1 3.42Å; N82-D132 PolarHBondContact ND2-OD2 3.44Å; N82-D132 PolarHBondContact O-N 3.35Å; N82-D132 VanDerWaalsContact O-N 3.12Å; G130-D132 PolarHBondContact O-N 3.16Å; D132-K161 HydrophobicContact CB-CB 4.44Å; D132-K161 HydrophobicContact CB-CD 4.13Å; D132-K161 HydrophobicContact CB-CG 4.16Å; D132-K161 WeakPolarHBondContact O-CA 3.5Å; D132-K161 WeakPolarHBondContact O-CB 3.45Å; D132-K161 PolarHBondContact O-N 2.96Å; D132-T162 PolarHBondContact O-N 2.81Å
133	K	97.9	Very high	97.1	Very high	59 Å²	59	22.7 Å²	22.7	26%	0.257	12%	0.116	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	121.5	-179.9	-176.7	172.5	-174.1	165.4	0	112	N82 Y83 L84 V131 T162	N82-K133 PolarHBondContact O-N 3.47Å; Y83-K133 WeakPolarHBondContact CA-O 3.36Å; Y83-K133 HydrophobicContact CD1-CD 4.33Å; Y83-K133 HydrophobicContact CD2-CB 4.19Å; Y83-K133 HydrophobicContact CD2-CD 3.99Å; Y83-K133 HydrophobicContact CD2-CG 3.77Å; Y83-K133 HydrophobicContact CE1-CD 4.49Å; Y83-K133 HydrophobicContact CE2-CD 4.17Å; Y83-K133 HydrophobicContact CE2-CG 4.04Å; Y83-K133 HydrophobicContact CG-CD 4.11Å; Y83-K133 HydrophobicContact CG-CG 4.3Å; L84-K133 PolarHBondContact N-O 3.38Å; V131-K133 WeakPolarHBondContact CG1-O 3.49Å; K133-T162 WeakPolarHBondContact CA-O 3.39Å; K133-T162 HydrophobicContact CG-CG2 4.19Å
134	I	98.7	Very high	96.9	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	133.5	172.5	-68.5	174.2	0	0	0	109.5	L84 I86 A123 V127 V131 L136 L154 L160 T162 V163 A164	L84-I134 HydrophobicContact CB-CG1 4.26Å; L84-I134 HydrophobicContact CD2-CG1 4.45Å; L84-I134 CarbonylContact O-C 3.55Å; L84-I134 WeakPolarHBondContact O-CA 3.44Å; I86-I134 HydrophobicContact CD1-CG2 3.98Å; I86-I134 HydrophobicContact CG1-CG2 4.3Å; A123-I134 HydrophobicContact CB-CD1 3.87Å; V127-I134 HydrophobicContact CG2-CD1 3.91Å; V131-I134 HydrophobicContact CG1-CG1 3.97Å; I134-L136 HydrophobicContact CG2-CD2 4.05Å; I134-L154 HydrophobicContact CD1-CD2 3.96Å; I134-L154 HydrophobicContact CG2-CD1 4.09Å; I134-L160 HydrophobicContact CB-CD1 4.07Å; I134-L160 HydrophobicContact CD1-CD1 3.82Å; I134-L160 HydrophobicContact CD1-CD2 3.93Å; I134-L160 HydrophobicContact CG1-CD1 3.64Å; I134-L160 HydrophobicContact CG1-CD2 4.42Å; I134-T162 PolarHBondContact N-O 2.8Å; I134-V163 CarbonylContact O-C 3.2Å; I134-V163 WeakPolarHBondContact O-CA 3.42Å; I134-A164 PolarHBondContact O-N 2.97Å
135	R	98.5	Very high	96.8	Very high	5 Å²	5	26.6 Å²	26.6	2%	0.019	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	122.4	169.5	177.2	175.6	-71.5	-81.5	-3.9	111.4	Y83 L84 R85 I86 T137 A164 V165 T166 N188	Y83-R135 HydrophobicContact CE2-CB 3.67Å; Y83-R135 WeakPolarHBondContact OH-CD 3.38Å; Y83-R135 PolarHBondContact OH-NE 3.16Å; L84-R135 PolarHBondContact O-N 3.09Å; R85-R135 CarbonylContact C-O 3.59Å; R85-R135 VanDerWaalsContact CA-O 3.28Å; R85-R135 WeakPolarHBondContact CA-O 3.31Å; R85-R135 HydrophobicContact CG-CB 4.29Å; I86-R135 PolarHBondContact N-O 2.85Å; R135-T137 HydrophobicContact CG-CG2 3.86Å; R135-A164 CarbonylContact C-O 3.54Å; R135-A164 VanDerWaalsContact CA-O 3.28Å; R135-A164 WeakPolarHBondContact CA-O 3.48Å; R135-A164 HydrophobicContact CB-CB 4.3Å; R135-A164 HydrophobicContact CG-CB 4.35Å; R135-V165 PolarHBondContact NH1-O 3.1Å; R135-T166 WeakPolarHBondContact CD-OG1 3.29Å; R135-T166 PolarHBondContact NH1-OG1 2.59Å; R135-N188 VanDerWaalsContact CZ-OD1 3.25Å; R135-N188 PolarHBondContact NH1-OD1 3.39Å; R135-N188 PolarHBondContact NH2-OD1 2.71Å
136	L	98.6	Very high	96.8	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	130.4	173.7	-55.3	178.8	0	0	0	109.8	I86 L88 I134 I150 I151 L154 V163 A164 V165 T166	I86-L136 HydrophobicContact CB-CD2 4.3Å; L88-L136 HydrophobicContact CD1-CB 4.04Å; L88-L136 HydrophobicContact CD1-CD1 4.16Å; L88-L136 HydrophobicContact CD1-CD2 4.16Å; L88-L136 HydrophobicContact CD1-CG 4.34Å; L88-L136 HydrophobicContact CD2-CD2 4.13Å; L88-L136 HydrophobicContact CG-CB 4.46Å; L88-L136 HydrophobicContact CG-CD2 4.24Å; I134-L136 HydrophobicContact CG2-CD2 4.05Å; L136-I150 HydrophobicContact CD1-CG2 4.18Å; L136-I150 HydrophobicContact CD2-CG2 4.42Å; L136-I151 HydrophobicContact CD1-CD1 4.14Å; L136-I151 HydrophobicContact CD1-CG1 3.45Å; L136-I151 VanDerWaalsContact CD1-CG1 3.45Å; L136-L154 HydrophobicContact CD1-CD1 4.22Å; L136-L154 HydrophobicContact CD2-CD1 3.9Å; L136-L154 HydrophobicContact CG-CD1 4.4Å; L136-V163 HydrophobicContact CD1-CG1 4.34Å; L136-A164 PolarHBondContact N-O 3.42Å; L136-V165 HydrophobicContact CB-CG2 4.05Å; L136-V165 HydrophobicContact CD1-CG2 4.44Å; L136-V165 WeakPolarHBondContact O-CA 3.08Å; L136-T166 PolarHBondContact O-N 3.03Å
137	T	97.6	Very high	96.8	Very high	2 Å²	2	28.6 Å²	28.6	1%	0.012	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	-165.4	-176.7	64.8	0	0	0	0	108.7	I86 S87 L88 R135 G397	I86-T137 PolarHBondContact O-N 2.76Å; I86-T137 PolarHBondContact O-OG1 2.92Å; I86-T137 VanDerWaalsContact O-OG1 3.09Å; S87-T137 WeakPolarHBondContact CA-OG1 3.27Å; L88-T137 PolarHBondContact N-O 3.27Å; R135-T137 HydrophobicContact CG-CG2 3.86Å; T137-G397 VanDerWaalsContact CG2-O 3.31Å; T137-G397 WeakPolarHBondContact CG2-O 3.46Å
138	G	91.5	Very high	96.8	Very high	5 Å²	5	30 Å²	30	5%	0.052	16%	0.162	C	C	.	.	S	Bend	trans	171.6	-150.4	175.8	0	0	0	0	0	110.6	S87 T89 G396	S87-G138 WeakPolarHBondContact OG-CA 3.4Å; T89-G138 CarbonylContact O-C 3.52Å; T89-G138 WeakPolarHBondContact O-CA 3.43Å; G138-G396 WeakPolarHBondContact O-CA 3.34Å
139	G	92.9	Very high	96.9	Very high	19 Å²	19	28.9 Å²	28.9	20%	0.196	17%	0.166	C	C	.	.	S	Bend	trans	-63.8	-73.5	135.3	0	0	0	0	0	108.7	T89 K91	T89-G139 PolarHBondContact O-N 3Å; K91-G139 CarbonylContact O-C 3.47Å; K91-G139 WeakPolarHBondContact O-CA 3.38Å
140	E	97.3	Very high	97	Very high	3 Å²	3	27.2 Å²	27.2	1%	0.014	16%	0.158	C	C	.	.			trans	-130.2	112.7	168.5	172.8	52	-127.4	0	0	109.9	T89 K91 C92 L142 I143 T167 N168	T89-E140 WeakPolarHBondContact CG2-O 3.39Å; K91-E140 PolarHBondContact O-N 3.41Å; C92-E140 HydrophobicContact CB-CB 4.49Å; E140-L142 VanDerWaalsContact C-N 3.3Å; E140-L142 PolarHBondContact O-N 3.34Å; E140-L142 VanDerWaalsContact OE1-CB 3.26Å; E140-L142 WeakPolarHBondContact OE1-CB 3.46Å; E140-L142 WeakPolarHBondContact OE1-CG 3.47Å; E140-L142 PolarHBondContact OE1-N 2.9Å; E140-I143 HydrophobicContact CB-CD1 4.37Å; E140-I143 HydrophobicContact CB-CG2 4.23Å; E140-I143 HydrophobicContact CG-CG2 3.78Å; E140-I143 WeakPolarHBondContact O-CG1 3.1Å; E140-I143 PolarHBondContact O-N 3.27Å; E140-T167 WeakPolarHBondContact OE1-CB 3.1Å; E140-T167 PolarHBondContact OE1-OG1 2.96Å; E140-T167 WeakPolarHBondContact OE2-CA 3.48Å; E140-T167 PolarHBondContact OE2-OG1 3.17Å; E140-T167 VanDerWaalsContact OE2-OG1 3.12Å; E140-N168 PolarHBondContact OE2-N 2.95Å; E140-N168 PolarHBondContact OE2-ND2 3.24Å
141	P	97.7	Very high	97.1	Very high	1 Å²	1	26 Å²	26	1%	0.006	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-63.2	-33.7	-178	22.2	-31.7	0	0	0	113.2	L88 I143 R144 V165 T166	L88-P141 HydrophobicContact CD1-CB 4.32Å; P141-I143 PolarHBondContact O-N 2.85Å; P141-I143 VanDerWaalsContact O-N 3.14Å; P141-R144 WeakPolarHBondContact O-CB 3.47Å; P141-R144 PolarHBondContact O-N 2.71Å; P141-V165 HydrophobicContact CG-CG1 3.85Å; P141-T166 VanDerWaalsContact CD-O 3.28Å; P141-T166 WeakPolarHBondContact CD-O 3.46Å; P141-T166 WeakPolarHBondContact CG-O 3.33Å
142	L	97.5	Very high	97.1	Very high	5 Å²	5	27.6 Å²	27.6	3%	0.026	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-78	4.7	-173.1	-58.4	-174.2	0	0	0	114.6	E140 V147 V165 T167 N171 L172 L175 L179	E140-L142 VanDerWaalsContact C-N 3.3Å; E140-L142 PolarHBondContact O-N 3.34Å; E140-L142 VanDerWaalsContact OE1-CB 3.26Å; E140-L142 WeakPolarHBondContact OE1-CB 3.46Å; E140-L142 WeakPolarHBondContact OE1-CG 3.47Å; E140-L142 PolarHBondContact OE1-N 2.9Å; L142-V147 HydrophobicContact CD2-CG1 4.44Å; L142-V147 HydrophobicContact CD2-CG2 4.4Å; L142-V165 HydrophobicContact CD2-CG1 4.24Å; L142-V165 HydrophobicContact CG-CG1 4.43Å; L142-T167 HydrophobicContact CD1-CG2 4.04Å; L142-T167 WeakPolarHBondContact CD1-OG1 3.45Å; L142-N171 HydrophobicContact CB-CB 4.41Å; L142-L172 HydrophobicContact CD1-CB 4.02Å; L142-L172 HydrophobicContact CD1-CD1 3.85Å; L142-L175 HydrophobicContact CB-CD1 3.97Å; L142-L175 HydrophobicContact CD2-CD1 4.37Å; L142-L179 HydrophobicContact CD1-CD1 4.47Å; L142-L179 HydrophobicContact CD2-CD1 4.16Å; L142-L179 HydrophobicContact CD2-CD2 4.25Å
143	I	96.8	Very high	97.2	Very high	56 Å²	56	29.3 Å²	29.3	29%	0.287	17%	0.166	S	C	.	.	G	3₁₀ helix	trans	-95.4	-9.8	166.4	77.6	-169.2	0	0	0	112.5	T89 K91 N93 E140 P141 P145	T89-I143 HydrophobicContact CG2-CG1 4.42Å; K91-I143 HydrophobicContact CB-CD1 3.6Å; K91-I143 WeakPolarHBondContact O-CD1 3.35Å; N93-I143 HydrophobicContact CB-CG2 4.41Å; E140-I143 HydrophobicContact CB-CD1 4.37Å; E140-I143 HydrophobicContact CB-CG2 4.23Å; E140-I143 HydrophobicContact CG-CG2 3.78Å; E140-I143 WeakPolarHBondContact O-CG1 3.1Å; E140-I143 PolarHBondContact O-N 3.27Å; P141-I143 PolarHBondContact O-N 2.85Å; P141-I143 VanDerWaalsContact O-N 3.14Å; I143-P145 WeakPolarHBondContact O-CD 3.46Å
144	R	96.3	Very high	97.2	Very high	29 Å²	29	26.5 Å²	26.5	11%	0.109	15%	0.153	C	C	.	.	S	Bend	trans	-72.6	122.9	176.4	178.4	169.1	179.6	162.1	-6.7	108.7	L88 T116 P141 D146 V147	L88-R144 PolarHBondContact O-NH1 2.84Å; T116-R144 PolarHBondContact OG1-NH2 3.32Å; P141-R144 WeakPolarHBondContact O-CB 3.47Å; P141-R144 PolarHBondContact O-N 2.71Å; R144-D146 VanDerWaalsContact C-N 3.3Å; R144-D146 WeakPolarHBondContact CD-OD1 3.4Å; R144-D146 WeakPolarHBondContact CG-OD1 3.44Å; R144-D146 IonicContact CZ-OD1 3.36Å; R144-D146 IonicContact NE-OD1 3.81Å; R144-D146 PolarHBondContact NE-OD1 2.83Å; R144-D146 IonicContact NH2-OD1 2.84Å; R144-D146 IonicContact NH2-OD2 2.79Å; R144-D146 PolarHBondContact O-N 3.09Å; R144-V147 HydrophobicContact CB-CB 4.46Å; R144-V147 WeakPolarHBondContact O-CB 3.26Å; R144-V147 WeakPolarHBondContact O-CG1 3.13Å; R144-V147 PolarHBondContact O-N 3.18Å
145	P	95.3	Very high	97.2	Very high	131 Å²	131	29.8 Å²	29.8	85%	0.851	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-35.8	-171.2	-27.8	35.8	0	0	0	115.1	I143	I143-P145 WeakPolarHBondContact O-CD 3.46Å
146	D	96.6	Very high	97.1	Very high	46 Å²	46	36 Å²	36	25%	0.246	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.2	20.3	-175	56.6	-6	0	0	0	113.2	T116 R144 L148 D149 I150	T116-D146 PolarHBondContact OG1-OD2 2.91Å; R144-D146 VanDerWaalsContact C-N 3.3Å; R144-D146 WeakPolarHBondContact CD-OD1 3.4Å; R144-D146 WeakPolarHBondContact CG-OD1 3.44Å; R144-D146 IonicContact CZ-OD1 3.36Å; R144-D146 IonicContact NE-OD1 3.81Å; R144-D146 PolarHBondContact NE-OD1 2.83Å; R144-D146 IonicContact NH2-OD1 2.84Å; R144-D146 IonicContact NH2-OD2 2.79Å; R144-D146 PolarHBondContact O-N 3.09Å; D146-L148 VanDerWaalsContact C-N 3.26Å; D146-L148 PolarHBondContact O-N 2.87Å; D146-D149 PolarHBondContact O-N 2.99Å; D146-I150 WeakPolarHBondContact O-CG1 3.48Å; D146-I150 PolarHBondContact O-N 3.42Å
147	V	97.9	Very high	97.1	Very high	4 Å²	4	37.3 Å²	37.3	2%	0.024	20%	0.202	C	C	.	.	H	α-helix	trans	-61.4	-33.7	179.3	68.1	0	0	0	0	112.9	L88 L142 R144 I151	L88-V147 HydrophobicContact CD1-CG2 4Å; L142-V147 HydrophobicContact CD2-CG1 4.44Å; L142-V147 HydrophobicContact CD2-CG2 4.4Å; R144-V147 HydrophobicContact CB-CB 4.46Å; R144-V147 WeakPolarHBondContact O-CB 3.26Å; R144-V147 WeakPolarHBondContact O-CG1 3.13Å; R144-V147 PolarHBondContact O-N 3.18Å; V147-I151 HydrophobicContact CG2-CD1 4.18Å; V147-I151 VanDerWaalsContact O-CG1 3.31Å; V147-I151 WeakPolarHBondContact O-CG1 3.47Å; V147-I151 PolarHBondContact O-N 2.73Å; V147-I151 VanDerWaalsContact O-N 3.08Å
148	L	98.1	Very high	96.9	Very high	38 Å²	38	44 Å²	44	20%	0.199	24%	0.243	C	C	.	.	H	α-helix	trans	-67.1	-44.2	177.9	-65.8	175.5	0	0	0	111	D146 I150 I151 A152 K178 L179	D146-L148 VanDerWaalsContact C-N 3.26Å; D146-L148 PolarHBondContact O-N 2.87Å; L148-I150 VanDerWaalsContact C-N 3.35Å; L148-I151 PolarHBondContact O-N 3.18Å; L148-A152 WeakPolarHBondContact O-CB 3.48Å; L148-A152 PolarHBondContact O-N 2.81Å; L148-K178 HydrophobicContact CD1-CB 3.81Å; L148-K178 HydrophobicContact CD1-CD 3.78Å; L148-K178 HydrophobicContact CD1-CG 4.46Å; L148-K178 HydrophobicContact CD2-CB 3.9Å; L148-L179 HydrophobicContact CD2-CD2 3.61Å; L148-L179 HydrophobicContact CD2-CG 3.95Å
149	D	98.1	Very high	97	Very high	102 Å²	102	46.1 Å²	46.1	55%	0.545	26%	0.264	S	S	.	.	H	α-helix	trans	-63.7	-43.3	178.3	-54.2	-32.3	0	0	0	110.4	D146 I151 A152 E153	D146-D149 PolarHBondContact O-N 2.99Å; D149-I151 VanDerWaalsContact C-N 3.35Å; D149-I151 PolarHBondContact O-N 3.43Å; D149-A152 PolarHBondContact O-N 3.06Å; D149-E153 WeakPolarHBondContact O-CG 3.35Å; D149-E153 PolarHBondContact O-N 3.37Å
150	I	98.6	Very high	97.2	Very high	0 Å²	0	46 Å²	46	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-57.1	-47.9	174.7	-69.1	165.7	0	0	0	110.9	L88 T116 V119 L136 D146 L148 A152 E153 L154	L88-I150 HydrophobicContact CD1-CD1 4.29Å; L88-I150 HydrophobicContact CD2-CD1 4.13Å; T116-I150 HydrophobicContact CG2-CD1 4.31Å; T116-I150 HydrophobicContact CG2-CG1 3.73Å; V119-I150 HydrophobicContact CG1-CG2 4.37Å; L136-I150 HydrophobicContact CD1-CG2 4.18Å; L136-I150 HydrophobicContact CD2-CG2 4.42Å; D146-I150 WeakPolarHBondContact O-CG1 3.48Å; D146-I150 PolarHBondContact O-N 3.42Å; L148-I150 VanDerWaalsContact C-N 3.35Å; I150-A152 PolarHBondContact O-N 2.74Å; I150-E153 PolarHBondContact O-N 2.84Å; I150-L154 HydrophobicContact CG2-CD1 3.86Å; I150-L154 HydrophobicContact CG2-CG 4.24Å; I150-L154 WeakPolarHBondContact O-CB 3.47Å; I150-L154 WeakPolarHBondContact O-CG 3.49Å; I150-L154 PolarHBondContact O-N 2.57Å
151	I	98.6	Very high	97.2	Very high	0 Å²	0	53 Å²	53	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-62.1	-45.8	179.8	-69.7	164.9	0	0	0	110.6	L136 V147 L148 D149 E153 L154 K155 V163 V165 L179 A182 L184	L136-I151 HydrophobicContact CD1-CD1 4.14Å; L136-I151 HydrophobicContact CD1-CG1 3.45Å; L136-I151 VanDerWaalsContact CD1-CG1 3.45Å; V147-I151 HydrophobicContact CG2-CD1 4.18Å; V147-I151 VanDerWaalsContact O-CG1 3.31Å; V147-I151 WeakPolarHBondContact O-CG1 3.47Å; V147-I151 PolarHBondContact O-N 2.73Å; V147-I151 VanDerWaalsContact O-N 3.08Å; L148-I151 PolarHBondContact O-N 3.18Å; D149-I151 VanDerWaalsContact C-N 3.35Å; D149-I151 PolarHBondContact O-N 3.43Å; I151-E153 PolarHBondContact O-N 3.01Å; I151-L154 PolarHBondContact O-N 3.31Å; I151-K155 WeakPolarHBondContact O-CG 3.41Å; I151-K155 PolarHBondContact O-N 3Å; I151-V163 HydrophobicContact CG1-CG1 4.29Å; I151-V163 HydrophobicContact CG2-CG1 4.25Å; I151-V165 HydrophobicContact CD1-CG2 4.23Å; I151-L179 HydrophobicContact CD1-CD2 3.4Å; I151-L179 VanDerWaalsContact CD1-CD2 3.4Å; I151-A182 HydrophobicContact CB-CB 4.25Å; I151-A182 HydrophobicContact CG2-CB 3.84Å; I151-L184 HydrophobicContact CD1-CD1 4.31Å; I151-L184 HydrophobicContact CG2-CB 4.29Å
152	A	98.4	Very high	97.2	Very high	33 Å²	33	54.5 Å²	54.5	27%	0.273	30%	0.298	S	S	.	.	H	α-helix	trans	-61.3	-43.3	179.9	0	0	0	0	0	112	L148 D149 I150 K155 A182	L148-A152 WeakPolarHBondContact O-CB 3.48Å; L148-A152 PolarHBondContact O-N 2.81Å; D149-A152 PolarHBondContact O-N 3.06Å; I150-A152 PolarHBondContact O-N 2.74Å; A152-K155 PolarHBondContact O-N 2.97Å; A152-A182 HydrophobicContact CB-CB 4.35Å
153	E	98.5	Very high	97.3	Very high	77 Å²	77	54.2 Å²	54.2	36%	0.36	30%	0.297	S	S	.	.	H	α-helix	trans	-68.7	-40.3	176.4	-67.8	-50	131.7	0	0	112.4	L120 D149 I150 I151 K155 K156	L120-E153 HydrophobicContact CD1-CB 3.76Å; L120-E153 HydrophobicContact CD1-CG 3.88Å; L120-E153 HydrophobicContact CD2-CB 3.66Å; L120-E153 HydrophobicContact CG-CB 4.38Å; D149-E153 WeakPolarHBondContact O-CG 3.35Å; D149-E153 PolarHBondContact O-N 3.37Å; I150-E153 PolarHBondContact O-N 2.84Å; I151-E153 PolarHBondContact O-N 3.01Å; E153-K155 VanDerWaalsContact C-N 3.27Å; E153-K155 PolarHBondContact O-N 3.14Å; E153-K156 WeakPolarHBondContact O-CB 3.47Å; E153-K156 PolarHBondContact O-N 3.49Å; E153-K156 VanDerWaalsContact O-N 3.1Å; E153-K156 IonicContact OE1-NZ 3.39Å; E153-K156 PolarHBondContact OE1-NZ 2.85Å; E153-K156 WeakPolarHBondContact OE2-CD 3.39Å; E153-K156 IonicContact OE2-NZ 3.38Å; E153-K156 PolarHBondContact OE2-NZ 3.16Å; E153-K156 VanDerWaalsContact OE2-NZ 3.14Å
154	L	98.4	Very high	97.3	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-59.6	-39.5	175.8	-73.2	177.1	0	0	0	111.7	L120 A123 I134 L136 I150 I151 K156 L157 L160 V163	L120-L154 HydrophobicContact CD2-CD2 4Å; L120-L154 HydrophobicContact CD2-CG 4.13Å; A123-L154 HydrophobicContact CB-CD2 3.36Å; I134-L154 HydrophobicContact CD1-CD2 3.96Å; I134-L154 HydrophobicContact CG2-CD1 4.09Å; L136-L154 HydrophobicContact CD1-CD1 4.22Å; L136-L154 HydrophobicContact CD2-CD1 3.9Å; L136-L154 HydrophobicContact CG-CD1 4.4Å; I150-L154 HydrophobicContact CG2-CD1 3.86Å; I150-L154 HydrophobicContact CG2-CG 4.24Å; I150-L154 WeakPolarHBondContact O-CB 3.47Å; I150-L154 WeakPolarHBondContact O-CG 3.49Å; I150-L154 PolarHBondContact O-N 2.57Å; I151-L154 PolarHBondContact O-N 3.31Å; L154-K156 PolarHBondContact O-N 3.29Å; L154-L157 HydrophobicContact CD2-CD1 3.79Å; L154-L157 VanDerWaalsContact O-CB 3.28Å; L154-L157 WeakPolarHBondContact O-CB 3.49Å; L154-L157 WeakPolarHBondContact O-CG 3.4Å; L154-L157 PolarHBondContact O-N 3.48Å; L154-L160 HydrophobicContact CB-CD2 4.03Å; L154-L160 VanDerWaalsContact O-CD2 3.24Å; L154-L160 WeakPolarHBondContact O-CD2 3.5Å; L154-V163 HydrophobicContact CB-CG2 4Å; L154-V163 HydrophobicContact CD1-CG1 4.47Å
155	K	97.3	Very high	97.4	Very high	69 Å²	69	50.2 Å²	50.2	30%	0.3	28%	0.279	S	S	.	.	H	α-helix	trans	-67.4	-15.1	178.9	-72.2	-64.4	-68.6	-170.3	0	114.1	I151 A152 E153 L157 V163 G183 D185	I151-K155 WeakPolarHBondContact O-CG 3.41Å; I151-K155 PolarHBondContact O-N 3Å; A152-K155 PolarHBondContact O-N 2.97Å; E153-K155 VanDerWaalsContact C-N 3.27Å; E153-K155 PolarHBondContact O-N 3.14Å; K155-L157 VanDerWaalsContact C-N 3.32Å; K155-V163 HydrophobicContact CD-CB 4.05Å; K155-V163 HydrophobicContact CD-CG2 3.54Å; K155-V163 HydrophobicContact CG-CG2 4.03Å; K155-G183 WeakPolarHBondContact CD-O 3.13Å; K155-G183 WeakPolarHBondContact CE-O 3.49Å; K155-G183 WeakPolarHBondContact CG-O 3.1Å; K155-D185 IonicContact NZ-OD1 3.14Å; K155-D185 PolarHBondContact NZ-OD1 3.16Å; K155-D185 IonicContact NZ-OD2 3.43Å; K155-D185 PolarHBondContact NZ-OD2 3.39Å
156	K	97.6	Very high	97.6	Very high	135 Å²	135	44.8 Å²	44.8	59%	0.587	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-13	172.3	-60.7	172.6	-170.2	173	0	112.9	E153 L154 V158	E153-K156 WeakPolarHBondContact O-CB 3.47Å; E153-K156 PolarHBondContact O-N 3.49Å; E153-K156 VanDerWaalsContact O-N 3.1Å; E153-K156 IonicContact OE1-NZ 3.39Å; E153-K156 PolarHBondContact OE1-NZ 2.85Å; E153-K156 WeakPolarHBondContact OE2-CD 3.39Å; E153-K156 IonicContact OE2-NZ 3.38Å; E153-K156 PolarHBondContact OE2-NZ 3.16Å; E153-K156 VanDerWaalsContact OE2-NZ 3.14Å; L154-K156 PolarHBondContact O-N 3.29Å; K156-V158 PolarHBondContact O-N 3.13Å
157	L	97.4	Very high	97.7	Very high	29 Å²	29	42.7 Å²	42.7	15%	0.152	23%	0.232	C	C	.	.	S	Bend	trans	-71.5	114.8	-178	-60	-179.9	0	0	0	111	A123 Q124 V127 L154 K155 G159 L160	A123-L157 HydrophobicContact CB-CD1 4.24Å; Q124-L157 HydrophobicContact CB-CD2 4.05Å; Q124-L157 HydrophobicContact CG-CD2 4.1Å; V127-L157 HydrophobicContact CG1-CB 4.26Å; V127-L157 HydrophobicContact CG2-CD1 4.08Å; L154-L157 HydrophobicContact CD2-CD1 3.79Å; L154-L157 VanDerWaalsContact O-CB 3.28Å; L154-L157 WeakPolarHBondContact O-CB 3.49Å; L154-L157 WeakPolarHBondContact O-CG 3.4Å; L154-L157 PolarHBondContact O-N 3.48Å; K155-L157 VanDerWaalsContact C-N 3.32Å; L157-G159 PolarHBondContact O-N 3.04Å; L157-L160 HydrophobicContact CB-CB 4.14Å; L157-L160 WeakPolarHBondContact O-CB 3.47Å; L157-L160 PolarHBondContact O-N 3.27Å; L157-L160 VanDerWaalsContact O-N 3.16Å
158	V	94.8	Very high	97.7	Very high	143 Å²	143	43 Å²	43	87%	0.867	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	128.1	174.7	-179	0	0	0	0	109.6	V127 K156	V127-V158 VanDerWaalsContact CG1-O 3.31Å; V127-V158 WeakPolarHBondContact CG1-O 3.49Å; K156-V158 PolarHBondContact O-N 3.13Å
159	G	93.6	Very high	97.6	Very high	49 Å²	49	41.2 Å²	41.2	51%	0.505	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	99.7	-22.2	-176.8	0	0	0	0	0	114.1	L157 K161	L157-G159 PolarHBondContact O-N 3.04Å; G159-K161 PolarHBondContact O-N 2.82Å
160	L	97.4	Very high	97.6	Very high	16 Å²	16	37.3 Å²	37.3	8%	0.084	20%	0.203	C	C	.	.			trans	-78.4	111.9	176.4	-173.5	66.9	0	0	0	110.7	V127 I134 L154 L157 V163	V127-L160 HydrophobicContact CG1-CB 4.13Å; V127-L160 HydrophobicContact CG2-CB 4.08Å; V127-L160 HydrophobicContact CG2-CD1 3.97Å; V127-L160 HydrophobicContact CG2-CG 4.44Å; I134-L160 HydrophobicContact CB-CD1 4.07Å; I134-L160 HydrophobicContact CD1-CD1 3.82Å; I134-L160 HydrophobicContact CD1-CD2 3.93Å; I134-L160 HydrophobicContact CG1-CD1 3.64Å; I134-L160 HydrophobicContact CG1-CD2 4.42Å; L154-L160 HydrophobicContact CB-CD2 4.03Å; L154-L160 VanDerWaalsContact O-CD2 3.24Å; L154-L160 WeakPolarHBondContact O-CD2 3.5Å; L157-L160 HydrophobicContact CB-CB 4.14Å; L157-L160 WeakPolarHBondContact O-CB 3.47Å; L157-L160 PolarHBondContact O-N 3.27Å; L157-L160 VanDerWaalsContact O-N 3.16Å; L160-V163 HydrophobicContact CD2-CG2 3.56Å; L160-V163 HydrophobicContact CG-CG2 4.33Å
161	K	96.9	Very high	97.5	Very high	149 Å²	149	39.4 Å²	39.4	65%	0.648	21%	0.214	S	C	*	.			trans	-87.9	-33.6	-178.3	-63.3	178.8	-177.1	171.6	0	112.8	D132 G159	D132-K161 HydrophobicContact CB-CB 4.44Å; D132-K161 HydrophobicContact CB-CD 4.13Å; D132-K161 HydrophobicContact CB-CG 4.16Å; D132-K161 WeakPolarHBondContact O-CA 3.5Å; D132-K161 WeakPolarHBondContact O-CB 3.45Å; D132-K161 PolarHBondContact O-N 2.96Å; G159-K161 PolarHBondContact O-N 2.82Å
162	T	97.8	Very high	97.4	Very high	33 Å²	33	39.5 Å²	39.5	20%	0.202	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	123.4	-170.4	-59	0	0	0	0	112.3	D132 K133 I134 D185 L186	D132-T162 PolarHBondContact O-N 2.81Å; K133-T162 WeakPolarHBondContact CA-O 3.39Å; K133-T162 HydrophobicContact CG-CG2 4.19Å; I134-T162 PolarHBondContact N-O 2.8Å; T162-D185 WeakPolarHBondContact CA-OD2 3.23Å; T162-D185 HydrophobicContact CG2-CB 4.19Å; T162-L186 HydrophobicContact CG2-CD1 3.7Å; T162-L186 HydrophobicContact CG2-CG 4.07Å
163	V	98.4	Very high	97.4	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	125.7	164.2	-178.3	0	0	0	0	108.5	I134 L136 I151 L154 K155 L160 L184 D185 L186	I134-V163 CarbonylContact O-C 3.2Å; I134-V163 WeakPolarHBondContact O-CA 3.42Å; L136-V163 HydrophobicContact CD1-CG1 4.34Å; I151-V163 HydrophobicContact CG1-CG1 4.29Å; I151-V163 HydrophobicContact CG2-CG1 4.25Å; L154-V163 HydrophobicContact CB-CG2 4Å; L154-V163 HydrophobicContact CD1-CG1 4.47Å; K155-V163 HydrophobicContact CD-CB 4.05Å; K155-V163 HydrophobicContact CD-CG2 3.54Å; K155-V163 HydrophobicContact CG-CG2 4.03Å; L160-V163 HydrophobicContact CD2-CG2 3.56Å; L160-V163 HydrophobicContact CG-CG2 4.33Å; V163-L184 HydrophobicContact CG1-CD1 4.16Å; V163-D185 PolarHBondContact N-OD2 3.34Å; V163-D185 WeakPolarHBondContact O-CB 3.4Å; V163-D185 PolarHBondContact O-N 3.35Å; V163-L186 PolarHBondContact O-N 3.22Å
164	A	98.2	Very high	97.3	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	156.1	-179.9	0	0	0	0	0	111.8	I134 R135 L136 L186	I134-A164 PolarHBondContact O-N 2.97Å; R135-A164 CarbonylContact C-O 3.54Å; R135-A164 VanDerWaalsContact CA-O 3.28Å; R135-A164 WeakPolarHBondContact CA-O 3.48Å; R135-A164 HydrophobicContact CB-CB 4.3Å; R135-A164 HydrophobicContact CG-CB 4.35Å; L136-A164 PolarHBondContact N-O 3.42Å; A164-L186 CarbonylContact C-O 3.54Å; A164-L186 WeakPolarHBondContact CA-O 3.4Å; A164-L186 HydrophobicContact CB-CB 3.84Å
165	V	98.4	Very high	97.2	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.006	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	140	172.5	166.1	0	0	0	0	110	R135 L136 P141 L142 I151 T167 L184 L186 N188	R135-V165 PolarHBondContact NH1-O 3.1Å; L136-V165 HydrophobicContact CB-CG2 4.05Å; L136-V165 HydrophobicContact CD1-CG2 4.44Å; L136-V165 WeakPolarHBondContact O-CA 3.08Å; P141-V165 HydrophobicContact CG-CG1 3.85Å; L142-V165 HydrophobicContact CD2-CG1 4.24Å; L142-V165 HydrophobicContact CG-CG1 4.43Å; I151-V165 HydrophobicContact CD1-CG2 4.23Å; V165-T167 HydrophobicContact CG1-CG2 4.26Å; V165-L184 HydrophobicContact CB-CD1 4.19Å; V165-L184 HydrophobicContact CB-CD2 4.35Å; V165-L184 HydrophobicContact CG2-CD1 3.65Å; V165-L184 HydrophobicContact CG2-CD2 4.19Å; V165-L186 PolarHBondContact N-O 2.95Å; V165-N188 PolarHBondContact O-N 3.37Å
166	T	98.3	Very high	97.2	Very high	16 Å²	16	40.5 Å²	40.5	10%	0.098	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	122.7	159.1	-59.3	0	0	0	0	108.9	R135 L136 P141 N188	R135-T166 WeakPolarHBondContact CD-OG1 3.29Å; R135-T166 PolarHBondContact NH1-OG1 2.59Å; L136-T166 PolarHBondContact O-N 3.03Å; P141-T166 VanDerWaalsContact CD-O 3.28Å; P141-T166 WeakPolarHBondContact CD-O 3.46Å; P141-T166 WeakPolarHBondContact CG-O 3.33Å; T166-N188 CarbonylContact C-O 3.4Å; T166-N188 WeakPolarHBondContact CA-O 3.18Å; T166-N188 HydrophobicContact CG2-CB 4.38Å
167	T	98.4	Very high	97.2	Very high	3 Å²	3	36.6 Å²	36.6	2%	0.018	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	158.1	-177.4	179	0	0	0	0	110.3	E140 L142 V165 G169 L172 I187 N188 I189 S190	E140-T167 WeakPolarHBondContact OE1-CB 3.1Å; E140-T167 PolarHBondContact OE1-OG1 2.96Å; E140-T167 WeakPolarHBondContact OE2-CA 3.48Å; E140-T167 PolarHBondContact OE2-OG1 3.17Å; E140-T167 VanDerWaalsContact OE2-OG1 3.12Å; L142-T167 HydrophobicContact CD1-CG2 4.04Å; L142-T167 WeakPolarHBondContact CD1-OG1 3.45Å; V165-T167 HydrophobicContact CG1-CG2 4.26Å; T167-G169 PolarHBondContact OG1-N 3.3Å; T167-L172 HydrophobicContact CG2-CB 4.48Å; T167-L172 HydrophobicContact CG2-CD2 4Å; T167-I187 HydrophobicContact CG2-CG2 4.41Å; T167-N188 PolarHBondContact N-O 2.89Å; T167-I189 HydrophobicContact CG2-CG1 4.49Å; T167-I189 CarbonylContact O-C 3.6Å; T167-I189 WeakPolarHBondContact O-CA 3.43Å; T167-S190 PolarHBondContact O-N 3.05Å
168	N	97.6	Very high	97.2	Very high	11 Å²	11	41.2 Å²	41.2	6%	0.059	22%	0.216	C	C	.	.			trans	-77.3	-6.2	165.6	65.7	46.7	0	0	0	113.7	N93 L94 E140 I170 V211	N93-N168 PolarHBondContact OD1-ND2 2.8Å; L94-N168 HydrophobicContact CD1-CB 3.39Å; L94-N168 HydrophobicContact CG-CB 4.35Å; E140-N168 PolarHBondContact OE2-N 2.95Å; E140-N168 PolarHBondContact OE2-ND2 3.24Å; N168-I170 VanDerWaalsContact C-N 3.32Å; N168-I170 PolarHBondContact O-N 2.88Å; N168-I170 WeakPolarHBondContact OD1-CB 3.5Å; N168-I170 PolarHBondContact OD1-N 2.92Å; N168-V211 VanDerWaalsContact O-CG2 3.25Å; N168-V211 WeakPolarHBondContact O-CG2 3.22Å
169	G	97.5	Very high	97.4	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.175	C	C	.	.	S	Bend	trans	83.5	-10.1	172.1	0	0	0	0	0	115.6	T167 N171 L172 S214	T167-G169 PolarHBondContact OG1-N 3.3Å; G169-N171 VanDerWaalsContact C-N 3.3Å; G169-N171 PolarHBondContact O-N 3.29Å; G169-L172 WeakPolarHBondContact O-CB 3.1Å; G169-L172 PolarHBondContact O-N 2.98Å; G169-L172 VanDerWaalsContact O-N 3.11Å; G169-S214 WeakPolarHBondContact O-CB 3.47Å; G169-S214 PolarHBondContact O-OG 2.75Å
170	I	97.3	Very high	97.5	Very high	20 Å²	20	37 Å²	37	10%	0.103	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-38	-174.4	-72	179.6	0	0	0	113.1	L94 N168 K210 V211	L94-I170 HydrophobicContact CD1-CD1 4.23Å; L94-I170 HydrophobicContact CD2-CD1 3.5Å; L94-I170 VanDerWaalsContact CD2-CD1 3.5Å; L94-I170 HydrophobicContact CG-CD1 4Å; N168-I170 VanDerWaalsContact C-N 3.32Å; N168-I170 PolarHBondContact O-N 2.88Å; N168-I170 WeakPolarHBondContact OD1-CB 3.5Å; N168-I170 PolarHBondContact OD1-N 2.92Å; I170-K210 HydrophobicContact CG2-CD 4.22Å; I170-V211 HydrophobicContact CG1-CG2 3.93Å
171	N	96.3	Very high	97.5	Very high	44 Å²	44	42.9 Å²	42.9	24%	0.235	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98	-0.9	-179.5	-73.7	-15.1	0	0	0	113	L142 G169 L175	L142-N171 HydrophobicContact CB-CB 4.41Å; G169-N171 VanDerWaalsContact C-N 3.3Å; G169-N171 PolarHBondContact O-N 3.29Å; N171-L175 HydrophobicContact CB-CD1 4.49Å
172	L	97.8	Very high	97.5	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-70.1	-46.7	-165.8	175.5	62.8	0	0	0	111.2	L142 T167 G169 R174 L175 L176 L179 I187 I189	L142-L172 HydrophobicContact CD1-CB 4.02Å; L142-L172 HydrophobicContact CD1-CD1 3.85Å; T167-L172 HydrophobicContact CG2-CB 4.48Å; T167-L172 HydrophobicContact CG2-CD2 4Å; G169-L172 WeakPolarHBondContact O-CB 3.1Å; G169-L172 PolarHBondContact O-N 2.98Å; G169-L172 VanDerWaalsContact O-N 3.11Å; L172-R174 PolarHBondContact O-N 2.97Å; L172-R174 VanDerWaalsContact O-N 3.11Å; L172-L175 PolarHBondContact O-N 3.14Å; L172-L176 HydrophobicContact CD1-CD2 3.7Å; L172-L176 HydrophobicContact CD1-CG 3.78Å; L172-L176 HydrophobicContact CG-CD1 4.2Å; L172-L176 HydrophobicContact CG-CD2 4.03Å; L172-L176 HydrophobicContact CG-CG 3.81Å; L172-L176 WeakPolarHBondContact O-CG 3.29Å; L172-L176 PolarHBondContact O-N 2.75Å; L172-L179 HydrophobicContact CD1-CD1 3.72Å; L172-I187 HydrophobicContact CD1-CD1 4.27Å; L172-I187 HydrophobicContact CD2-CG2 3.8Å; L172-I189 HydrophobicContact CD2-CD1 3.55Å; L172-I189 HydrophobicContact CD2-CG1 3.81Å
173	S	97.1	Very high	97.5	Very high	13 Å²	13	36.1 Å²	36.1	9%	0.091	18%	0.181	C	C	.	.	H	α-helix	trans	-53.7	-38.6	-176.6	72.8	0	0	0	0	113.7	E213 S214 K217	S173-E213 VanDerWaalsContact CB-OE1 3.22Å; S173-E213 WeakPolarHBondContact CB-OE1 3.44Å; S173-E213 PolarHBondContact OG-OE1 3.17Å; S173-S214 WeakPolarHBondContact CB-OG 3.4Å; S173-S214 PolarHBondContact N-OG 3.45Å; S173-K217 WeakPolarHBondContact O-CD 3.14Å; S173-K217 WeakPolarHBondContact O-CE 3.37Å; S173-K217 PolarHBondContact O-NZ 3.18Å
174	R	96.4	Very high	97.4	Very high	172 Å²	172	36.5 Å²	36.5	65%	0.649	18%	0.183	S	C	*	.	H	α-helix	trans	-69.9	-36.2	176.8	-178.8	179.9	66.3	101.7	2.1	113.1	L172	L172-R174 PolarHBondContact O-N 2.97Å; L172-R174 VanDerWaalsContact O-N 3.11Å
175	L	97.6	Very high	97.4	Very high	15 Å²	15	39.2 Å²	39.2	8%	0.079	20%	0.198	C	C	.	.	H	α-helix	trans	-91.7	-19.2	-173.8	-66.4	176.2	0	0	0	113.2	L142 N171 L172 K178 L179	L142-L175 HydrophobicContact CB-CD1 3.97Å; L142-L175 HydrophobicContact CD2-CD1 4.37Å; N171-L175 HydrophobicContact CB-CD1 4.49Å; L172-L175 PolarHBondContact O-N 3.14Å; L175-K178 PolarHBondContact O-N 2.81Å; L175-L179 HydrophobicContact CB-CD1 3.83Å; L175-L179 HydrophobicContact CB-CG 4.15Å; L175-L179 WeakPolarHBondContact O-CG 3.31Å; L175-L179 PolarHBondContact O-N 3.23Å
176	L	97.1	Very high	97.4	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-46.8	-49	-175.2	-90.1	172.7	0	0	0	114.9	L172 K178 L179 K180 I187 K217 A218 L221 Y223	L172-L176 HydrophobicContact CD1-CD2 3.7Å; L172-L176 HydrophobicContact CD1-CG 3.78Å; L172-L176 HydrophobicContact CG-CD1 4.2Å; L172-L176 HydrophobicContact CG-CD2 4.03Å; L172-L176 HydrophobicContact CG-CG 3.81Å; L172-L176 WeakPolarHBondContact O-CG 3.29Å; L172-L176 PolarHBondContact O-N 2.75Å; L176-K178 PolarHBondContact O-N 3.17Å; L176-L179 PolarHBondContact O-N 3.01Å; L176-K180 PolarHBondContact O-N 2.88Å; L176-I187 HydrophobicContact CD2-CD1 3.43Å; L176-I187 VanDerWaalsContact CD2-CD1 3.43Å; L176-K217 HydrophobicContact CD1-CB 3.77Å; L176-K217 HydrophobicContact CD1-CD 4.1Å; L176-K217 HydrophobicContact CD1-CG 3.73Å; L176-A218 HydrophobicContact CD1-CB 4.02Å; L176-A218 HydrophobicContact CD2-CB 4.08Å; L176-L221 HydrophobicContact CB-CD1 3.65Å; L176-L221 HydrophobicContact CD1-CD1 4.3Å; L176-L221 HydrophobicContact CG-CD1 4.4Å; L176-Y223 HydrophobicContact CD2-CD2 4.13Å; L176-Y223 HydrophobicContact CD2-CE2 3.61Å
177	P	96.9	Very high	97.3	Very high	53 Å²	53	40.1 Å²	40.1	34%	0.344	20%	0.202	S	C	.	.	H	α-helix	trans	-58.6	-48.5	178.1	-25	35.4	0	0	0	112.1	L179 K180 D181	P177-L179 VanDerWaalsContact C-N 3.33Å; P177-L179 PolarHBondContact O-N 2.97Å; P177-K180 WeakPolarHBondContact O-CB 3.39Å; P177-K180 PolarHBondContact O-N 2.71Å; P177-K180 VanDerWaalsContact O-N 3.14Å; P177-D181 VanDerWaalsContact O-CG 3.23Å; P177-D181 PolarHBondContact O-N 3.23Å
178	K	97.9	Very high	97.3	Very high	127 Å²	127	40.2 Å²	40.2	55%	0.552	20%	0.202	S	C	*	.	H	α-helix	trans	-66	-34.6	179.2	-60.1	-172.4	177.5	-168.4	0	112.8	L148 L175 L176 K180 D181 A182	L148-K178 HydrophobicContact CD1-CB 3.81Å; L148-K178 HydrophobicContact CD1-CD 3.78Å; L148-K178 HydrophobicContact CD1-CG 4.46Å; L148-K178 HydrophobicContact CD2-CB 3.9Å; L175-K178 PolarHBondContact O-N 2.81Å; L176-K178 PolarHBondContact O-N 3.17Å; K178-K180 VanDerWaalsContact C-N 3.33Å; K178-D181 PolarHBondContact O-N 2.99Å; K178-A182 VanDerWaalsContact O-CB 3.31Å; K178-A182 WeakPolarHBondContact O-CB 3.22Å; K178-A182 PolarHBondContact O-N 2.78Å
179	L	97.9	Very high	97.4	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-65.8	-39.6	174.9	-71.6	167	0	0	0	110.9	L142 L148 I151 L172 L175 L176 P177 A182 G183 L184	L142-L179 HydrophobicContact CD1-CD1 4.47Å; L142-L179 HydrophobicContact CD2-CD1 4.16Å; L142-L179 HydrophobicContact CD2-CD2 4.25Å; L148-L179 HydrophobicContact CD2-CD2 3.61Å; L148-L179 HydrophobicContact CD2-CG 3.95Å; I151-L179 HydrophobicContact CD1-CD2 3.4Å; I151-L179 VanDerWaalsContact CD1-CD2 3.4Å; L172-L179 HydrophobicContact CD1-CD1 3.72Å; L175-L179 HydrophobicContact CB-CD1 3.83Å; L175-L179 HydrophobicContact CB-CG 4.15Å; L175-L179 WeakPolarHBondContact O-CG 3.31Å; L175-L179 PolarHBondContact O-N 3.23Å; L176-L179 PolarHBondContact O-N 3.01Å; P177-L179 VanDerWaalsContact C-N 3.33Å; P177-L179 PolarHBondContact O-N 2.97Å; L179-A182 PolarHBondContact O-N 3.08Å; L179-G183 PolarHBondContact O-N 2.63Å; L179-L184 HydrophobicContact CB-CB 4.16Å; L179-L184 HydrophobicContact CB-CD2 3.88Å; L179-L184 HydrophobicContact CD1-CD2 4.17Å; L179-L184 HydrophobicContact CD2-CD2 4.19Å; L179-L184 HydrophobicContact CG-CD2 4.3Å; L179-L184 WeakPolarHBondContact O-CB 3.46Å; L179-L184 PolarHBondContact O-N 3.47Å
180	K	96.4	Very high	97.4	Very high	103 Å²	103	41.2 Å²	41.2	45%	0.448	21%	0.21	S	C	.	.	H	α-helix	trans	-65.5	-45.1	175.1	-169	172.8	-179.9	179.5	0	111.2	L176 P177 K178 A182 G183 L221 Y223	L176-K180 PolarHBondContact O-N 2.88Å; P177-K180 WeakPolarHBondContact O-CB 3.39Å; P177-K180 PolarHBondContact O-N 2.71Å; P177-K180 VanDerWaalsContact O-N 3.14Å; K178-K180 VanDerWaalsContact C-N 3.33Å; K180-A182 VanDerWaalsContact C-N 3.3Å; K180-A182 PolarHBondContact O-N 3.02Å; K180-G183 WeakPolarHBondContact O-CA 3.13Å; K180-G183 PolarHBondContact O-N 2.65Å; K180-L221 HydrophobicContact CD-CB 4.49Å; K180-L221 PolarHBondContact NZ-O 2.85Å; K180-Y223 WeakPolarHBondContact CA-OH 3.35Å; K180-Y223 PolarHBondContact N-OH 3.48Å
181	D	97.1	Very high	97.4	Very high	139 Å²	139	40.3 Å²	40.3	74%	0.743	21%	0.205	S	C	*	.	H	α-helix	trans	-62.5	-37	176.6	-61.3	-22.7	0	0	0	112.1	P177 K178 G183	P177-D181 VanDerWaalsContact O-CG 3.23Å; P177-D181 PolarHBondContact O-N 3.23Å; K178-D181 PolarHBondContact O-N 2.99Å; D181-G183 PolarHBondContact O-N 3.11Å
182	A	97.6	Very high	97.5	Very high	18 Å²	18	38.4 Å²	38.4	15%	0.149	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-9.2	173.7	0	0	0	0	0	113.5	I151 A152 K178 L179 K180	I151-A182 HydrophobicContact CB-CB 4.25Å; I151-A182 HydrophobicContact CG2-CB 3.84Å; A152-A182 HydrophobicContact CB-CB 4.35Å; K178-A182 VanDerWaalsContact O-CB 3.31Å; K178-A182 WeakPolarHBondContact O-CB 3.22Å; K178-A182 PolarHBondContact O-N 2.78Å; L179-A182 PolarHBondContact O-N 3.08Å; K180-A182 VanDerWaalsContact C-N 3.3Å; K180-A182 PolarHBondContact O-N 3.02Å
183	G	96.3	Very high	97.5	Very high	22 Å²	22	38.3 Å²	38.3	23%	0.227	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.4	25.2	177.2	0	0	0	0	0	115	K155 L179 K180 D181 D185	K155-G183 WeakPolarHBondContact CD-O 3.13Å; K155-G183 WeakPolarHBondContact CE-O 3.49Å; K155-G183 WeakPolarHBondContact CG-O 3.1Å; L179-G183 PolarHBondContact O-N 2.63Å; K180-G183 WeakPolarHBondContact O-CA 3.13Å; K180-G183 PolarHBondContact O-N 2.65Å; D181-G183 PolarHBondContact O-N 3.11Å; G183-D185 PolarHBondContact O-N 2.96Å
184	L	98.1	Very high	97.5	Very high	8 Å²	8	39.5 Å²	39.5	4%	0.042	20%	0.2	C	C	.	.			trans	-63.1	124.3	172.4	-178.2	68.4	0	0	0	110.6	I151 V163 V165 L179 I187 Y223	I151-L184 HydrophobicContact CD1-CD1 4.31Å; I151-L184 HydrophobicContact CG2-CB 4.29Å; V163-L184 HydrophobicContact CG1-CD1 4.16Å; V165-L184 HydrophobicContact CB-CD1 4.19Å; V165-L184 HydrophobicContact CB-CD2 4.35Å; V165-L184 HydrophobicContact CG2-CD1 3.65Å; V165-L184 HydrophobicContact CG2-CD2 4.19Å; L179-L184 HydrophobicContact CB-CB 4.16Å; L179-L184 HydrophobicContact CB-CD2 3.88Å; L179-L184 HydrophobicContact CD1-CD2 4.17Å; L179-L184 HydrophobicContact CD2-CD2 4.19Å; L179-L184 HydrophobicContact CG-CD2 4.3Å; L179-L184 WeakPolarHBondContact O-CB 3.46Å; L179-L184 PolarHBondContact O-N 3.47Å; L184-I187 HydrophobicContact CD2-CD1 4.19Å; L184-I187 HydrophobicContact CD2-CG1 3.8Å; L184-Y223 VanDerWaalsContact O-CE1 3.31Å; L184-Y223 WeakPolarHBondContact O-CE1 3.3Å; L184-Y223 PolarHBondContact O-OH 3.23Å
185	D	97.7	Very high	97.6	Very high	58 Å²	58	34.2 Å²	34.2	31%	0.31	19%	0.187	S	C	.	.			trans	-91.1	-44.2	-174.3	-54.1	-72.9	0	0	0	112.9	K155 T162 V163 G183	K155-D185 IonicContact NZ-OD1 3.14Å; K155-D185 PolarHBondContact NZ-OD1 3.16Å; K155-D185 IonicContact NZ-OD2 3.43Å; K155-D185 PolarHBondContact NZ-OD2 3.39Å; T162-D185 WeakPolarHBondContact CA-OD2 3.23Å; T162-D185 HydrophobicContact CG2-CB 4.19Å; V163-D185 PolarHBondContact N-OD2 3.34Å; V163-D185 WeakPolarHBondContact O-CB 3.4Å; V163-D185 PolarHBondContact O-N 3.35Å; G183-D185 PolarHBondContact O-N 2.96Å
186	L	97.3	Very high	97.6	Very high	34 Å²	34	35.9 Å²	35.9	18%	0.178	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	143	-171.3	-63.4	178.8	0	0	0	113.4	T162 V163 A164 V165	T162-L186 HydrophobicContact CG2-CD1 3.7Å; T162-L186 HydrophobicContact CG2-CG 4.07Å; V163-L186 PolarHBondContact O-N 3.22Å; A164-L186 CarbonylContact C-O 3.54Å; A164-L186 WeakPolarHBondContact CA-O 3.4Å; A164-L186 HydrophobicContact CB-CB 3.84Å; V165-L186 PolarHBondContact N-O 2.95Å
187	I	97.8	Very high	97.6	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.005	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	132.8	179.5	-56.8	173.7	0	0	0	110.2	T167 L172 L176 L184 I189 A218 Y223 K227	T167-I187 HydrophobicContact CG2-CG2 4.41Å; L172-I187 HydrophobicContact CD1-CD1 4.27Å; L172-I187 HydrophobicContact CD2-CG2 3.8Å; L176-I187 HydrophobicContact CD2-CD1 3.43Å; L176-I187 VanDerWaalsContact CD2-CD1 3.43Å; L184-I187 HydrophobicContact CD2-CD1 4.19Å; L184-I187 HydrophobicContact CD2-CG1 3.8Å; I187-I189 HydrophobicContact CG2-CD1 4.25Å; I187-I189 HydrophobicContact CG2-CG1 3.72Å; I187-A218 HydrophobicContact CD1-CB 4.36Å; I187-Y223 HydrophobicContact CD1-CD1 3.8Å; I187-Y223 HydrophobicContact CD1-CD2 3.76Å; I187-Y223 HydrophobicContact CD1-CE1 3.69Å; I187-Y223 HydrophobicContact CD1-CE2 3.66Å; I187-Y223 HydrophobicContact CD1-CG 3.83Å; I187-Y223 HydrophobicContact CG1-CD1 3.98Å; I187-Y223 HydrophobicContact CG1-CE1 3.93Å; I187-Y223 HydrophobicContact CG1-CG 4.41Å; I187-K227 PolarHBondContact O-N 2.95Å; I187-K227 VanDerWaalsContact O-N 3.14Å
188	N	98.1	Very high	97.6	Very high	5 Å²	5	39.2 Å²	39.2	3%	0.027	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	122.7	164.6	-70.5	50.8	0	0	0	109.2	R135 V165 T166 T167 K227	R135-N188 VanDerWaalsContact CZ-OD1 3.25Å; R135-N188 PolarHBondContact NH1-OD1 3.39Å; R135-N188 PolarHBondContact NH2-OD1 2.71Å; V165-N188 PolarHBondContact O-N 3.37Å; T166-N188 CarbonylContact C-O 3.4Å; T166-N188 WeakPolarHBondContact CA-O 3.18Å; T166-N188 HydrophobicContact CG2-CB 4.38Å; T167-N188 PolarHBondContact N-O 2.89Å; N188-K227 CarbonylContact C-O 3.6Å; N188-K227 WeakPolarHBondContact CA-O 3.33Å; N188-K227 HydrophobicContact CB-CB 4.41Å; N188-K227 WeakPolarHBondContact OD1-CD 3.22Å
189	I	98.5	Very high	97.6	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	126.2	179.2	-56	175.3	0	0	0	107.9	T167 L172 I187 V211 I215 V226 K227 I228 N229	T167-I189 HydrophobicContact CG2-CG1 4.49Å; T167-I189 CarbonylContact O-C 3.6Å; T167-I189 WeakPolarHBondContact O-CA 3.43Å; L172-I189 HydrophobicContact CD2-CD1 3.55Å; L172-I189 HydrophobicContact CD2-CG1 3.81Å; I187-I189 HydrophobicContact CG2-CD1 4.25Å; I187-I189 HydrophobicContact CG2-CG1 3.72Å; I189-V211 HydrophobicContact CG2-CG1 3.67Å; I189-I215 HydrophobicContact CD1-CB 4.36Å; I189-I215 HydrophobicContact CD1-CG1 3.55Å; I189-I215 HydrophobicContact CG2-CG1 4.28Å; I189-V226 HydrophobicContact CD1-CG1 3.93Å; I189-K227 PolarHBondContact N-O 3.38Å; I189-I228 CarbonylContact O-C 3.44Å; I189-I228 VanDerWaalsContact O-CA 3.3Å; I189-I228 WeakPolarHBondContact O-CA 3.29Å; I189-N229 PolarHBondContact O-N 3.38Å
190	S	98.2	Very high	97.6	Very high	33 Å²	33	36.6 Å²	36.6	23%	0.231	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	118.7	175	-50.9	0	0	0	0	109.2	T167 N229	T167-S190 PolarHBondContact O-N 3.05Å; S190-N229 WeakPolarHBondContact CA-O 3.31Å
191	L	98.1	Very high	97.5	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.215	C	C	.	.			trans	-146.1	110.4	179.2	179.4	66.6	0	0	0	108.7	S193 L194 F199 F208 V211 M212 I215 I228 N229 C230 F244	L191-S193 WeakPolarHBondContact CD1-O 3.44Å; L191-L194 HydrophobicContact CD2-CD2 3.87Å; L191-F199 HydrophobicContact CD1-CD2 3.66Å; L191-F199 HydrophobicContact CD1-CE2 3.81Å; L191-F208 HydrophobicContact CD1-CD2 4.3Å; L191-F208 HydrophobicContact CD1-CE2 4.33Å; L191-V211 HydrophobicContact CB-CG1 4.46Å; L191-V211 HydrophobicContact CD1-CG1 4.07Å; L191-M212 HydrophobicContact CD2-SD 3.74Å; L191-I215 HydrophobicContact CD2-CD1 3.8Å; L191-I228 HydrophobicContact CB-CG2 3.91Å; L191-N229 PolarHBondContact N-O 3.01Å; L191-C230 WeakPolarHBondContact O-CB 3.3Å; L191-F244 HydrophobicContact CD2-CE1 4.24Å; L191-F244 HydrophobicContact CG-CE1 4.35Å; L191-F244 HydrophobicContact CG-CZ 4.34Å; L191-F244 WeakPolarHBondContact O-CZ 3.48Å
192	D	97.6	Very high	97.4	Very high	4 Å²	4	31 Å²	31	2%	0.021	18%	0.181	C	C	.	.			trans	-98.8	-4.7	-173	-56.2	-56.9	0	0	0	113.7	Y98 V202 V231 N237	Y98-D192 WeakPolarHBondContact CE1-OD2 3.43Å; Y98-D192 PolarHBondContact OH-OD2 3.28Å; D192-V202 HydrophobicContact CB-CG1 4.23Å; D192-V231 PolarHBondContact OD1-N 3.41Å; D192-N237 WeakPolarHBondContact O-CB 3.14Å; D192-N237 PolarHBondContact O-ND2 3.43Å
193	S	97.9	Very high	97.2	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	18%	0.175	C	C	.	.			trans	-157.1	142.6	176.7	178.7	0	0	0	0	110.6	L191 V195 K198 F208 E240	L191-S193 WeakPolarHBondContact CD1-O 3.44Å; S193-V195 PolarHBondContact OG-N 3.41Å; S193-V195 VanDerWaalsContact OG-N 3.09Å; S193-V195 PolarHBondContact OG-O 3.38Å; S193-K198 WeakPolarHBondContact OG-CB 3.32Å; S193-F208 WeakPolarHBondContact O-CE2 3.36Å; S193-E240 WeakPolarHBondContact CA-OE2 3.45Å; S193-E240 WeakPolarHBondContact CB-OE1 3.49Å; S193-E240 PolarHBondContact OG-OE1 3.45Å; S193-E240 PolarHBondContact OG-OE2 2.78Å
194	L	97.8	Very high	97.2	Very high	38 Å²	38	32.9 Å²	32.9	20%	0.199	18%	0.177	C	C	.	.	S	Bend	trans	-89.1	-10.4	170.9	-62.2	179.5	0	0	0	112	L191 F208 M212 E240 D243 F244 L247	L191-L194 HydrophobicContact CD2-CD2 3.87Å; L194-F208 WeakPolarHBondContact O-CE2 3.28Å; L194-F208 WeakPolarHBondContact O-CZ 3.06Å; L194-M212 HydrophobicContact CD2-SD 4.45Å; L194-E240 PolarHBondContact N-OE2 3.23Å; L194-D243 HydrophobicContact CD1-CB 3.82Å; L194-F244 HydrophobicContact CD1-CD1 4.07Å; L194-F244 HydrophobicContact CD1-CD2 4.3Å; L194-F244 HydrophobicContact CD1-CE1 4.31Å; L194-F244 HydrophobicContact CD1-CG 4.07Å; L194-F244 HydrophobicContact CD2-CD1 4.16Å; L194-F244 HydrophobicContact CD2-CE1 3.7Å; L194-F244 HydrophobicContact CD2-CZ 4Å; L194-F244 HydrophobicContact CG-CD1 4.08Å; L194-F244 HydrophobicContact CG-CD2 4.25Å; L194-F244 HydrophobicContact CG-CE1 3.81Å; L194-F244 HydrophobicContact CG-CE2 3.99Å; L194-F244 HydrophobicContact CG-CG 4.3Å; L194-F244 HydrophobicContact CG-CZ 3.76Å; L194-L247 HydrophobicContact CD2-CD2 4.15Å
195	V	98	Very high	97	Very high	60 Å²	60	38.6 Å²	38.6	36%	0.364	20%	0.198	S	C	.	.	S	Bend	trans	-90.2	117.9	174.2	178.7	0	0	0	0	110	S193 A197 K198 F199 E240	S193-V195 PolarHBondContact OG-N 3.41Å; S193-V195 VanDerWaalsContact OG-N 3.09Å; S193-V195 PolarHBondContact OG-O 3.38Å; V195-A197 VanDerWaalsContact C-N 3.3Å; V195-A197 PolarHBondContact O-N 3.4Å; V195-A197 VanDerWaalsContact O-N 3.16Å; V195-K198 HydrophobicContact CB-CB 4.13Å; V195-K198 HydrophobicContact CB-CD 4.1Å; V195-K198 HydrophobicContact CB-CG 4.2Å; V195-K198 HydrophobicContact CG1-CB 4.39Å; V195-K198 HydrophobicContact CG1-CD 4.47Å; V195-K198 HydrophobicContact CG1-CG 4.19Å; V195-K198 HydrophobicContact CG2-CD 4.42Å; V195-K198 PolarHBondContact O-N 2.84Å; V195-K198 VanDerWaalsContact O-N 3.09Å; V195-F199 PolarHBondContact O-N 3.15Å; V195-E240 PolarHBondContact N-OE2 2.79Å
196	P	97.7	Very high	96.9	Very high	51 Å²	51	43.8 Å²	43.8	33%	0.331	22%	0.218	S	C	.	.	H	α-helix	trans	-53.9	-41.4	-175.2	-25.9	30.3	0	0	0	114.4	F199 E200 F208	P196-F199 WeakPolarHBondContact O-CB 3.41Å; P196-F199 PolarHBondContact O-N 3.06Å; P196-E200 WeakPolarHBondContact O-CG 3.42Å; P196-E200 PolarHBondContact O-N 2.86Å; P196-F208 HydrophobicContact CB-CB 4.31Å; P196-F208 HydrophobicContact CB-CD1 4.02Å; P196-F208 HydrophobicContact CB-CG 4.16Å; P196-F208 HydrophobicContact CG-CD1 3.62Å; P196-F208 HydrophobicContact CG-CE1 3.82Å; P196-F208 HydrophobicContact CG-CG 4.19Å
197	A	97.3	Very high	96.9	Very high	73 Å²	73	42.7 Å²	42.7	60%	0.603	22%	0.215	S	C	*	.	H	α-helix	trans	-66.8	-41.4	-179.8	0	0	0	0	0	112.5	V195 E200 F201	V195-A197 VanDerWaalsContact C-N 3.3Å; V195-A197 PolarHBondContact O-N 3.4Å; V195-A197 VanDerWaalsContact O-N 3.16Å; A197-E200 PolarHBondContact O-N 3.41Å; A197-F201 WeakPolarHBondContact O-CB 3.1Å; A197-F201 PolarHBondContact O-N 3.27Å
198	K	97.2	Very high	96.9	Very high	50 Å²	50	43.6 Å²	43.6	22%	0.217	22%	0.219	C	C	.	.	H	α-helix	trans	-68.4	-41.3	175.2	-73	-176.8	-179.9	-172.9	0	111	S193 V195 E200 F201 V202 L236 D239 E240	S193-K198 WeakPolarHBondContact OG-CB 3.32Å; V195-K198 HydrophobicContact CB-CB 4.13Å; V195-K198 HydrophobicContact CB-CD 4.1Å; V195-K198 HydrophobicContact CB-CG 4.2Å; V195-K198 HydrophobicContact CG1-CB 4.39Å; V195-K198 HydrophobicContact CG1-CD 4.47Å; V195-K198 HydrophobicContact CG1-CG 4.19Å; V195-K198 HydrophobicContact CG2-CD 4.42Å; V195-K198 PolarHBondContact O-N 2.84Å; V195-K198 VanDerWaalsContact O-N 3.09Å; K198-E200 VanDerWaalsContact C-N 3.35Å; K198-E200 PolarHBondContact O-N 2.66Å; K198-F201 WeakPolarHBondContact O-CB 3.39Å; K198-F201 PolarHBondContact O-N 2.8Å; K198-F201 VanDerWaalsContact O-N 3.16Å; K198-V202 WeakPolarHBondContact O-CG2 3.37Å; K198-V202 PolarHBondContact O-N 2.76Å; K198-L236 WeakPolarHBondContact CD-O 3.3Å; K198-L236 WeakPolarHBondContact CE-O 3.27Å; K198-L236 PolarHBondContact NZ-O 2.71Å; K198-L236 VanDerWaalsContact NZ-O 3.17Å; K198-D239 IonicContact NZ-OD1 3.27Å; K198-D239 PolarHBondContact NZ-OD1 3.38Å; K198-D239 IonicContact NZ-OD2 2.78Å; K198-D239 PolarHBondContact NZ-OD2 3.14Å; K198-E240 WeakPolarHBondContact CD-OE1 3.33Å; K198-E240 IonicContact NZ-OE1 3.23Å; K198-E240 PolarHBondContact NZ-OE1 3.23Å
199	F	97.7	Very high	96.9	Very high	4 Å²	4	50 Å²	50	2%	0.018	25%	0.249	C	C	.	.	H	α-helix	trans	-52.5	-53.3	171.3	173.2	-87.6	0	0	0	111.1	L191 V195 P196 F201 V202 V203 F208 V211	L191-F199 HydrophobicContact CD1-CD2 3.66Å; L191-F199 HydrophobicContact CD1-CE2 3.81Å; V195-F199 PolarHBondContact O-N 3.15Å; P196-F199 WeakPolarHBondContact O-CB 3.41Å; P196-F199 PolarHBondContact O-N 3.06Å; F199-F201 VanDerWaalsContact C-N 3.28Å; F199-F201 PolarHBondContact O-N 3.27Å; F199-V202 PolarHBondContact O-N 2.77Å; F199-V202 VanDerWaalsContact O-N 3.17Å; F199-V203 HydrophobicContact CD1-CG2 3.96Å; F199-V203 HydrophobicContact CD2-CG1 4.47Å; F199-V203 HydrophobicContact CE1-CG2 3.5Å; F199-V203 HydrophobicContact CE2-CG1 4.19Å; F199-V203 HydrophobicContact CE2-CG2 4.38Å; F199-V203 HydrophobicContact CZ-CG1 4.32Å; F199-V203 HydrophobicContact CZ-CG2 3.76Å; F199-V203 WeakPolarHBondContact O-CG2 3.24Å; F199-V203 PolarHBondContact O-N 3.37Å; F199-F208 HydrophobicContact CB-CB 4.39Å; F199-F208 HydrophobicContact CB-CD2 4.04Å; F199-F208 HydrophobicContact CD1-CB 3.78Å; F199-F208 HydrophobicContact CD2-CD2 4.22Å; F199-F208 HydrophobicContact CE1-CB 4.24Å; F199-F208 VanDerWaalsContact CE1-N 3.34Å; F199-F208 HydrophobicContact CG-CB 4.03Å; F199-F208 HydrophobicContact CG-CD2 4.05Å; F199-V211 HydrophobicContact CE2-CG2 4.24Å; F199-V211 HydrophobicContact CZ-CG2 4Å
200	E	96.6	Very high	96.9	Very high	68 Å²	68	55.6 Å²	55.6	32%	0.318	27%	0.273	S	S	.	.	H	α-helix	trans	-61	-37.4	179.3	-72.1	-170	-168.1	0	0	112.2	P196 A197 K198 R204 K206	P196-E200 WeakPolarHBondContact O-CG 3.42Å; P196-E200 PolarHBondContact O-N 2.86Å; A197-E200 PolarHBondContact O-N 3.41Å; K198-E200 VanDerWaalsContact C-N 3.35Å; K198-E200 PolarHBondContact O-N 2.66Å; E200-R204 WeakPolarHBondContact O-CA 3.42Å; E200-R204 PolarHBondContact O-N 2.77Å; E200-K206 WeakPolarHBondContact OE1-CG 3.44Å
201	F	95.4	Very high	96.9	Very high	123 Å²	123	54 Å²	54	54%	0.539	26%	0.262	S	S	.	.	H	α-helix	trans	-61.8	-47.6	174.2	178.5	-99.6	0	0	0	111.8	Q97 A197 K198 F199 L236	Q97-F201 PolarHBondContact NE2-O 3.15Å; A197-F201 WeakPolarHBondContact O-CB 3.1Å; A197-F201 PolarHBondContact O-N 3.27Å; K198-F201 WeakPolarHBondContact O-CB 3.39Å; K198-F201 PolarHBondContact O-N 2.8Å; K198-F201 VanDerWaalsContact O-N 3.16Å; F199-F201 VanDerWaalsContact C-N 3.28Å; F199-F201 PolarHBondContact O-N 3.27Å; F201-L236 HydrophobicContact CD1-CD1 3.73Å; F201-L236 HydrophobicContact CE1-CD1 3.84Å
202	V	94.5	Very high	96.9	Very high	2 Å²	2	55.5 Å²	55.5	1%	0.012	27%	0.269	C	S	.	.	H	α-helix	trans	-66.2	-48.4	-178.5	175.8	0	0	0	0	111.8	C96 Q97 Y98 D192 K198 F199 L236	C96-V202 VanDerWaalsContact CA-O 3.27Å; C96-V202 WeakPolarHBondContact CA-O 3.29Å; Q97-V202 PolarHBondContact N-O 3.21Å; Y98-V202 HydrophobicContact CD1-CG1 4.15Å; Y98-V202 HydrophobicContact CE1-CG1 3.78Å; D192-V202 HydrophobicContact CB-CG1 4.23Å; K198-V202 WeakPolarHBondContact O-CG2 3.37Å; K198-V202 PolarHBondContact O-N 2.76Å; F199-V202 PolarHBondContact O-N 2.77Å; F199-V202 VanDerWaalsContact O-N 3.17Å; V202-L236 HydrophobicContact CG2-CD1 3.82Å; V202-L236 HydrophobicContact CG2-CD2 3.64Å; V202-L236 HydrophobicContact CG2-CG 4.04Å
203	V	94.5	Very high	96.9	Very high	4 Å²	4	60 Å²	60	2%	0.024	29%	0.29	C	S	.	.	H	α-helix	trans	-94.2	-7.8	-172.2	-46.9	0	0	0	0	114.2	L94 R95 F199 R205	L94-V203 HydrophobicContact CB-CB 4.41Å; L94-V203 HydrophobicContact CD1-CB 3.96Å; L94-V203 HydrophobicContact CD1-CG1 4.15Å; L94-V203 HydrophobicContact CD1-CG2 4.27Å; L94-V203 HydrophobicContact CD2-CB 3.98Å; L94-V203 HydrophobicContact CD2-CG2 3.69Å; L94-V203 HydrophobicContact CG-CB 4.36Å; R95-V203 CarbonylContact C-O 3.59Å; R95-V203 PolarHBondContact N-O 2.85Å; F199-V203 HydrophobicContact CD1-CG2 3.96Å; F199-V203 HydrophobicContact CD2-CG1 4.47Å; F199-V203 HydrophobicContact CE1-CG2 3.5Å; F199-V203 HydrophobicContact CE2-CG1 4.19Å; F199-V203 HydrophobicContact CE2-CG2 4.38Å; F199-V203 HydrophobicContact CZ-CG1 4.32Å; F199-V203 HydrophobicContact CZ-CG2 3.76Å; F199-V203 WeakPolarHBondContact O-CG2 3.24Å; F199-V203 PolarHBondContact O-N 3.37Å; V203-R205 HydrophobicContact CG2-CB 4.42Å; V203-R205 VanDerWaalsContact CG2-O 3.31Å; V203-R205 WeakPolarHBondContact CG2-O 3.41Å; V203-R205 PolarHBondContact O-N 2.94Å
204	R	94.6	Very high	96.9	Very high	75 Å²	75	60 Å²	60	28%	0.283	29%	0.29	S	S	.	.	S	Bend	trans	57.9	27	-179.6	-55	178	175.5	148.6	-14.2	114.6	R95 E200	R95-R204 HydrophobicContact CB-CB 4.15Å; R95-R204 WeakPolarHBondContact O-CD 2.99Å; E200-R204 WeakPolarHBondContact O-CA 3.42Å; E200-R204 PolarHBondContact O-N 2.77Å
205	R	95	Very high	96.9	Very high	128 Å²	128	58.2 Å²	58.2	48%	0.483	28%	0.28	S	S	.	.	S	Bend	trans	-151.8	150.4	179.7	-65.8	-65.8	-179.8	-108.4	10.1	110.4	L94 V203	L94-R205 HydrophobicContact CD2-CB 3.63Å; L94-R205 HydrophobicContact CD2-CG 4Å; V203-R205 HydrophobicContact CG2-CB 4.42Å; V203-R205 VanDerWaalsContact CG2-O 3.31Å; V203-R205 WeakPolarHBondContact CG2-O 3.41Å; V203-R205 PolarHBondContact O-N 2.94Å
206	K	95.8	Very high	96.9	Very high	166 Å²	166	57.9 Å²	57.9	72%	0.722	28%	0.277	S	S	*	.			trans	-69.5	149.1	168.5	-51.2	-158.4	169.8	-178.6	0	110.5	E200	E200-K206 WeakPolarHBondContact OE1-CG 3.44Å
207	G	96.1	Very high	97	Very high	11 Å²	11	58.4 Å²	58.4	11%	0.113	27%	0.274	C	S	.	.			trans	161.2	-8.1	177.7	0	0	0	0	0	115.9	H209 K210 V211	G207-H209 PolarHBondContact O-N 3.21Å; G207-K210 WeakPolarHBondContact O-CB 3.43Å; G207-K210 PolarHBondContact O-N 2.92Å; G207-V211 PolarHBondContact O-N 3.25Å; G207-V211 VanDerWaalsContact O-N 3.13Å
208	F	98.2	Very high	97	Very high	21 Å²	21	54.9 Å²	54.9	9%	0.092	25%	0.245	C	C	.	.	H	α-helix	trans	-45	-54.6	-175.1	176.7	-101.5	0	0	0	113.6	L191 S193 L194 P196 F199 K210 V211 M212	L191-F208 HydrophobicContact CD1-CD2 4.3Å; L191-F208 HydrophobicContact CD1-CE2 4.33Å; S193-F208 WeakPolarHBondContact O-CE2 3.36Å; L194-F208 WeakPolarHBondContact O-CE2 3.28Å; L194-F208 WeakPolarHBondContact O-CZ 3.06Å; P196-F208 HydrophobicContact CB-CB 4.31Å; P196-F208 HydrophobicContact CB-CD1 4.02Å; P196-F208 HydrophobicContact CB-CG 4.16Å; P196-F208 HydrophobicContact CG-CD1 3.62Å; P196-F208 HydrophobicContact CG-CE1 3.82Å; P196-F208 HydrophobicContact CG-CG 4.19Å; F199-F208 HydrophobicContact CB-CB 4.39Å; F199-F208 HydrophobicContact CB-CD2 4.04Å; F199-F208 HydrophobicContact CD1-CB 3.78Å; F199-F208 HydrophobicContact CD2-CD2 4.22Å; F199-F208 HydrophobicContact CE1-CB 4.24Å; F199-F208 VanDerWaalsContact CE1-N 3.34Å; F199-F208 HydrophobicContact CG-CB 4.03Å; F199-F208 HydrophobicContact CG-CD2 4.05Å; F208-K210 VanDerWaalsContact C-N 3.28Å; F208-K210 PolarHBondContact O-N 2.98Å; F208-V211 WeakPolarHBondContact O-CB 3.36Å; F208-V211 PolarHBondContact O-N 2.77Å; F208-M212 HydrophobicContact CD1-CG 4.31Å; F208-M212 HydrophobicContact CD2-CG 4.45Å; F208-M212 HydrophobicContact CE1-CG 3.79Å; F208-M212 HydrophobicContact CE2-CG 3.91Å; F208-M212 HydrophobicContact CE2-SD 4.09Å; F208-M212 HydrophobicContact CZ-CG 3.56Å; F208-M212 HydrophobicContact CZ-SD 4.01Å; F208-M212 PolarHBondContact O-N 3.28Å
209	H	98	Very high	97	Very high	140 Å²	140	54.2 Å²	54.2	65%	0.648	25%	0.245	S	C	*	.	H	α-helix	trans	-61.7	-33.2	-178.6	-62	-65.8	0	0	0	113.6	G207 M212 E213	G207-H209 PolarHBondContact O-N 3.21Å; H209-M212 PolarHBondContact O-N 2.7Å; H209-E213 WeakPolarHBondContact O-CB 3.34Å; H209-E213 PolarHBondContact O-N 3.13Å
210	K	97.9	Very high	96.9	Very high	116 Å²	116	61.4 Å²	61.4	50%	0.504	28%	0.279	S	S	.	.	H	α-helix	trans	-69.4	-34.9	175.4	-64.3	-176	174.2	-176.2	0	112	I170 G207 F208 S214	I170-K210 HydrophobicContact CG2-CD 4.22Å; G207-K210 WeakPolarHBondContact O-CB 3.43Å; G207-K210 PolarHBondContact O-N 2.92Å; F208-K210 VanDerWaalsContact C-N 3.28Å; F208-K210 PolarHBondContact O-N 2.98Å; K210-S214 WeakPolarHBondContact O-CB 3.25Å; K210-S214 PolarHBondContact O-N 3.32Å; K210-S214 PolarHBondContact O-OG 3.14Å
211	V	98.3	Very high	96.9	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-67.7	-45.1	175.5	-176.9	0	0	0	0	109.9	N168 I170 I189 L191 F199 G207 F208 S214 I215	N168-V211 VanDerWaalsContact O-CG2 3.25Å; N168-V211 WeakPolarHBondContact O-CG2 3.22Å; I170-V211 HydrophobicContact CG1-CG2 3.93Å; I189-V211 HydrophobicContact CG2-CG1 3.67Å; L191-V211 HydrophobicContact CB-CG1 4.46Å; L191-V211 HydrophobicContact CD1-CG1 4.07Å; F199-V211 HydrophobicContact CE2-CG2 4.24Å; F199-V211 HydrophobicContact CZ-CG2 4Å; G207-V211 PolarHBondContact O-N 3.25Å; G207-V211 VanDerWaalsContact O-N 3.13Å; F208-V211 WeakPolarHBondContact O-CB 3.36Å; F208-V211 PolarHBondContact O-N 2.77Å; V211-S214 WeakPolarHBondContact O-CB 3.42Å; V211-S214 PolarHBondContact O-N 3.02Å; V211-S214 VanDerWaalsContact O-N 3.14Å; V211-I215 HydrophobicContact CG1-CD1 4.24Å; V211-I215 WeakPolarHBondContact O-CG1 3.39Å; V211-I215 PolarHBondContact O-N 2.49Å
212	M	98.3	Very high	96.9	Very high	31 Å²	31	57.3 Å²	57.3	15%	0.153	28%	0.277	C	S	.	.	H	α-helix	trans	-61.8	-46	175.8	-65.2	-52.3	-62.6	0	0	112.3	L191 L194 F208 H209 S214 I215 D216	L191-M212 HydrophobicContact CD2-SD 3.74Å; L194-M212 HydrophobicContact CD2-SD 4.45Å; F208-M212 HydrophobicContact CD1-CG 4.31Å; F208-M212 HydrophobicContact CD2-CG 4.45Å; F208-M212 HydrophobicContact CE1-CG 3.79Å; F208-M212 HydrophobicContact CE2-CG 3.91Å; F208-M212 HydrophobicContact CE2-SD 4.09Å; F208-M212 HydrophobicContact CZ-CG 3.56Å; F208-M212 HydrophobicContact CZ-SD 4.01Å; F208-M212 PolarHBondContact O-N 3.28Å; H209-M212 PolarHBondContact O-N 2.7Å; M212-S214 PolarHBondContact O-N 2.98Å; M212-I215 WeakPolarHBondContact O-CB 3.25Å; M212-I215 PolarHBondContact O-N 2.79Å; M212-I215 VanDerWaalsContact O-N 3.14Å; M212-I215 HydrophobicContact SD-CD1 3.94Å; M212-D216 PolarHBondContact O-N 3.12Å
213	E	98.3	Very high	97	Very high	99 Å²	99	57.9 Å²	57.9	46%	0.463	28%	0.28	S	S	.	.	H	α-helix	trans	-55.9	-40.3	172.6	-174.6	-158.9	141.5	0	0	111.5	S173 H209 D216 K217	S173-E213 VanDerWaalsContact CB-OE1 3.22Å; S173-E213 WeakPolarHBondContact CB-OE1 3.44Å; S173-E213 PolarHBondContact OG-OE1 3.17Å; H209-E213 WeakPolarHBondContact O-CB 3.34Å; H209-E213 PolarHBondContact O-N 3.13Å; E213-D216 PolarHBondContact O-N 3.05Å; E213-K217 VanDerWaalsContact O-CB 3.23Å; E213-K217 WeakPolarHBondContact O-CB 3.39Å; E213-K217 PolarHBondContact O-N 3.03Å
214	S	98.3	Very high	96.8	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-69.7	-35	178.9	-62	0	0	0	0	113.3	G169 S173 K210 V211 M212 A218	G169-S214 WeakPolarHBondContact O-CB 3.47Å; G169-S214 PolarHBondContact O-OG 2.75Å; S173-S214 WeakPolarHBondContact CB-OG 3.4Å; S173-S214 PolarHBondContact N-OG 3.45Å; K210-S214 WeakPolarHBondContact O-CB 3.25Å; K210-S214 PolarHBondContact O-N 3.32Å; K210-S214 PolarHBondContact O-OG 3.14Å; V211-S214 WeakPolarHBondContact O-CB 3.42Å; V211-S214 PolarHBondContact O-N 3.02Å; V211-S214 VanDerWaalsContact O-N 3.14Å; M212-S214 PolarHBondContact O-N 2.98Å; S214-A218 WeakPolarHBondContact O-CB 3.32Å; S214-A218 PolarHBondContact O-N 3Å
215	I	98.3	Very high	96.7	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-63.4	-50.6	173.1	-70.1	161	0	0	0	109.3	I189 L191 V211 M212 A218 V219 I228 L253	I189-I215 HydrophobicContact CD1-CB 4.36Å; I189-I215 HydrophobicContact CD1-CG1 3.55Å; I189-I215 HydrophobicContact CG2-CG1 4.28Å; L191-I215 HydrophobicContact CD2-CD1 3.8Å; V211-I215 HydrophobicContact CG1-CD1 4.24Å; V211-I215 WeakPolarHBondContact O-CG1 3.39Å; V211-I215 PolarHBondContact O-N 2.49Å; M212-I215 WeakPolarHBondContact O-CB 3.25Å; M212-I215 PolarHBondContact O-N 2.79Å; M212-I215 VanDerWaalsContact O-N 3.14Å; M212-I215 HydrophobicContact SD-CD1 3.94Å; I215-A218 PolarHBondContact O-N 2.94Å; I215-V219 WeakPolarHBondContact O-CG2 3.41Å; I215-V219 PolarHBondContact O-N 3.03Å; I215-V219 VanDerWaalsContact O-N 3.08Å; I215-I228 HydrophobicContact CD1-CD1 3.8Å; I215-I228 HydrophobicContact CD1-CG1 4.27Å; I215-I228 HydrophobicContact CG1-CD1 4.34Å; I215-I228 HydrophobicContact CG2-CD1 4.28Å; I215-L253 HydrophobicContact CG2-CD1 4.08Å; I215-L253 HydrophobicContact CG2-CD2 3.78Å
216	D	97.8	Very high	96.7	Very high	53 Å²	53	55.3 Å²	55.3	28%	0.283	28%	0.282	S	S	.	.	H	α-helix	trans	-63.3	-47.8	-177	-69.2	-22.2	0	0	0	111.2	M212 E213 A218 V219 E220 K251	M212-D216 PolarHBondContact O-N 3.12Å; E213-D216 PolarHBondContact O-N 3.05Å; D216-A218 VanDerWaalsContact C-N 3.31Å; D216-A218 PolarHBondContact O-N 3Å; D216-V219 WeakPolarHBondContact O-CB 3.45Å; D216-V219 PolarHBondContact O-N 3.29Å; D216-V219 VanDerWaalsContact O-N 3.13Å; D216-E220 WeakPolarHBondContact O-CG 3.47Å; D216-E220 PolarHBondContact O-N 3.14Å; D216-K251 WeakPolarHBondContact OD1-CE 3.35Å; D216-K251 IonicContact OD1-NZ 3.11Å; D216-K251 PolarHBondContact OD1-NZ 3.11Å; D216-K251 IonicContact OD2-NZ 3.85Å
217	K	98.1	Very high	96.8	Very high	62 Å²	62	48.1 Å²	48.1	27%	0.27	25%	0.251	S	S	.	.	H	α-helix	trans	-63.7	-33.9	177.1	-170	172.2	-176.1	178.5	0	113.3	S173 L176 E213 E220 L221	S173-K217 WeakPolarHBondContact O-CD 3.14Å; S173-K217 WeakPolarHBondContact O-CE 3.37Å; S173-K217 PolarHBondContact O-NZ 3.18Å; L176-K217 HydrophobicContact CD1-CB 3.77Å; L176-K217 HydrophobicContact CD1-CD 4.1Å; L176-K217 HydrophobicContact CD1-CG 3.73Å; E213-K217 VanDerWaalsContact O-CB 3.23Å; E213-K217 WeakPolarHBondContact O-CB 3.39Å; E213-K217 PolarHBondContact O-N 3.03Å; K217-E220 PolarHBondContact O-N 2.9Å; K217-L221 HydrophobicContact CG-CD1 4.21Å; K217-L221 WeakPolarHBondContact O-CB 3.5Å; K217-L221 WeakPolarHBondContact O-CG 3.33Å; K217-L221 PolarHBondContact O-N 2.76Å
218	A	98	Very high	97	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-66.3	-41.3	175.2	0	0	0	0	0	111	L176 I187 S214 I215 D216 L221 G222 Y223 V226	L176-A218 HydrophobicContact CD1-CB 4.02Å; L176-A218 HydrophobicContact CD2-CB 4.08Å; I187-A218 HydrophobicContact CD1-CB 4.36Å; S214-A218 WeakPolarHBondContact O-CB 3.32Å; S214-A218 PolarHBondContact O-N 3Å; I215-A218 PolarHBondContact O-N 2.94Å; D216-A218 VanDerWaalsContact C-N 3.31Å; D216-A218 PolarHBondContact O-N 3Å; A218-L221 PolarHBondContact O-N 3.35Å; A218-G222 PolarHBondContact O-N 3.21Å; A218-Y223 HydrophobicContact CB-CD2 4.18Å; A218-Y223 WeakPolarHBondContact O-CB 3.31Å; A218-Y223 WeakPolarHBondContact O-CD2 3.33Å; A218-Y223 PolarHBondContact O-N 2.62Å; A218-Y223 VanDerWaalsContact O-N 3.11Å; A218-V226 HydrophobicContact CB-CG1 4.33Å; A218-V226 HydrophobicContact CB-CG2 3.67Å
219	V	97	Very high	97	Very high	35 Å²	35	47.5 Å²	47.5	21%	0.212	25%	0.246	C	C	.	.	H	α-helix	trans	-63.4	-45.9	174	171.7	0	0	0	0	111	I215 D216 L221 G222 V226 P252 L253	I215-V219 WeakPolarHBondContact O-CG2 3.41Å; I215-V219 PolarHBondContact O-N 3.03Å; I215-V219 VanDerWaalsContact O-N 3.08Å; D216-V219 WeakPolarHBondContact O-CB 3.45Å; D216-V219 PolarHBondContact O-N 3.29Å; D216-V219 VanDerWaalsContact O-N 3.13Å; V219-L221 VanDerWaalsContact C-N 3.29Å; V219-L221 PolarHBondContact O-N 2.96Å; V219-G222 WeakPolarHBondContact O-CA 3.46Å; V219-G222 PolarHBondContact O-N 2.82Å; V219-V226 HydrophobicContact CG2-CB 4.23Å; V219-V226 HydrophobicContact CG2-CG2 3.84Å; V219-P252 HydrophobicContact CG1-CG 3.78Å; V219-L253 HydrophobicContact CG2-CD2 3.63Å
220	E	96.8	Very high	97	Very high	156 Å²	156	40.9 Å²	40.9	73%	0.729	22%	0.216	S	C	*	.	H	α-helix	trans	-59.2	-38.8	177.8	-72.6	169	-176.3	0	0	112.7	D216 K217 G222	D216-E220 WeakPolarHBondContact O-CG 3.47Å; D216-E220 PolarHBondContact O-N 3.14Å; K217-E220 PolarHBondContact O-N 2.9Å; E220-G222 PolarHBondContact O-N 2.8Å
221	L	96.5	Very high	96.9	Very high	47 Å²	47	36.3 Å²	36.3	25%	0.246	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.9	3.9	175.5	-70	173.4	0	0	0	113.4	L176 K180 K217 A218 V219 Y223	L176-L221 HydrophobicContact CB-CD1 3.65Å; L176-L221 HydrophobicContact CD1-CD1 4.3Å; L176-L221 HydrophobicContact CG-CD1 4.4Å; K180-L221 HydrophobicContact CD-CB 4.49Å; K180-L221 PolarHBondContact NZ-O 2.85Å; K217-L221 HydrophobicContact CG-CD1 4.21Å; K217-L221 WeakPolarHBondContact O-CB 3.5Å; K217-L221 WeakPolarHBondContact O-CG 3.33Å; K217-L221 PolarHBondContact O-N 2.76Å; A218-L221 PolarHBondContact O-N 3.35Å; V219-L221 VanDerWaalsContact C-N 3.29Å; V219-L221 PolarHBondContact O-N 2.96Å; L221-Y223 HydrophobicContact CB-CD2 4.27Å; L221-Y223 HydrophobicContact CB-CE2 4.38Å
222	G	95.4	Very high	96.9	Very high	57 Å²	57	36.3 Å²	36.3	59%	0.588	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	81.5	17.2	172.2	0	0	0	0	0	114.7	A218 V219 E220 N224	A218-G222 PolarHBondContact O-N 3.21Å; V219-G222 WeakPolarHBondContact O-CA 3.46Å; V219-G222 PolarHBondContact O-N 2.82Å; E220-G222 PolarHBondContact O-N 2.8Å; G222-N224 PolarHBondContact O-N 2.81Å
223	Y	95.8	Very high	96.8	Very high	15 Å²	15	35.5 Å²	35.5	6%	0.059	19%	0.194	C	C	.	.			trans	-63.7	121.5	168.4	-75.8	-81	0	0	0	109	L176 K180 L184 I187 A218 L221 V226	L176-Y223 HydrophobicContact CD2-CD2 4.13Å; L176-Y223 HydrophobicContact CD2-CE2 3.61Å; K180-Y223 WeakPolarHBondContact CA-OH 3.35Å; K180-Y223 PolarHBondContact N-OH 3.48Å; L184-Y223 VanDerWaalsContact O-CE1 3.31Å; L184-Y223 WeakPolarHBondContact O-CE1 3.3Å; L184-Y223 PolarHBondContact O-OH 3.23Å; I187-Y223 HydrophobicContact CD1-CD1 3.8Å; I187-Y223 HydrophobicContact CD1-CD2 3.76Å; I187-Y223 HydrophobicContact CD1-CE1 3.69Å; I187-Y223 HydrophobicContact CD1-CE2 3.66Å; I187-Y223 HydrophobicContact CD1-CG 3.83Å; I187-Y223 HydrophobicContact CG1-CD1 3.98Å; I187-Y223 HydrophobicContact CG1-CE1 3.93Å; I187-Y223 HydrophobicContact CG1-CG 4.41Å; A218-Y223 HydrophobicContact CB-CD2 4.18Å; A218-Y223 WeakPolarHBondContact O-CB 3.31Å; A218-Y223 WeakPolarHBondContact O-CD2 3.33Å; A218-Y223 PolarHBondContact O-N 2.62Å; A218-Y223 VanDerWaalsContact O-N 3.11Å; L221-Y223 HydrophobicContact CB-CD2 4.27Å; L221-Y223 HydrophobicContact CB-CE2 4.38Å; Y223-V226 WeakPolarHBondContact O-CG2 3.37Å
224	N	91.5	Very high	96.7	Very high	121 Å²	121	36.2 Å²	36.2	65%	0.647	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-139.6	118.2	-178.3	-170.8	8.7	0	0	0	112.3	G222	G222-N224 PolarHBondContact O-N 2.81Å
225	P	90.6	Very high	96.5	Very high	31 Å²	31	39.6 Å²	39.6	20%	0.201	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	cis	-84.2	142.3	-8.4	29.3	-26.8	0	0	0	111.3	K227 E254	P225-K227 PolarHBondContact O-N 3Å; P225-K227 PolarHBondContact O-NZ 2.86Å; P225-E254 HydrophobicContact CB-CB 4.02Å; P225-E254 HydrophobicContact CG-CB 4.35Å
226	V	96.6	Very high	96.3	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	120.3	160.1	177.8	0	0	0	0	107.6	I189 A218 V219 Y223 L253 E254	I189-V226 HydrophobicContact CD1-CG1 3.93Å; A218-V226 HydrophobicContact CB-CG1 4.33Å; A218-V226 HydrophobicContact CB-CG2 3.67Å; V219-V226 HydrophobicContact CG2-CB 4.23Å; V219-V226 HydrophobicContact CG2-CG2 3.84Å; Y223-V226 WeakPolarHBondContact O-CG2 3.37Å; V226-L253 HydrophobicContact CB-CD2 3.78Å; V226-L253 HydrophobicContact CG1-CD2 4.05Å; V226-E254 PolarHBondContact O-N 3.05Å
227	K	97.9	Very high	96.3	Very high	15 Å²	15	38.4 Å²	38.4	7%	0.065	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	130.9	-176.4	-68.5	165.3	-176.6	76	0	110.1	I187 N188 I189 P225 E254	I187-K227 PolarHBondContact O-N 2.95Å; I187-K227 VanDerWaalsContact O-N 3.14Å; N188-K227 CarbonylContact C-O 3.6Å; N188-K227 WeakPolarHBondContact CA-O 3.33Å; N188-K227 HydrophobicContact CB-CB 4.41Å; N188-K227 WeakPolarHBondContact OD1-CD 3.22Å; I189-K227 PolarHBondContact N-O 3.38Å; P225-K227 PolarHBondContact O-N 3Å; P225-K227 PolarHBondContact O-NZ 2.86Å; K227-E254 CarbonylContact C-O 3.55Å; K227-E254 VanDerWaalsContact CA-O 3.31Å; K227-E254 WeakPolarHBondContact CA-O 3.46Å; K227-E254 VanDerWaalsContact CE-OE2 3.27Å; K227-E254 WeakPolarHBondContact CE-OE2 3.28Å; K227-E254 HydrophobicContact CG-CB 4.03Å; K227-E254 HydrophobicContact CG-CG 4.37Å
228	I	98.5	Very high	96.2	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	125.7	170.5	-62.3	174.9	0	0	0	107.5	I189 L191 I215 F244 L247 L253 E254 V255 R256	I189-I228 CarbonylContact O-C 3.44Å; I189-I228 VanDerWaalsContact O-CA 3.3Å; I189-I228 WeakPolarHBondContact O-CA 3.29Å; L191-I228 HydrophobicContact CB-CG2 3.91Å; I215-I228 HydrophobicContact CD1-CD1 3.8Å; I215-I228 HydrophobicContact CD1-CG1 4.27Å; I215-I228 HydrophobicContact CG1-CD1 4.34Å; I215-I228 HydrophobicContact CG2-CD1 4.28Å; I228-F244 HydrophobicContact CG2-CE1 4.26Å; I228-L247 HydrophobicContact CD1-CD2 3.85Å; I228-L253 HydrophobicContact CD1-CD1 3.9Å; I228-E254 PolarHBondContact N-O 2.99Å; I228-V255 HydrophobicContact CB-CG2 4.23Å; I228-V255 HydrophobicContact CD1-CG2 4.28Å; I228-V255 CarbonylContact O-C 3.35Å; I228-R256 WeakPolarHBondContact O-CB 3.35Å; I228-R256 PolarHBondContact O-N 3.2Å
229	N	98.3	Very high	96.1	Very high	20 Å²	20	42.5 Å²	42.5	11%	0.107	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	123.4	173	-74.4	-13.4	0	0	0	108.4	I189 S190 L191 R256 I258	I189-N229 PolarHBondContact O-N 3.38Å; S190-N229 WeakPolarHBondContact CA-O 3.31Å; L191-N229 PolarHBondContact N-O 3.01Å; N229-R256 WeakPolarHBondContact OD1-CD 3.44Å; N229-I258 HydrophobicContact CB-CD1 3.82Å
230	C	98.1	Very high	96.2	Very high	1 Å²	1	41 Å²	41	1%	0.007	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	117.5	178.1	176.6	0	0	0	0	109.2	L191 F244 R256 F257 I258	L191-C230 WeakPolarHBondContact O-CB 3.3Å; C230-F244 HydrophobicContact CB-CZ 4.32Å; C230-R256 PolarHBondContact N-O 2.84Å; C230-F257 HydrophobicContact CB-CD1 4.35Å; C230-F257 CarbonylContact O-C 3.13Å; C230-F257 WeakPolarHBondContact O-CA 3.18Å; C230-I258 PolarHBondContact O-N 2.65Å
231	V	97.3	Very high	96.2	Very high	19 Å²	19	33.7 Å²	33.7	12%	0.115	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	115.1	172.1	-179.1	0	0	0	0	108.4	Y98 D192 M233 N237 I258 Y260	Y98-V231 HydrophobicContact CD2-CG2 4.45Å; Y98-V231 HydrophobicContact CE2-CG2 4.04Å; D192-V231 PolarHBondContact OD1-N 3.41Å; V231-M233 HydrophobicContact CG1-CG 4.39Å; V231-N237 PolarHBondContact O-ND2 2.88Å; V231-I258 WeakPolarHBondContact CA-O 3.08Å; V231-I258 HydrophobicContact CG2-CB 4.27Å; V231-Y260 HydrophobicContact CG1-CD2 4.2Å
232	V	97.5	Very high	96.3	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.006	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	125.8	-176	-173.5	0	0	0	0	109.6	N237 E238 L241 F257 I258 V274 M279	V232-N237 WeakPolarHBondContact CA-OD1 3.46Å; V232-E238 HydrophobicContact CG1-CB 4.11Å; V232-L241 HydrophobicContact CG1-CD2 4.24Å; V232-L241 HydrophobicContact CG1-CG 4.49Å; V232-L241 HydrophobicContact CG2-CD2 3.9Å; V232-F257 HydrophobicContact CG2-CB 4.02Å; V232-F257 HydrophobicContact CG2-CD1 3.76Å; V232-F257 HydrophobicContact CG2-CG 4.31Å; V232-I258 PolarHBondContact N-O 3.05Å; V232-V274 HydrophobicContact CG1-CB 4.05Å; V232-V274 HydrophobicContact CG1-CG2 4.01Å; V232-M279 HydrophobicContact CB-SD 3.83Å; V232-M279 HydrophobicContact CG1-SD 4.09Å; V232-M279 HydrophobicContact CG2-SD 3.72Å
233	M	95.9	Very high	96.4	Very high	14 Å²	14	35.8 Å²	35.8	7%	0.069	20%	0.198	C	C	.	.	B	Isolated β-bridge	trans	-132.6	131.7	-178.9	-70.8	177.6	-83.3	0	0	110	Y98 V231 L236 N237 Y260 K272	Y98-M233 HydrophobicContact CD1-CE 3.63Å; Y98-M233 HydrophobicContact CE1-CE 4.33Å; Y98-M233 HydrophobicContact CG-CE 4.38Å; V231-M233 HydrophobicContact CG1-CG 4.39Å; M233-L236 HydrophobicContact CB-CB 4.23Å; M233-L236 HydrophobicContact CB-CD2 4.09Å; M233-L236 HydrophobicContact CE-CD2 3.3Å; M233-L236 PolarHBondContact O-N 2.69Å; M233-L236 HydrophobicContact SD-CD2 4.08Å; M233-N237 PolarHBondContact N-OD1 3.26Å; M233-N237 PolarHBondContact O-N 3.08Å; M233-N237 PolarHBondContact O-OD1 3.27Å; M233-Y260 HydrophobicContact CG-CD1 4.36Å; M233-Y260 HydrophobicContact CG-CD2 3.92Å; M233-Y260 HydrophobicContact CG-CG 3.8Å; M233-Y260 HydrophobicContact SD-CD2 3.88Å; M233-Y260 HydrophobicContact SD-CE2 4.01Å; M233-Y260 HydrophobicContact SD-CG 4.3Å; M233-K272 CarbonylContact C-O 3.58Å; M233-K272 WeakPolarHBondContact CA-O 3.3Å
234	R	95.9	Very high	96.5	Very high	113 Å²	113	35.1 Å²	35.1	43%	0.426	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	138.6	176.7	-161.5	-178.6	-59.4	-123.5	-1.4	111.3	L236 E238 K271 K272 M273 V274 E278	R234-L236 VanDerWaalsContact C-N 3.32Å; R234-E238 WeakPolarHBondContact CA-OE2 3.43Å; R234-K271 WeakPolarHBondContact CD-O 3.45Å; R234-K271 PolarHBondContact NE-O 2.84Å; R234-K272 PolarHBondContact N-O 2.91Å; R234-M273 PolarHBondContact NE-O 2.81Å; R234-M273 PolarHBondContact NH2-O 2.87Å; R234-V274 HydrophobicContact CB-CG2 3.91Å; R234-E278 IonicContact CZ-OE1 3.88Å; R234-E278 IonicContact NH2-OE1 2.83Å; R234-E278 PolarHBondContact NH2-OE1 3Å; R234-E278 IonicContact NH2-OE2 2.96Å; R234-E278 PolarHBondContact NH2-OE2 3.31Å
235	G	94.6	Very high	96.9	Very high	71 Å²	71	29.4 Å²	29.4	73%	0.732	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.6	16.3	-174.8	0	0	0	0	0	113.8	E238	G235-E238 PolarHBondContact N-OE1 2.85Å; G235-E238 PolarHBondContact N-OE2 2.8Å
236	L	94.8	Very high	97.2	Very high	27 Å²	27	31.6 Å²	31.6	14%	0.141	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-136.8	-62.3	-174.3	179.9	67.2	0	0	0	112.8	K198 F201 V202 M233 R234 E238	K198-L236 WeakPolarHBondContact CD-O 3.3Å; K198-L236 WeakPolarHBondContact CE-O 3.27Å; K198-L236 PolarHBondContact NZ-O 2.71Å; K198-L236 VanDerWaalsContact NZ-O 3.17Å; F201-L236 HydrophobicContact CD1-CD1 3.73Å; F201-L236 HydrophobicContact CE1-CD1 3.84Å; V202-L236 HydrophobicContact CG2-CD1 3.82Å; V202-L236 HydrophobicContact CG2-CD2 3.64Å; V202-L236 HydrophobicContact CG2-CG 4.04Å; M233-L236 HydrophobicContact CB-CB 4.23Å; M233-L236 HydrophobicContact CB-CD2 4.09Å; M233-L236 HydrophobicContact CE-CD2 3.3Å; M233-L236 PolarHBondContact O-N 2.69Å; M233-L236 HydrophobicContact SD-CD2 4.08Å; R234-L236 VanDerWaalsContact C-N 3.32Å; L236-E238 PolarHBondContact N-OE2 3.4Å
237	N	97.2	Very high	97.2	Very high	2 Å²	2	33 Å²	33	1%	0.011	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-141.4	7	-171.4	68	-15.5	0	0	0	113.6	D192 V231 V232 M233 D239 E240	D192-N237 WeakPolarHBondContact O-CB 3.14Å; D192-N237 PolarHBondContact O-ND2 3.43Å; V231-N237 PolarHBondContact O-ND2 2.88Å; V232-N237 WeakPolarHBondContact CA-OD1 3.46Å; M233-N237 PolarHBondContact N-OD1 3.26Å; M233-N237 PolarHBondContact O-N 3.08Å; M233-N237 PolarHBondContact O-OD1 3.27Å; N237-D239 WeakPolarHBondContact CA-OD1 3.33Å; N237-D239 PolarHBondContact O-N 2.97Å; N237-E240 PolarHBondContact O-N 3.38Å; N237-E240 VanDerWaalsContact O-N 3.11Å
238	E	96.5	Very high	97.2	Very high	45 Å²	45	32.3 Å²	32.3	21%	0.21	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-64	-26	175.6	75.8	-84.5	-147.8	0	0	112.4	V232 R234 G235 L236 E240 L241 V274	V232-E238 HydrophobicContact CG1-CB 4.11Å; R234-E238 WeakPolarHBondContact CA-OE2 3.43Å; G235-E238 PolarHBondContact N-OE1 2.85Å; G235-E238 PolarHBondContact N-OE2 2.8Å; L236-E238 PolarHBondContact N-OE2 3.4Å; E238-E240 PolarHBondContact O-N 3.22Å; E238-L241 WeakPolarHBondContact O-CD1 2.92Å; E238-L241 VanDerWaalsContact O-CG 3.3Å; E238-L241 WeakPolarHBondContact O-CG 3.21Å; E238-L241 PolarHBondContact O-N 3.39Å; E238-V274 HydrophobicContact CB-CG2 4Å
239	D	96.6	Very high	97.1	Very high	103 Å²	103	35.6 Å²	35.6	55%	0.551	19%	0.192	S	C	*	.	G	3₁₀ helix	trans	-69.1	-19.7	175.4	61.4	-48.1	0	0	0	113	K198 N237	K198-D239 IonicContact NZ-OD1 3.27Å; K198-D239 PolarHBondContact NZ-OD1 3.38Å; K198-D239 IonicContact NZ-OD2 2.78Å; K198-D239 PolarHBondContact NZ-OD2 3.14Å; N237-D239 WeakPolarHBondContact CA-OD1 3.33Å; N237-D239 PolarHBondContact O-N 2.97Å
240	E	97.9	Very high	97	Very high	2 Å²	2	42 Å²	42	1%	0.009	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-92	2.4	-179.3	-61.5	179	-111.9	0	0	113.1	S193 L194 V195 K198 N237 E238 L242 D243 F244	S193-E240 WeakPolarHBondContact CA-OE2 3.45Å; S193-E240 WeakPolarHBondContact CB-OE1 3.49Å; S193-E240 PolarHBondContact OG-OE1 3.45Å; S193-E240 PolarHBondContact OG-OE2 2.78Å; L194-E240 PolarHBondContact N-OE2 3.23Å; V195-E240 PolarHBondContact N-OE2 2.79Å; K198-E240 WeakPolarHBondContact CD-OE1 3.33Å; K198-E240 IonicContact NZ-OE1 3.23Å; K198-E240 PolarHBondContact NZ-OE1 3.23Å; N237-E240 PolarHBondContact O-N 3.38Å; N237-E240 VanDerWaalsContact O-N 3.11Å; E238-E240 PolarHBondContact O-N 3.22Å; E240-L242 VanDerWaalsContact C-N 3.3Å; E240-L242 PolarHBondContact O-N 3.36Å; E240-D243 PolarHBondContact O-N 2.79Å; E240-D243 VanDerWaalsContact O-N 3.14Å; E240-F244 HydrophobicContact CB-CD2 4.19Å; E240-F244 HydrophobicContact CB-CE2 4.32Å; E240-F244 WeakPolarHBondContact O-CD2 3.45Å; E240-F244 PolarHBondContact O-N 3.33Å
241	L	97.4	Very high	96.8	Very high	3 Å²	3	44.5 Å²	44.5	2%	0.016	23%	0.23	C	C	.	.	H	α-helix	trans	-53.4	-47.7	-179.1	-79.6	171.1	0	0	0	111.8	V232 E238 F244 V245 F257 M279	V232-L241 HydrophobicContact CG1-CD2 4.24Å; V232-L241 HydrophobicContact CG1-CG 4.49Å; V232-L241 HydrophobicContact CG2-CD2 3.9Å; E238-L241 WeakPolarHBondContact O-CD1 2.92Å; E238-L241 VanDerWaalsContact O-CG 3.3Å; E238-L241 WeakPolarHBondContact O-CG 3.21Å; E238-L241 PolarHBondContact O-N 3.39Å; L241-F244 PolarHBondContact O-N 3.36Å; L241-V245 WeakPolarHBondContact O-CG2 3.48Å; L241-V245 PolarHBondContact O-N 2.87Å; L241-F257 HydrophobicContact CD2-CD1 3.5Å; L241-F257 VanDerWaalsContact CD2-CD1 3.5Å; L241-F257 HydrophobicContact CD2-CD2 4.38Å; L241-F257 HydrophobicContact CD2-CE1 3.49Å; L241-F257 VanDerWaalsContact CD2-CE1 3.49Å; L241-F257 HydrophobicContact CD2-CE2 4.36Å; L241-F257 HydrophobicContact CD2-CG 3.96Å; L241-F257 HydrophobicContact CD2-CZ 3.93Å; L241-M279 HydrophobicContact CD1-CB 4.17Å; L241-M279 HydrophobicContact CD1-CG 3.94Å; L241-M279 HydrophobicContact CD2-CG 4.26Å; L241-M279 HydrophobicContact CD2-SD 4.23Å
242	L	98.1	Very high	96.7	Very high	64 Å²	64	45.6 Å²	45.6	34%	0.335	24%	0.237	S	C	.	.	H	α-helix	trans	-67.8	-36	-178.9	-53.6	-176.5	0	0	0	111.7	E240 F244 V245 Q246 I283 Q286 W287	E240-L242 VanDerWaalsContact C-N 3.3Å; E240-L242 PolarHBondContact O-N 3.36Å; L242-F244 VanDerWaalsContact C-N 3.34Å; L242-F244 PolarHBondContact O-N 3.42Å; L242-V245 WeakPolarHBondContact O-CB 3.44Å; L242-V245 PolarHBondContact O-N 3.2Å; L242-V245 VanDerWaalsContact O-N 3.16Å; L242-Q246 PolarHBondContact O-N 3.15Å; L242-I283 HydrophobicContact CD2-CG1 4.27Å; L242-Q286 HydrophobicContact CD1-CB 4.3Å; L242-Q286 HydrophobicContact CD2-CB 4.16Å; L242-W287 HydrophobicContact CB-CH2 4.09Å; L242-W287 HydrophobicContact CB-CZ3 4.12Å; L242-W287 HydrophobicContact CD2-CE3 4.33Å; L242-W287 HydrophobicContact CD2-CH2 4.37Å; L242-W287 HydrophobicContact CD2-CZ3 3.58Å; L242-W287 HydrophobicContact CG-CZ3 4.4Å; L242-W287 WeakPolarHBondContact O-CH2 3.4Å
243	D	98.1	Very high	96.7	Very high	85 Å²	85	45.6 Å²	45.6	46%	0.455	24%	0.237	S	C	.	.	H	α-helix	trans	-64.2	-41.3	176.9	-61.5	-38.1	0	0	0	111.3	L194 E240 V245 Q246 L247	L194-D243 HydrophobicContact CD1-CB 3.82Å; E240-D243 PolarHBondContact O-N 2.79Å; E240-D243 VanDerWaalsContact O-N 3.14Å; D243-V245 VanDerWaalsContact C-N 3.33Å; D243-V245 PolarHBondContact O-N 2.92Å; D243-Q246 PolarHBondContact O-N 3.4Å; D243-L247 PolarHBondContact O-N 3.19Å
244	F	98.3	Very high	96.8	Very high	1 Å²	1	45.2 Å²	45.2	0%	0.004	24%	0.235	C	C	.	.	H	α-helix	trans	-63.6	-37	172.9	-89.9	-68.9	0	0	0	112.6	L191 L194 I228 C230 E240 L241 L242 L247 V255 F257	L191-F244 HydrophobicContact CD2-CE1 4.24Å; L191-F244 HydrophobicContact CG-CE1 4.35Å; L191-F244 HydrophobicContact CG-CZ 4.34Å; L191-F244 WeakPolarHBondContact O-CZ 3.48Å; L194-F244 HydrophobicContact CD1-CD1 4.07Å; L194-F244 HydrophobicContact CD1-CD2 4.3Å; L194-F244 HydrophobicContact CD1-CE1 4.31Å; L194-F244 HydrophobicContact CD1-CG 4.07Å; L194-F244 HydrophobicContact CD2-CD1 4.16Å; L194-F244 HydrophobicContact CD2-CE1 3.7Å; L194-F244 HydrophobicContact CD2-CZ 4Å; L194-F244 HydrophobicContact CG-CD1 4.08Å; L194-F244 HydrophobicContact CG-CD2 4.25Å; L194-F244 HydrophobicContact CG-CE1 3.81Å; L194-F244 HydrophobicContact CG-CE2 3.99Å; L194-F244 HydrophobicContact CG-CG 4.3Å; L194-F244 HydrophobicContact CG-CZ 3.76Å; I228-F244 HydrophobicContact CG2-CE1 4.26Å; C230-F244 HydrophobicContact CB-CZ 4.32Å; E240-F244 HydrophobicContact CB-CD2 4.19Å; E240-F244 HydrophobicContact CB-CE2 4.32Å; E240-F244 WeakPolarHBondContact O-CD2 3.45Å; E240-F244 PolarHBondContact O-N 3.33Å; L241-F244 PolarHBondContact O-N 3.36Å; L242-F244 VanDerWaalsContact C-N 3.34Å; L242-F244 PolarHBondContact O-N 3.42Å; F244-L247 WeakPolarHBondContact O-CB 3.34Å; F244-L247 PolarHBondContact O-N 2.93Å; F244-V255 HydrophobicContact CB-CG1 4.08Å; F244-V255 HydrophobicContact CD1-CG1 3.92Å; F244-V255 HydrophobicContact CG-CG1 4.28Å; F244-F257 HydrophobicContact CB-CE1 3.7Å; F244-F257 HydrophobicContact CB-CZ 3.73Å; F244-F257 HydrophobicContact CD2-CE1 4.4Å; F244-F257 HydrophobicContact CG-CE1 4.16Å
245	V	98.2	Very high	96.9	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-65.3	-46.8	172.5	175.9	0	0	0	0	110.6	L241 L242 D243 L247 T248 F257 I283 W287 V306 F309 L313	L241-V245 WeakPolarHBondContact O-CG2 3.48Å; L241-V245 PolarHBondContact O-N 2.87Å; L242-V245 WeakPolarHBondContact O-CB 3.44Å; L242-V245 PolarHBondContact O-N 3.2Å; L242-V245 VanDerWaalsContact O-N 3.16Å; D243-V245 VanDerWaalsContact C-N 3.33Å; D243-V245 PolarHBondContact O-N 2.92Å; V245-L247 PolarHBondContact O-N 3.15Å; V245-T248 WeakPolarHBondContact O-CB 3.36Å; V245-T248 PolarHBondContact O-N 3.13Å; V245-T248 PolarHBondContact O-OG1 3.38Å; V245-F257 HydrophobicContact CG2-CE2 4.21Å; V245-F257 HydrophobicContact CG2-CZ 4.17Å; V245-I283 HydrophobicContact CG2-CD1 3.85Å; V245-I283 HydrophobicContact CG2-CG1 3.95Å; V245-I283 HydrophobicContact CG2-CG2 4.13Å; V245-W287 HydrophobicContact CB-CE3 4.27Å; V245-W287 HydrophobicContact CB-CH2 3.67Å; V245-W287 HydrophobicContact CB-CZ3 3.51Å; V245-W287 HydrophobicContact CG1-CD2 4.11Å; V245-W287 HydrophobicContact CG1-CE3 3.69Å; V245-W287 HydrophobicContact CG1-CH2 3.57Å; V245-W287 HydrophobicContact CG1-CZ2 4.01Å; V245-W287 HydrophobicContact CG1-CZ3 3.38Å; V245-W287 HydrophobicContact CG2-CZ3 4.05Å; V245-V306 HydrophobicContact CG1-CG2 3.95Å; V245-F309 HydrophobicContact CG1-CE2 4.08Å; V245-L313 HydrophobicContact CB-CD1 4.27Å; V245-L313 HydrophobicContact CB-CD2 4.21Å; V245-L313 HydrophobicContact CG1-CD1 3.87Å; V245-L313 HydrophobicContact CG1-CD2 4.25Å; V245-L313 HydrophobicContact CG2-CD1 3.51Å; V245-L313 HydrophobicContact CG2-CD2 3.79Å; V245-L313 HydrophobicContact CG2-CG 4.28Å
246	Q	97.9	Very high	97.1	Very high	77 Å²	77	38.4 Å²	38.4	36%	0.36	19%	0.188	S	C	.	.	H	α-helix	trans	-58.7	-33.8	178.8	-168.2	66.3	38.9	0	0	112.1	L242 D243 T248 E249	L242-Q246 PolarHBondContact O-N 3.15Å; D243-Q246 PolarHBondContact O-N 3.4Å; Q246-T248 PolarHBondContact O-N 3.43Å; Q246-T248 VanDerWaalsContact O-N 3.11Å; Q246-E249 PolarHBondContact NE2-OE1 2.96Å; Q246-E249 PolarHBondContact NE2-OE2 2.92Å; Q246-E249 WeakPolarHBondContact O-CB 3.45Å; Q246-E249 PolarHBondContact O-N 3.33Å
247	L	96.8	Very high	97.3	Very high	29 Å²	29	37.1 Å²	37.1	15%	0.152	18%	0.181	C	C	.	.	H	α-helix	trans	-56.1	-28.7	175.1	-173.4	64.9	0	0	0	112.9	L194 I228 D243 F244 V245 E249 K251 L253	L194-L247 HydrophobicContact CD2-CD2 4.15Å; I228-L247 HydrophobicContact CD1-CD2 3.85Å; D243-L247 PolarHBondContact O-N 3.19Å; F244-L247 WeakPolarHBondContact O-CB 3.34Å; F244-L247 PolarHBondContact O-N 2.93Å; V245-L247 PolarHBondContact O-N 3.15Å; L247-E249 VanDerWaalsContact C-N 3.34Å; L247-K251 HydrophobicContact CD1-CD 4.29Å; L247-L253 HydrophobicContact CD1-CD1 4.49Å; L247-L253 HydrophobicContact CD2-CD1 3.95Å; L247-L253 HydrophobicContact CG-CD1 3.8Å
248	T	97.4	Very high	97.3	Very high	1 Å²	1	38 Å²	38	1%	0.006	19%	0.185	C	C	.	.	H	α-helix	trans	-82.4	-7.1	179.2	71.1	0	0	0	0	114.1	V245 Q246 L253 V255 F309 K310 G311 L313	V245-T248 WeakPolarHBondContact O-CB 3.36Å; V245-T248 PolarHBondContact O-N 3.13Å; V245-T248 PolarHBondContact O-OG1 3.38Å; Q246-T248 PolarHBondContact O-N 3.43Å; Q246-T248 VanDerWaalsContact O-N 3.11Å; T248-L253 HydrophobicContact CG2-CB 4.4Å; T248-V255 HydrophobicContact CG2-CB 4.12Å; T248-V255 HydrophobicContact CG2-CG2 3.52Å; T248-F309 WeakPolarHBondContact OG1-CD2 3.5Å; T248-K310 PolarHBondContact O-N 3.44Å; T248-G311 PolarHBondContact O-N 3.23Å; T248-L313 HydrophobicContact CG2-CD2 3.99Å
249	E	97.3	Very high	97.2	Very high	70 Å²	70	35.9 Å²	35.9	33%	0.327	18%	0.175	S	C	.	.	H	α-helix	trans	-58.7	-53.4	179	-178.2	-172.6	-137.9	0	0	111.1	Q246 L247 F309 K310	Q246-E249 PolarHBondContact NE2-OE1 2.96Å; Q246-E249 PolarHBondContact NE2-OE2 2.92Å; Q246-E249 WeakPolarHBondContact O-CB 3.45Å; Q246-E249 PolarHBondContact O-N 3.33Å; L247-E249 VanDerWaalsContact C-N 3.34Å; E249-F309 HydrophobicContact CB-CD1 4.12Å; E249-F309 HydrophobicContact CB-CD2 3.93Å; E249-F309 HydrophobicContact CB-CE1 4.01Å; E249-F309 HydrophobicContact CB-CE2 3.81Å; E249-F309 HydrophobicContact CB-CG 4.08Å; E249-F309 HydrophobicContact CB-CZ 3.85Å; E249-F309 HydrophobicContact CG-CD1 3.94Å; E249-F309 HydrophobicContact CG-CE1 3.78Å; E249-F309 HydrophobicContact CG-CE2 4.49Å; E249-F309 HydrophobicContact CG-CG 4.36Å; E249-F309 HydrophobicContact CG-CZ 4.07Å; E249-K310 PolarHBondContact O-N 3.06Å
250	K	94.8	Very high	97.1	Very high	153 Å²	153	31.2 Å²	31.2	67%	0.665	15%	0.15	S	C	*	.	H	α-helix	trans	-102.3	-12.8	-171	-62.4	-178.2	-176.3	175.8	0	114.2	K310	K250-K310 WeakPolarHBondContact O-CD 3.19Å
251	K	94.6	Very high	96.8	Very high	54 Å²	54	32.1 Å²	32.1	24%	0.235	16%	0.155	C	C	.	.	S	Bend	trans	-118	140.1	-174.8	-59	-177.9	179.2	-178.5	0	110.2	D216 L247 L253 G311	D216-K251 WeakPolarHBondContact OD1-CE 3.35Å; D216-K251 IonicContact OD1-NZ 3.11Å; D216-K251 PolarHBondContact OD1-NZ 3.11Å; D216-K251 IonicContact OD2-NZ 3.85Å; L247-K251 HydrophobicContact CD1-CD 4.29Å; K251-L253 HydrophobicContact CB-CD1 3.7Å; K251-L253 HydrophobicContact CB-CG 3.64Å; K251-L253 HydrophobicContact CD-CD1 3.87Å; K251-L253 HydrophobicContact CG-CD1 4.41Å; K251-L253 PolarHBondContact O-N 2.79Å; K251-G311 WeakPolarHBondContact O-CA 3.29Å; K251-G311 PolarHBondContact O-N 2.69Å
252	P	95.3	Very high	96.3	Very high	42 Å²	42	32.2 Å²	32.2	27%	0.273	16%	0.155	S	C	.	.			trans	-76.5	56	177.3	35.3	-37	0	0	0	111.1	V219	V219-P252 HydrophobicContact CG1-CG 3.78Å
253	L	97.4	Very high	95.7	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.005	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	148.5	-179	-61.1	174.2	0	0	0	110	I215 V219 V226 I228 L247 T248 K251 G311 Q312	I215-L253 HydrophobicContact CG2-CD1 4.08Å; I215-L253 HydrophobicContact CG2-CD2 3.78Å; V219-L253 HydrophobicContact CG2-CD2 3.63Å; V226-L253 HydrophobicContact CB-CD2 3.78Å; V226-L253 HydrophobicContact CG1-CD2 4.05Å; I228-L253 HydrophobicContact CD1-CD1 3.9Å; L247-L253 HydrophobicContact CD1-CD1 4.49Å; L247-L253 HydrophobicContact CD2-CD1 3.95Å; L247-L253 HydrophobicContact CG-CD1 3.8Å; T248-L253 HydrophobicContact CG2-CB 4.4Å; K251-L253 HydrophobicContact CB-CD1 3.7Å; K251-L253 HydrophobicContact CB-CG 3.64Å; K251-L253 HydrophobicContact CD-CD1 3.87Å; K251-L253 HydrophobicContact CG-CD1 4.41Å; K251-L253 PolarHBondContact O-N 2.79Å; L253-G311 CarbonylContact O-C 3.49Å; L253-G311 WeakPolarHBondContact O-CA 3.06Å; L253-Q312 PolarHBondContact O-N 3.4Å
254	E	97.6	Very high	94.8	Very high	6 Å²	6	28.3 Å²	28.3	3%	0.028	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	102.5	165	178	-179.7	168.8	0	0	109	P225 V226 K227 I228 R256 Q312	P225-E254 HydrophobicContact CB-CB 4.02Å; P225-E254 HydrophobicContact CG-CB 4.35Å; V226-E254 PolarHBondContact O-N 3.05Å; K227-E254 CarbonylContact C-O 3.55Å; K227-E254 VanDerWaalsContact CA-O 3.31Å; K227-E254 WeakPolarHBondContact CA-O 3.46Å; K227-E254 VanDerWaalsContact CE-OE2 3.27Å; K227-E254 WeakPolarHBondContact CE-OE2 3.28Å; K227-E254 HydrophobicContact CG-CB 4.03Å; K227-E254 HydrophobicContact CG-CG 4.37Å; I228-E254 PolarHBondContact N-O 2.99Å; E254-R256 VanDerWaalsContact CD-NE 3.31Å; E254-R256 VanDerWaalsContact CD-NH2 3.32Å; E254-R256 HydrophobicContact CG-CG 4.08Å; E254-R256 IonicContact OE1-CZ 2.92Å; E254-R256 IonicContact OE1-NE 2.76Å; E254-R256 PolarHBondContact OE1-NE 3.13Å; E254-R256 IonicContact OE1-NH2 3.72Å; E254-R256 PolarHBondContact OE1-NH2 3.14Å; E254-R256 IonicContact OE2-NE 3.28Å; E254-R256 IonicContact OE2-NH2 2.77Å; E254-R256 PolarHBondContact OE2-NH2 3.48Å; E254-Q312 VanDerWaalsContact CA-O 3.3Å; E254-Q312 WeakPolarHBondContact CA-O 3.4Å; E254-Q312 HydrophobicContact CB-CG 3.87Å; E254-Q312 HydrophobicContact CG-CG 3.78Å; E254-Q312 PolarHBondContact OE2-NE2 3.14Å
255	V	98.3	Very high	93.8	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	120.8	177.4	-179.8	0	0	0	0	109.6	I228 F244 T248 F257 Q312 L313 G314	I228-V255 HydrophobicContact CB-CG2 4.23Å; I228-V255 HydrophobicContact CD1-CG2 4.28Å; I228-V255 CarbonylContact O-C 3.35Å; F244-V255 HydrophobicContact CB-CG1 4.08Å; F244-V255 HydrophobicContact CD1-CG1 3.92Å; F244-V255 HydrophobicContact CG-CG1 4.28Å; T248-V255 HydrophobicContact CG2-CB 4.12Å; T248-V255 HydrophobicContact CG2-CG2 3.52Å; V255-F257 HydrophobicContact CG1-CD1 4.49Å; V255-F257 HydrophobicContact CG1-CE1 3.94Å; V255-F257 HydrophobicContact CG1-CE2 4.44Å; V255-F257 HydrophobicContact CG1-CZ 3.92Å; V255-Q312 PolarHBondContact N-O 2.81Å; V255-L313 HydrophobicContact CB-CD2 4.3Å; V255-L313 CarbonylContact O-C 3.59Å; V255-L313 VanDerWaalsContact O-CA 3.29Å; V255-L313 WeakPolarHBondContact O-CA 3.42Å; V255-G314 PolarHBondContact O-N 2.81Å
256	R	98.3	Very high	93	Very high	42 Å²	42	30.6 Å²	30.6	16%	0.158	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	110.4	-175.8	-63.8	178.7	173.3	-162	-5.4	110.3	I228 N229 C230 E254 G314 I316	I228-R256 WeakPolarHBondContact O-CB 3.35Å; I228-R256 PolarHBondContact O-N 3.2Å; N229-R256 WeakPolarHBondContact OD1-CD 3.44Å; C230-R256 PolarHBondContact N-O 2.84Å; E254-R256 VanDerWaalsContact CD-NE 3.31Å; E254-R256 VanDerWaalsContact CD-NH2 3.32Å; E254-R256 HydrophobicContact CG-CG 4.08Å; E254-R256 IonicContact OE1-CZ 2.92Å; E254-R256 IonicContact OE1-NE 2.76Å; E254-R256 PolarHBondContact OE1-NE 3.13Å; E254-R256 IonicContact OE1-NH2 3.72Å; E254-R256 PolarHBondContact OE1-NH2 3.14Å; E254-R256 IonicContact OE2-NE 3.28Å; E254-R256 IonicContact OE2-NH2 2.77Å; E254-R256 PolarHBondContact OE2-NH2 3.48Å; R256-G314 CarbonylContact C-O 3.5Å; R256-G314 WeakPolarHBondContact CA-O 3.41Å; R256-I316 HydrophobicContact CB-CD1 4.48Å
257	F	98.4	Very high	92.4	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	128.1	172.5	-56.5	-65.6	0	0	0	109.9	C230 V232 L241 F244 V245 V255 M279 I283 L313 G314 F315 I316	C230-F257 HydrophobicContact CB-CD1 4.35Å; C230-F257 CarbonylContact O-C 3.13Å; C230-F257 WeakPolarHBondContact O-CA 3.18Å; V232-F257 HydrophobicContact CG2-CB 4.02Å; V232-F257 HydrophobicContact CG2-CD1 3.76Å; V232-F257 HydrophobicContact CG2-CG 4.31Å; L241-F257 HydrophobicContact CD2-CD1 3.5Å; L241-F257 VanDerWaalsContact CD2-CD1 3.5Å; L241-F257 HydrophobicContact CD2-CD2 4.38Å; L241-F257 HydrophobicContact CD2-CE1 3.49Å; L241-F257 VanDerWaalsContact CD2-CE1 3.49Å; L241-F257 HydrophobicContact CD2-CE2 4.36Å; L241-F257 HydrophobicContact CD2-CG 3.96Å; L241-F257 HydrophobicContact CD2-CZ 3.93Å; F244-F257 HydrophobicContact CB-CE1 3.7Å; F244-F257 HydrophobicContact CB-CZ 3.73Å; F244-F257 HydrophobicContact CD2-CE1 4.4Å; F244-F257 HydrophobicContact CG-CE1 4.16Å; V245-F257 HydrophobicContact CG2-CE2 4.21Å; V245-F257 HydrophobicContact CG2-CZ 4.17Å; V255-F257 HydrophobicContact CG1-CD1 4.49Å; V255-F257 HydrophobicContact CG1-CE1 3.94Å; V255-F257 HydrophobicContact CG1-CE2 4.44Å; V255-F257 HydrophobicContact CG1-CZ 3.92Å; F257-M279 HydrophobicContact CB-CE 4.48Å; F257-M279 HydrophobicContact CB-SD 3.78Å; F257-M279 HydrophobicContact CG-SD 4.47Å; F257-I283 HydrophobicContact CD2-CD1 4.3Å; F257-I283 HydrophobicContact CE2-CD1 3.81Å; F257-I283 HydrophobicContact CZ-CD1 4.49Å; F257-L313 HydrophobicContact CE2-CD2 4.27Å; F257-G314 PolarHBondContact N-O 3.22Å; F257-F315 HydrophobicContact CB-CD1 4.14Å; F257-F315 HydrophobicContact CB-CE1 4.45Å; F257-F315 HydrophobicContact CD2-CD1 4.19Å; F257-F315 AromaticContact CD2-CE1 3.79Å; F257-F315 HydrophobicContact CD2-CE1 3.79Å; F257-F315 HydrophobicContact CD2-CZ 4.28Å; F257-I316 PolarHBondContact O-N 3.11Å
258	I	97.4	Very high	91.8	Very high	19 Å²	19	34.9 Å²	34.9	10%	0.097	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	128.4	-175.6	-49.1	-173.6	0	0	0	108.6	N229 C230 V231 V232 M261 I316	N229-I258 HydrophobicContact CB-CD1 3.82Å; C230-I258 PolarHBondContact O-N 2.65Å; V231-I258 WeakPolarHBondContact CA-O 3.08Å; V231-I258 HydrophobicContact CG2-CB 4.27Å; V232-I258 PolarHBondContact N-O 3.05Å; I258-M261 HydrophobicContact CG2-CE 4.12Å; I258-I316 HydrophobicContact CB-CB 4.37Å; I258-I316 HydrophobicContact CD1-CD1 3.92Å; I258-I316 HydrophobicContact CG1-CB 4.07Å; I258-I316 HydrophobicContact CG1-CD1 3.91Å; I258-I316 HydrophobicContact CG1-CG1 4.21Å; I258-I316 HydrophobicContact CG2-CB 4.22Å; I258-I316 HydrophobicContact CG2-CG2 4.16Å
259	E	96.2	Very high	91.3	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.005	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	137.4	173.1	-64.5	-175.9	142.4	0	0	111	M261 M273 S275 Y276 M279 I316 T317 S318 M319 S320	E259-M261 WeakPolarHBondContact O-CG 3.41Å; E259-M261 PolarHBondContact O-N 2.98Å; E259-M273 HydrophobicContact CB-CE 4.22Å; E259-M273 VanDerWaalsContact CD-CE 3.47Å; E259-M273 HydrophobicContact CG-CE 4.17Å; E259-M273 WeakPolarHBondContact OE1-CE 3.24Å; E259-S275 WeakPolarHBondContact OE1-CA 3.31Å; E259-Y276 PolarHBondContact OE1-N 3.08Å; E259-M279 HydrophobicContact CG-CE 4Å; E259-I316 PolarHBondContact N-O 2.59Å; E259-T317 WeakPolarHBondContact OE2-CA 3.35Å; E259-S318 PolarHBondContact OE2-N 2.98Å; E259-M319 WeakPolarHBondContact OE2-CA 3.36Å; E259-M319 PolarHBondContact OE2-N 3.43Å; E259-S320 VanDerWaalsContact CD-OG 3.31Å; E259-S320 WeakPolarHBondContact OE1-CB 3.34Å; E259-S320 PolarHBondContact OE1-OG 3.31Å; E259-S320 PolarHBondContact OE2-N 3.33Å; E259-S320 PolarHBondContact OE2-OG 2.65Å
260	Y	93.7	Very high	90.8	Very high	6 Å²	6	39.8 Å²	39.8	2%	0.024	19%	0.194	C	C	.	.			trans	-65	122.4	175.1	178.4	-124	0	0	0	111.7	V231 M233 N266 W268 K272	V231-Y260 HydrophobicContact CG1-CD2 4.2Å; M233-Y260 HydrophobicContact CG-CD1 4.36Å; M233-Y260 HydrophobicContact CG-CD2 3.92Å; M233-Y260 HydrophobicContact CG-CG 3.8Å; M233-Y260 HydrophobicContact SD-CD2 3.88Å; M233-Y260 HydrophobicContact SD-CE2 4.01Å; M233-Y260 HydrophobicContact SD-CG 4.3Å; Y260-N266 PolarHBondContact OH-O 3.08Å; Y260-W268 AromaticContact CD1-CD1 3.81Å; Y260-W268 HydrophobicContact CE1-CB 4.42Å; Y260-W268 AromaticContact CE1-CD1 3.56Å; Y260-W268 HydrophobicContact CE1-CG 4.24Å; Y260-W268 WeakPolarHBondContact OH-CA 3.39Å; Y260-K272 HydrophobicContact CD1-CB 4.15Å; Y260-K272 HydrophobicContact CE1-CB 4.2Å
261	M	91.1	Very high	90.7	Very high	21 Å²	21	40.4 Å²	40.4	10%	0.103	20%	0.197	C	C	.	.			trans	-110.2	150.5	-171.7	-70.8	177	-74.7	0	0	112.4	I258 E259 F263 N266 W268 S318 M319 L342 F343	I258-M261 HydrophobicContact CG2-CE 4.12Å; E259-M261 WeakPolarHBondContact O-CG 3.41Å; E259-M261 PolarHBondContact O-N 2.98Å; M261-F263 HydrophobicContact CB-CD2 4.15Å; M261-F263 HydrophobicContact CB-CE2 3.55Å; M261-F263 HydrophobicContact CB-CZ 4.38Å; M261-F263 HydrophobicContact CE-CE2 4.13Å; M261-F263 PolarHBondContact O-N 2.81Å; M261-F263 HydrophobicContact SD-CE2 4.36Å; M261-N266 PolarHBondContact O-ND2 3.3Å; M261-W268 VanDerWaalsContact C-CD1 3.49Å; M261-S318 WeakPolarHBondContact SD-CB 3.39Å; M261-S318 PolarHBondContact SD-OG 3.11Å; M261-M319 HydrophobicContact CB-SD 4.35Å; M261-M319 HydrophobicContact CG-CG 3.97Å; M261-M319 HydrophobicContact CG-SD 3.78Å; M261-L342 HydrophobicContact CE-CD2 4.42Å; M261-L342 HydrophobicContact SD-CD2 4.25Å; M261-F343 HydrophobicContact CB-CE1 4.36Å; M261-F343 HydrophobicContact CB-CZ 4.2Å; M261-F343 HydrophobicContact CG-CZ 4.05Å; M261-F343 HydrophobicContact SD-CE1 4.44Å; M261-F343 HydrophobicContact SD-CE2 4.39Å; M261-F343 HydrophobicContact SD-CZ 3.61Å
262	P	86.6	Confident	90.6	Very high	5 Å²	5	42.1 Å²	42.1	3%	0.032	21%	0.205	C	C	.	.			trans	-73.5	123.6	174.5	27.1	-31.9	0	0	0	112.4	W268 M319 I384	P262-W268 VanDerWaalsContact CA-CD1 3.5Å; P262-W268 HydrophobicContact CB-CB 4.04Å; P262-W268 HydrophobicContact CB-CD2 3.78Å; P262-W268 HydrophobicContact CB-CE3 4.36Å; P262-W268 HydrophobicContact CB-CG 3.6Å; P262-M319 HydrophobicContact CG-CE 3.99Å; P262-I384 HydrophobicContact CB-CG2 4.39Å; P262-I384 HydrophobicContact CG-CB 3.99Å; P262-I384 HydrophobicContact CG-CG2 3.59Å
263	F	85.4	Confident	90.6	Very high	14 Å²	14	40.5 Å²	40.5	6%	0.061	19%	0.194	C	C	.	.			trans	-138	155.5	170.9	-71.1	-80	0	0	0	111	M261 G265 N266 L342 F343 M392 I395	M261-F263 HydrophobicContact CB-CD2 4.15Å; M261-F263 HydrophobicContact CB-CE2 3.55Å; M261-F263 HydrophobicContact CB-CZ 4.38Å; M261-F263 HydrophobicContact CE-CE2 4.13Å; M261-F263 PolarHBondContact O-N 2.81Å; M261-F263 HydrophobicContact SD-CE2 4.36Å; F263-G265 PolarHBondContact O-N 2.99Å; F263-N266 HydrophobicContact CB-CB 4.44Å; F263-N266 PolarHBondContact N-ND2 2.74Å; F263-N266 PolarHBondContact N-OD1 3.39Å; F263-N266 VanDerWaalsContact O-CG 3.25Å; F263-N266 PolarHBondContact O-N 2.9Å; F263-N266 VanDerWaalsContact O-N 3.15Å; F263-N266 PolarHBondContact O-OD1 3.46Å; F263-L342 HydrophobicContact CE1-CD1 4.21Å; F263-L342 HydrophobicContact CE1-CG 4.04Å; F263-L342 HydrophobicContact CZ-CD1 4.23Å; F263-L342 HydrophobicContact CZ-CD2 3.85Å; F263-L342 HydrophobicContact CZ-CG 3.83Å; F263-F343 HydrophobicContact CE1-CD1 4.41Å; F263-F343 HydrophobicContact CE1-CE1 4.19Å; F263-F343 HydrophobicContact CE2-CE1 4.38Å; F263-F343 HydrophobicContact CZ-CD1 4.47Å; F263-F343 AromaticContact CZ-CE1 3.83Å; F263-F343 HydrophobicContact CZ-CE1 3.83Å; F263-F343 HydrophobicContact CZ-CZ 4.46Å; F263-M392 HydrophobicContact CD1-CE 4.41Å; F263-M392 HydrophobicContact CD2-CE 3.78Å; F263-M392 HydrophobicContact CE1-CE 3.85Å; F263-M392 HydrophobicContact CE1-SD 4.45Å; F263-M392 HydrophobicContact CE2-CE 3.11Å; F263-M392 HydrophobicContact CG-CB 4.48Å; F263-M392 HydrophobicContact CG-CE 4.4Å; F263-M392 HydrophobicContact CZ-CE 3.17Å; F263-M392 HydrophobicContact CZ-SD 4.28Å; F263-I395 HydrophobicContact CD1-CD1 4.24Å; F263-I395 HydrophobicContact CE1-CD1 4.06Å
264	D	80.1	Confident	90.5	Very high	53 Å²	53	40.7 Å²	40.7	28%	0.283	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	125.9	-179.2	-72.6	35.7	0	0	0	111.2	N266 N389 P391	D264-N266 VanDerWaalsContact C-N 3.29Å; D264-N266 PolarHBondContact O-N 3.44Å; D264-N389 WeakPolarHBondContact CB-O 3.26Å; D264-N389 WeakPolarHBondContact OD1-CA 3.24Å; D264-N389 WeakPolarHBondContact OD1-CB 3.28Å; D264-N389 PolarHBondContact OD1-N 2.95Å; D264-N389 PolarHBondContact OD2-N 2.91Å; D264-P391 HydrophobicContact CB-CG 4.47Å
265	G	77.1	Confident	90.5	Very high	40 Å²	40	41.7 Å²	41.7	41%	0.412	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.5	4.6	177.8	0	0	0	0	0	115.8	F263 K267	F263-G265 PolarHBondContact O-N 2.99Å; G265-K267 VanDerWaalsContact C-N 3.31Å; G265-K267 PolarHBondContact O-N 3.47Å
266	N	81.9	Confident	90.4	Very high	9 Å²	9	42.8 Å²	42.8	5%	0.048	21%	0.207	C	C	.	.	S	Bend	trans	-87.7	7.7	178.1	85.5	-12.8	0	0	0	114.8	Y98 Y260 M261 F263 D264 W268	Y98-N266 VanDerWaalsContact O-CB 3.29Å; Y98-N266 WeakPolarHBondContact O-CB 3.34Å; Y98-N266 PolarHBondContact O-ND2 2.77Å; Y260-N266 PolarHBondContact OH-O 3.08Å; M261-N266 PolarHBondContact O-ND2 3.3Å; F263-N266 HydrophobicContact CB-CB 4.44Å; F263-N266 PolarHBondContact N-ND2 2.74Å; F263-N266 PolarHBondContact N-OD1 3.39Å; F263-N266 VanDerWaalsContact O-CG 3.25Å; F263-N266 PolarHBondContact O-N 2.9Å; F263-N266 VanDerWaalsContact O-N 3.15Å; F263-N266 PolarHBondContact O-OD1 3.46Å; D264-N266 VanDerWaalsContact C-N 3.29Å; D264-N266 PolarHBondContact O-N 3.44Å; N266-W268 VanDerWaalsContact C-N 3.26Å; N266-W268 PolarHBondContact O-N 2.89Å; N266-W268 WeakPolarHBondContact OD1-CB 3.44Å; N266-W268 PolarHBondContact OD1-N 3.22Å
267	K	83.9	Confident	90.3	Very high	144 Å²	144	45 Å²	45	63%	0.626	22%	0.219	S	C	*	.			trans	51.4	42	-179.1	-57.6	-179.7	-174.7	171.8	0	112.8	E102 G265 N269	E102-K267 IonicContact OE2-NZ 3.23Å; E102-K267 PolarHBondContact OE2-NZ 3.27Å; G265-K267 VanDerWaalsContact C-N 3.31Å; G265-K267 PolarHBondContact O-N 3.47Å; K267-N269 PolarHBondContact O-N 2.93Å
268	W	84.3	Confident	90.2	Very high	51 Å²	51	48.5 Å²	48.5	19%	0.193	24%	0.235	C	C	.	.			trans	-52.5	137.5	-179.2	180	83.4	0	0	0	112.9	Y260 M261 P262 N266 F270 M381 S385	Y260-W268 AromaticContact CD1-CD1 3.81Å; Y260-W268 HydrophobicContact CE1-CB 4.42Å; Y260-W268 AromaticContact CE1-CD1 3.56Å; Y260-W268 HydrophobicContact CE1-CG 4.24Å; Y260-W268 WeakPolarHBondContact OH-CA 3.39Å; M261-W268 VanDerWaalsContact C-CD1 3.49Å; P262-W268 VanDerWaalsContact CA-CD1 3.5Å; P262-W268 HydrophobicContact CB-CB 4.04Å; P262-W268 HydrophobicContact CB-CD2 3.78Å; P262-W268 HydrophobicContact CB-CE3 4.36Å; P262-W268 HydrophobicContact CB-CG 3.6Å; N266-W268 VanDerWaalsContact C-N 3.26Å; N266-W268 PolarHBondContact O-N 2.89Å; N266-W268 WeakPolarHBondContact OD1-CB 3.44Å; N266-W268 PolarHBondContact OD1-N 3.22Å; W268-F270 HydrophobicContact CH2-CB 3.78Å; W268-F270 HydrophobicContact CZ2-CB 3.87Å; W268-F270 HydrophobicContact CZ2-CD2 4.47Å; W268-M381 HydrophobicContact CH2-CG 3.74Å; W268-M381 HydrophobicContact CH2-SD 4.3Å; W268-M381 HydrophobicContact CZ2-CE 4.47Å; W268-M381 HydrophobicContact CZ2-CG 3.38Å; W268-M381 HydrophobicContact CZ2-SD 3.53Å; W268-M381 VanDerWaalsContact CZ2-SD 3.53Å; W268-S385 VanDerWaalsContact CE3-CB 3.47Å; W268-S385 VanDerWaalsContact CZ3-CB 3.46Å
269	N	87.4	Confident	90.2	Very high	71 Å²	71	47.7 Å²	47.7	38%	0.38	23%	0.231	S	C	.	.			trans	-146.4	125.3	175.4	-175.7	-27.5	0	0	0	108.6	K267 K271 K272	K267-N269 PolarHBondContact O-N 2.93Å; N269-K271 PolarHBondContact O-N 2.87Å; N269-K271 VanDerWaalsContact O-N 3.15Å; N269-K271 WeakPolarHBondContact OD1-CB 3.34Å; N269-K271 PolarHBondContact OD1-N 3.09Å; N269-K272 HydrophobicContact CB-CD 4.45Å; N269-K272 HydrophobicContact CB-CG 4.27Å; N269-K272 WeakPolarHBondContact O-CB 3.37Å; N269-K272 PolarHBondContact O-N 2.84Å
270	F	87.4	Confident	90.3	Very high	103 Å²	103	47.7 Å²	47.7	45%	0.452	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-53.9	-34	177.7	177.3	-110.7	0	0	0	113.2	W268 K272 M273 M381	W268-F270 HydrophobicContact CH2-CB 3.78Å; W268-F270 HydrophobicContact CZ2-CB 3.87Å; W268-F270 HydrophobicContact CZ2-CD2 4.47Å; F270-K272 PolarHBondContact O-N 2.98Å; F270-K272 VanDerWaalsContact O-N 3.15Å; F270-M273 HydrophobicContact CD2-CB 4.44Å; F270-M273 HydrophobicContact CD2-SD 4.26Å; F270-M273 HydrophobicContact CE2-SD 4.15Å; F270-M273 VanDerWaalsContact O-CB 3.27Å; F270-M273 WeakPolarHBondContact O-CB 3.23Å; F270-M273 PolarHBondContact O-N 2.91Å; F270-M381 HydrophobicContact CD2-CE 3.21Å; F270-M381 HydrophobicContact CD2-SD 3.96Å; F270-M381 HydrophobicContact CE2-CE 3.32Å; F270-M381 HydrophobicContact CE2-SD 4.41Å; F270-M381 HydrophobicContact CG-CE 4.34Å; F270-M381 HydrophobicContact CZ-CE 4.49Å
271	K	92.2	Very high	90.5	Very high	166 Å²	166	50.6 Å²	50.6	72%	0.722	25%	0.247	S	C	*	.	G	3₁₀ helix	trans	-63	-20.6	176.9	-62.7	-175.6	178.2	-176.6	0	113.5	R234 N269	R234-K271 WeakPolarHBondContact CD-O 3.45Å; R234-K271 PolarHBondContact NE-O 2.84Å; N269-K271 PolarHBondContact O-N 2.87Å; N269-K271 VanDerWaalsContact O-N 3.15Å; N269-K271 WeakPolarHBondContact OD1-CB 3.34Å; N269-K271 PolarHBondContact OD1-N 3.09Å
272	K	93.3	Very high	90.8	Very high	90 Å²	90	53.3 Å²	53.3	39%	0.391	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-86.7	-9.9	175.1	-66.2	-173.8	174.6	-175.2	0	113	M233 R234 Y260 N269 F270	M233-K272 CarbonylContact C-O 3.58Å; M233-K272 WeakPolarHBondContact CA-O 3.3Å; R234-K272 PolarHBondContact N-O 2.91Å; Y260-K272 HydrophobicContact CD1-CB 4.15Å; Y260-K272 HydrophobicContact CE1-CB 4.2Å; N269-K272 HydrophobicContact CB-CD 4.45Å; N269-K272 HydrophobicContact CB-CG 4.27Å; N269-K272 WeakPolarHBondContact O-CB 3.37Å; N269-K272 PolarHBondContact O-N 2.84Å; F270-K272 PolarHBondContact O-N 2.98Å; F270-K272 VanDerWaalsContact O-N 3.15Å
273	M	94.5	Very high	91.3	Very high	9 Å²	9	53 Å²	53	4%	0.044	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-74.7	139.7	177.6	-173	-179.1	161.1	0	0	110	R234 E259 F270 M319 M381	R234-M273 PolarHBondContact NE-O 2.81Å; R234-M273 PolarHBondContact NH2-O 2.87Å; E259-M273 HydrophobicContact CB-CE 4.22Å; E259-M273 VanDerWaalsContact CD-CE 3.47Å; E259-M273 HydrophobicContact CG-CE 4.17Å; E259-M273 WeakPolarHBondContact OE1-CE 3.24Å; F270-M273 HydrophobicContact CD2-CB 4.44Å; F270-M273 HydrophobicContact CD2-SD 4.26Å; F270-M273 HydrophobicContact CE2-SD 4.15Å; F270-M273 VanDerWaalsContact O-CB 3.27Å; F270-M273 WeakPolarHBondContact O-CB 3.23Å; F270-M273 PolarHBondContact O-N 2.91Å; M273-M319 HydrophobicContact CE-CB 3.63Å; M273-M319 HydrophobicContact CE-CG 4.45Å; M273-M319 HydrophobicContact SD-CB 4.09Å; M273-M381 HydrophobicContact SD-CE 4.13Å; M273-M381 HydrophobicContact SD-SD 3.58Å
274	V	96.3	Very high	91.9	Very high	4 Å²	4	57 Å²	57	2%	0.024	27%	0.273	C	S	.	.			trans	-114.2	121.4	163.8	-170	0	0	0	0	106.3	V232 R234 E238 E278 M279	V232-V274 HydrophobicContact CG1-CB 4.05Å; V232-V274 HydrophobicContact CG1-CG2 4.01Å; R234-V274 HydrophobicContact CB-CG2 3.91Å; E238-V274 HydrophobicContact CB-CG2 4Å; V274-E278 WeakPolarHBondContact CA-OE2 3.35Å; V274-E278 HydrophobicContact CG1-CB 3.92Å; V274-M279 HydrophobicContact CB-CG 4.26Å; V274-M279 HydrophobicContact CG1-CG 3.58Å
275	S	96.6	Very high	92.7	Very high	28 Å²	28	62 Å²	62	20%	0.196	29%	0.294	C	S	.	.			trans	-76.9	159.9	-175.5	72.8	0	0	0	0	111.7	E259 Q277 E278 M279	E259-S275 WeakPolarHBondContact OE1-CA 3.31Å; S275-Q277 PolarHBondContact O-N 2.89Å; S275-E278 PolarHBondContact N-OE2 3.03Å; S275-E278 PolarHBondContact O-N 3.13Å; S275-E278 VanDerWaalsContact OG-CG 3.31Å; S275-E278 WeakPolarHBondContact OG-CG 3.36Å; S275-E278 PolarHBondContact OG-N 3.34Å; S275-M279 WeakPolarHBondContact O-CG 3.43Å; S275-M279 PolarHBondContact O-N 2.87Å
276	Y	95.8	Very high	93.7	Very high	23 Å²	23	65.6 Å²	65.6	9%	0.09	30%	0.3	C	S	.	.	H	α-helix	trans	-44.6	-50.2	168.8	170.4	-130	0	0	0	113.4	E259 M279 L280 K302 F304 F315 T317	E259-Y276 PolarHBondContact OE1-N 3.08Å; Y276-M279 PolarHBondContact O-N 2.77Å; Y276-L280 HydrophobicContact CE1-CD2 4.45Å; Y276-L280 HydrophobicContact CE2-CB 4.23Å; Y276-L280 HydrophobicContact CE2-CD2 4.06Å; Y276-L280 VanDerWaalsContact O-CB 3.27Å; Y276-L280 WeakPolarHBondContact O-CB 3.34Å; Y276-L280 PolarHBondContact O-N 2.95Å; Y276-L280 WeakPolarHBondContact OH-CD2 3.46Å; Y276-K302 HydrophobicContact CE1-CD 4.03Å; Y276-K302 HydrophobicContact CE2-CD 4.29Å; Y276-F304 HydrophobicContact CE2-CE2 4.31Å; Y276-F304 WeakPolarHBondContact OH-CE2 3.49Å; Y276-F304 WeakPolarHBondContact OH-CZ 3.48Å; Y276-F315 HydrophobicContact CD2-CB 3.52Å; Y276-F315 AromaticContact CD2-CD1 3.78Å; Y276-F315 HydrophobicContact CD2-CD1 3.78Å; Y276-F315 HydrophobicContact CD2-CD2 4.18Å; Y276-F315 AromaticContact CD2-CG 3.56Å; Y276-F315 HydrophobicContact CD2-CG 3.56Å; Y276-F315 HydrophobicContact CE2-CB 3.72Å; Y276-F315 HydrophobicContact CE2-CD1 4.11Å; Y276-F315 AromaticContact CE2-CD2 3.69Å; Y276-F315 HydrophobicContact CE2-CD2 3.69Å; Y276-F315 HydrophobicContact CE2-CE2 4.3Å; Y276-F315 AromaticContact CE2-CG 3.57Å; Y276-F315 HydrophobicContact CE2-CG 3.57Å; Y276-T317 VanDerWaalsContact CB-CG2 3.45Å; Y276-T317 HydrophobicContact CD1-CG2 4Å; Y276-T317 HydrophobicContact CD2-CG2 3.65Å; Y276-T317 HydrophobicContact CE2-CG2 4.44Å; Y276-T317 HydrophobicContact CG-CG2 3.39Å
277	Q	96.5	Very high	94.4	Very high	89 Å²	89	66.8 Å²	66.8	42%	0.416	30%	0.304	S	S	.	.	H	α-helix	trans	-67.8	-43	-174.9	-168.3	59.9	50.5	0	0	110.9	S275 M279 L280 D281	S275-Q277 PolarHBondContact O-N 2.89Å; Q277-M279 PolarHBondContact O-N 2.73Å; Q277-L280 PolarHBondContact O-N 3.27Å; Q277-D281 PolarHBondContact NE2-OD1 3.14Å; Q277-D281 PolarHBondContact NE2-OD2 3.45Å; Q277-D281 WeakPolarHBondContact O-CB 3.38Å; Q277-D281 PolarHBondContact O-N 2.78Å
278	E	97.2	Very high	95	Very high	73 Å²	73	64.5 Å²	64.5	34%	0.341	30%	0.304	S	S	.	.	H	α-helix	trans	-58.9	-47.2	175	-71.1	172.6	153.4	0	0	111.8	R234 V274 S275 D281 Q282	R234-E278 IonicContact CZ-OE1 3.88Å; R234-E278 IonicContact NH2-OE1 2.83Å; R234-E278 PolarHBondContact NH2-OE1 3Å; R234-E278 IonicContact NH2-OE2 2.96Å; R234-E278 PolarHBondContact NH2-OE2 3.31Å; V274-E278 WeakPolarHBondContact CA-OE2 3.35Å; V274-E278 HydrophobicContact CG1-CB 3.92Å; S275-E278 PolarHBondContact N-OE2 3.03Å; S275-E278 PolarHBondContact O-N 3.13Å; S275-E278 VanDerWaalsContact OG-CG 3.31Å; S275-E278 WeakPolarHBondContact OG-CG 3.36Å; S275-E278 PolarHBondContact OG-N 3.34Å; E278-D281 PolarHBondContact O-N 2.82Å; E278-Q282 WeakPolarHBondContact O-CG 3.46Å; E278-Q282 PolarHBondContact O-N 2.88Å; E278-Q282 VanDerWaalsContact O-N 3.1Å
279	M	97.9	Very high	95.5	Very high	1 Å²	1	68.1 Å²	68.1	1%	0.005	33%	0.327	C	S	.	.	H	α-helix	trans	-63.1	-43.6	177.7	-65.8	-175.6	-83	0	0	111.5	V232 L241 F257 E259 V274 S275 Y276 Q277 I283 F315	V232-M279 HydrophobicContact CB-SD 3.83Å; V232-M279 HydrophobicContact CG1-SD 4.09Å; V232-M279 HydrophobicContact CG2-SD 3.72Å; L241-M279 HydrophobicContact CD1-CB 4.17Å; L241-M279 HydrophobicContact CD1-CG 3.94Å; L241-M279 HydrophobicContact CD2-CG 4.26Å; L241-M279 HydrophobicContact CD2-SD 4.23Å; F257-M279 HydrophobicContact CB-CE 4.48Å; F257-M279 HydrophobicContact CB-SD 3.78Å; F257-M279 HydrophobicContact CG-SD 4.47Å; E259-M279 HydrophobicContact CG-CE 4Å; V274-M279 HydrophobicContact CB-CG 4.26Å; V274-M279 HydrophobicContact CG1-CG 3.58Å; S275-M279 WeakPolarHBondContact O-CG 3.43Å; S275-M279 PolarHBondContact O-N 2.87Å; Y276-M279 PolarHBondContact O-N 2.77Å; Q277-M279 PolarHBondContact O-N 2.73Å; M279-I283 WeakPolarHBondContact O-CD1 3.29Å; M279-I283 VanDerWaalsContact O-CG1 3.31Å; M279-I283 WeakPolarHBondContact O-CG1 3.42Å; M279-I283 PolarHBondContact O-N 3.45Å; M279-I283 VanDerWaalsContact O-N 3.09Å; M279-F315 HydrophobicContact CB-CD1 4.36Å; M279-F315 HydrophobicContact CB-CE1 3.84Å; M279-F315 HydrophobicContact CE-CD1 4.4Å
280	L	97.3	Very high	96	Very high	2 Å²	2	65.3 Å²	65.3	1%	0.01	31%	0.312	C	S	.	.	H	α-helix	trans	-64.6	-42.4	-179.9	-178.7	64.1	0	0	0	111.8	Y276 Q277 I283 R284 L290 F304 F315	Y276-L280 HydrophobicContact CE1-CD2 4.45Å; Y276-L280 HydrophobicContact CE2-CB 4.23Å; Y276-L280 HydrophobicContact CE2-CD2 4.06Å; Y276-L280 VanDerWaalsContact O-CB 3.27Å; Y276-L280 WeakPolarHBondContact O-CB 3.34Å; Y276-L280 PolarHBondContact O-N 2.95Å; Y276-L280 WeakPolarHBondContact OH-CD2 3.46Å; Q277-L280 PolarHBondContact O-N 3.27Å; L280-I283 PolarHBondContact O-N 2.93Å; L280-R284 HydrophobicContact CD1-CG 4.4Å; L280-R284 WeakPolarHBondContact O-CB 3.22Å; L280-R284 WeakPolarHBondContact O-CG 3.41Å; L280-R284 PolarHBondContact O-N 2.81Å; L280-L290 HydrophobicContact CD1-CD2 3.64Å; L280-F304 HydrophobicContact CD1-CD1 4.43Å; L280-F304 HydrophobicContact CD1-CE1 4.16Å; L280-F304 HydrophobicContact CD1-CZ 4.31Å; L280-F304 HydrophobicContact CD2-CZ 4.49Å; L280-F315 HydrophobicContact CB-CZ 4.49Å; L280-F315 HydrophobicContact CD1-CE2 4.09Å; L280-F315 HydrophobicContact CD1-CZ 4.14Å
281	D	97.4	Very high	96.4	Very high	67 Å²	67	65.8 Å²	65.8	36%	0.358	32%	0.316	S	S	.	.	H	α-helix	trans	-65.5	-42.6	-180	-69.4	-20.4	0	0	0	111.1	Q277 E278 I283 R284 Q285	Q277-D281 PolarHBondContact NE2-OD1 3.14Å; Q277-D281 PolarHBondContact NE2-OD2 3.45Å; Q277-D281 WeakPolarHBondContact O-CB 3.38Å; Q277-D281 PolarHBondContact O-N 2.78Å; E278-D281 PolarHBondContact O-N 2.82Å; D281-I283 PolarHBondContact O-N 3.43Å; D281-R284 PolarHBondContact O-N 3.04Å; D281-Q285 WeakPolarHBondContact O-CG 3.35Å; D281-Q285 PolarHBondContact O-N 2.85Å
282	Q	97.1	Very high	96.5	Very high	77 Å²	77	65.3 Å²	65.3	36%	0.36	31%	0.309	S	S	.	.	H	α-helix	trans	-60.5	-44.8	174.2	-74.4	-179.7	-17.6	0	0	112.1	E278 R284 Q285	E278-Q282 WeakPolarHBondContact O-CG 3.46Å; E278-Q282 PolarHBondContact O-N 2.88Å; E278-Q282 VanDerWaalsContact O-N 3.1Å; Q282-R284 VanDerWaalsContact C-N 3.33Å; Q282-R284 PolarHBondContact O-N 2.88Å; Q282-Q285 PolarHBondContact O-N 3.28Å
283	I	97.8	Very high	96.5	Very high	0 Å²	0	63.5 Å²	63.5	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-65	-39.8	177.7	-68.9	165.7	0	0	0	110.8	L242 V245 F257 M279 L280 D281 Q285 Q286 W287 L290 L313 F315	L242-I283 HydrophobicContact CD2-CG1 4.27Å; V245-I283 HydrophobicContact CG2-CD1 3.85Å; V245-I283 HydrophobicContact CG2-CG1 3.95Å; V245-I283 HydrophobicContact CG2-CG2 4.13Å; F257-I283 HydrophobicContact CD2-CD1 4.3Å; F257-I283 HydrophobicContact CE2-CD1 3.81Å; F257-I283 HydrophobicContact CZ-CD1 4.49Å; M279-I283 WeakPolarHBondContact O-CD1 3.29Å; M279-I283 VanDerWaalsContact O-CG1 3.31Å; M279-I283 WeakPolarHBondContact O-CG1 3.42Å; M279-I283 PolarHBondContact O-N 3.45Å; M279-I283 VanDerWaalsContact O-N 3.09Å; L280-I283 PolarHBondContact O-N 2.93Å; D281-I283 PolarHBondContact O-N 3.43Å; I283-Q285 VanDerWaalsContact C-N 3.31Å; I283-Q285 PolarHBondContact O-N 2.83Å; I283-Q286 PolarHBondContact O-N 3.42Å; I283-W287 HydrophobicContact CG2-CE3 3.89Å; I283-W287 HydrophobicContact CG2-CZ3 4.42Å; I283-W287 PolarHBondContact O-N 3.35Å; I283-L290 HydrophobicContact CG2-CD2 3.94Å; I283-L313 HydrophobicContact CD1-CD1 4.49Å; I283-L313 HydrophobicContact CG2-CD1 4.22Å; I283-F315 HydrophobicContact CD1-CE1 4.01Å; I283-F315 HydrophobicContact CD1-CZ 3.7Å
284	R	97.5	Very high	96.1	Very high	98 Å²	98	72.7 Å²	72.7	37%	0.37	35%	0.346	S	S	.	.	H	α-helix	trans	-68.3	-25.9	179.1	-80.5	177.2	170.2	166	-5	114	L280 D281 Q282 Q286 W287 P288 L290	L280-R284 HydrophobicContact CD1-CG 4.4Å; L280-R284 WeakPolarHBondContact O-CB 3.22Å; L280-R284 WeakPolarHBondContact O-CG 3.41Å; L280-R284 PolarHBondContact O-N 2.81Å; D281-R284 PolarHBondContact O-N 3.04Å; Q282-R284 VanDerWaalsContact C-N 3.33Å; Q282-R284 PolarHBondContact O-N 2.88Å; R284-Q286 PolarHBondContact O-N 2.91Å; R284-W287 CarbonylContact O-C 3.54Å; R284-P288 VanDerWaalsContact O-CA 3.31Å; R284-P288 WeakPolarHBondContact O-CA 3.28Å; R284-P288 WeakPolarHBondContact O-CD 3.28Å; R284-P288 WeakPolarHBondContact O-CG 3.19Å; R284-P288 VanDerWaalsContact O-N 3.14Å; R284-L290 HydrophobicContact CG-CB 4.47Å; R284-L290 HydrophobicContact CG-CD2 4.46Å
285	Q	97.4	Very high	95.2	Very high	157 Å²	157	74.7 Å²	74.7	73%	0.734	36%	0.36	S	S	*	.	H	α-helix	trans	-60.5	-37.5	172.8	-73.1	169.9	17.6	0	0	111.4	D281 Q282 I283	D281-Q285 WeakPolarHBondContact O-CG 3.35Å; D281-Q285 PolarHBondContact O-N 2.85Å; Q282-Q285 PolarHBondContact O-N 3.28Å; I283-Q285 VanDerWaalsContact C-N 3.31Å; I283-Q285 PolarHBondContact O-N 2.83Å
286	Q	97.4	Very high	94.2	Very high	115 Å²	115	74.9 Å²	74.9	54%	0.537	37%	0.367	S	S	.	.	H	α-helix	trans	-88.4	-36.9	177.6	-174.5	62.2	19.1	0	0	113	L242 I283 R284 P288	L242-Q286 HydrophobicContact CD1-CB 4.3Å; L242-Q286 HydrophobicContact CD2-CB 4.16Å; I283-Q286 PolarHBondContact O-N 3.42Å; R284-Q286 PolarHBondContact O-N 2.91Å; Q286-P288 WeakPolarHBondContact O-CD 3.45Å
287	W	97.7	Very high	92.9	Very high	34 Å²	34	79.9 Å²	79.9	13%	0.129	40%	0.402	C	S	.	.			trans	-124.7	81	178.2	-60.3	-78	0	0	0	111.3	L242 V245 I283 R284 N289 L290 V306 F309	L242-W287 HydrophobicContact CB-CH2 4.09Å; L242-W287 HydrophobicContact CB-CZ3 4.12Å; L242-W287 HydrophobicContact CD2-CE3 4.33Å; L242-W287 HydrophobicContact CD2-CH2 4.37Å; L242-W287 HydrophobicContact CD2-CZ3 3.58Å; L242-W287 HydrophobicContact CG-CZ3 4.4Å; L242-W287 WeakPolarHBondContact O-CH2 3.4Å; V245-W287 HydrophobicContact CB-CE3 4.27Å; V245-W287 HydrophobicContact CB-CH2 3.67Å; V245-W287 HydrophobicContact CB-CZ3 3.51Å; V245-W287 HydrophobicContact CG1-CD2 4.11Å; V245-W287 HydrophobicContact CG1-CE3 3.69Å; V245-W287 HydrophobicContact CG1-CH2 3.57Å; V245-W287 HydrophobicContact CG1-CZ2 4.01Å; V245-W287 HydrophobicContact CG1-CZ3 3.38Å; V245-W287 HydrophobicContact CG2-CZ3 4.05Å; I283-W287 HydrophobicContact CG2-CE3 3.89Å; I283-W287 HydrophobicContact CG2-CZ3 4.42Å; I283-W287 PolarHBondContact O-N 3.35Å; R284-W287 CarbonylContact O-C 3.54Å; W287-N289 PolarHBondContact O-N 2.77Å; W287-L290 WeakPolarHBondContact O-CB 3.45Å; W287-L290 PolarHBondContact O-N 3.34Å; W287-V306 HydrophobicContact CB-CG1 4.28Å; W287-V306 HydrophobicContact CB-CG2 4.16Å; W287-V306 VanDerWaalsContact CD1-CG1 3.49Å; W287-V306 HydrophobicContact CD2-CG2 4.29Å; W287-V306 HydrophobicContact CG-CG1 3.91Å; W287-V306 HydrophobicContact CG-CG2 4Å; W287-F309 HydrophobicContact CZ2-CE2 4.44Å; W287-F309 HydrophobicContact CZ2-CZ 4.22Å; W287-F309 AromaticContact NE1-CZ 3.71Å
288	P	96	Very high	92	Very high	97 Å²	97	77.1 Å²	77.1	63%	0.63	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-28.8	-179	-25.2	34.4	0	0	0	113.8	R284 Q286 L290	R284-P288 VanDerWaalsContact O-CA 3.31Å; R284-P288 WeakPolarHBondContact O-CA 3.28Å; R284-P288 WeakPolarHBondContact O-CD 3.28Å; R284-P288 WeakPolarHBondContact O-CG 3.19Å; R284-P288 VanDerWaalsContact O-N 3.14Å; Q286-P288 WeakPolarHBondContact O-CD 3.45Å; P288-L290 PolarHBondContact O-N 3.26Å
289	N	95.3	Very high	91.3	Very high	126 Å²	126	77.9 Å²	77.9	67%	0.674	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	19.8	-179.8	-58.8	-24.6	0	0	0	113.1	W287 E291 P307	W287-N289 PolarHBondContact O-N 2.77Å; N289-E291 PolarHBondContact O-N 2.91Å; N289-P307 HydrophobicContact CB-CG 4.22Å; N289-P307 WeakPolarHBondContact O-CD 3.22Å; N289-P307 VanDerWaalsContact O-CG 3.29Å; N289-P307 WeakPolarHBondContact O-CG 3.33Å
290	L	96.6	Very high	90.8	Very high	12 Å²	12	79 Å²	79	6%	0.063	41%	0.408	C	S	.	.	P	Polyproline II helix	trans	-63.7	118.3	178.1	-176.2	77.6	0	0	0	111	L280 I283 R284 W287 P288 F304 V306 L313	L280-L290 HydrophobicContact CD1-CD2 3.64Å; I283-L290 HydrophobicContact CG2-CD2 3.94Å; R284-L290 HydrophobicContact CG-CB 4.47Å; R284-L290 HydrophobicContact CG-CD2 4.46Å; W287-L290 WeakPolarHBondContact O-CB 3.45Å; W287-L290 PolarHBondContact O-N 3.34Å; P288-L290 PolarHBondContact O-N 3.26Å; L290-F304 HydrophobicContact CD1-CB 4Å; L290-F304 HydrophobicContact CD2-CB 4.01Å; L290-F304 HydrophobicContact CD2-CD1 3.84Å; L290-F304 HydrophobicContact CD2-CG 4.1Å; L290-F304 HydrophobicContact CG-CB 3.95Å; L290-F304 HydrophobicContact CG-CD1 3.97Å; L290-F304 HydrophobicContact CG-CG 4.34Å; L290-V306 HydrophobicContact CD1-CB 4.45Å; L290-V306 HydrophobicContact CD1-CG2 3.5Å; L290-L313 HydrophobicContact CD1-CD1 4Å
291	E	96.1	Very high	90.5	Very high	114 Å²	114	79.1 Å²	79.1	53%	0.533	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	138.8	-175.5	-68.9	174.9	-171.1	0	0	111.6	N289 F304 K305 P307	N289-E291 PolarHBondContact O-N 2.91Å; E291-F304 CarbonylContact O-C 3.51Å; E291-F304 WeakPolarHBondContact O-CA 3.33Å; E291-F304 WeakPolarHBondContact O-CB 3.46Å; E291-F304 WeakPolarHBondContact O-CD1 3.25Å; E291-K305 PolarHBondContact N-O 3.16Å; E291-K305 PolarHBondContact O-N 3.29Å; E291-P307 HydrophobicContact CG-CG 4.41Å
292	R	95.5	Very high	90.3	Very high	155 Å²	155	77.1 Å²	77.1	59%	0.585	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.3	127.3	171.3	-170.7	175.2	178.7	179.2	-1.5	109.4	F304	R292-F304 HydrophobicContact CB-CD1 3.88Å; R292-F304 HydrophobicContact CB-CE1 3.54Å; R292-F304 HydrophobicContact CB-CZ 4Å; R292-F304 HydrophobicContact CG-CD1 4.35Å; R292-F304 HydrophobicContact CG-CE1 3.89Å; R292-F304 HydrophobicContact CG-CE2 4.24Å; R292-F304 HydrophobicContact CG-CZ 3.81Å
293	L	93.4	Very high	90.3	Very high	53 Å²	53	74 Å²	74	28%	0.277	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-84.6	148.7	174	-59.2	-173.4	0	0	0	110.8	S295 T303 K305	L293-S295 PolarHBondContact O-N 2.74Å; L293-S295 PolarHBondContact O-OG 3.3Å; L293-T303 HydrophobicContact CB-CG2 4.29Å; L293-T303 HydrophobicContact CD1-CG2 3.89Å; L293-T303 HydrophobicContact CG-CG2 4.4Å; L293-T303 PolarHBondContact N-O 3.26Å; L293-K305 HydrophobicContact CD1-CB 4.06Å; L293-K305 HydrophobicContact CD2-CB 4.03Å; L293-K305 HydrophobicContact CG-CB 4.08Å
294	Q	85.2	Confident	90.2	Very high	202 Å²	202	74 Å²	74	94%	0.944	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-60.1	126.7	169.9	-71.5	-175.1	-2	0	0	109.1
295	S	76.9	Confident	90.2	Very high	45 Å²	45	72.8 Å²	72.8	32%	0.315	38%	0.381	S	S	.	.			trans	-106.2	145.9	178.6	-50.2	0	0	0	0	108.7	L293	L293-S295 PolarHBondContact O-N 2.74Å; L293-S295 PolarHBondContact O-OG 3.3Å
296	G	76	Confident	90.2	Very high	32 Å²	32	65.7 Å²	65.7	33%	0.33	35%	0.348	S	S	.	.			trans	-62.7	158.2	172.5	0	0	0	0	0	111.5	A298 D299	G296-A298 PolarHBondContact O-N 3.1Å; G296-A298 VanDerWaalsContact O-N 3.11Å; G296-D299 PolarHBondContact N-OD2 2.74Å; G296-D299 WeakPolarHBondContact O-CB 3.43Å; G296-D299 PolarHBondContact O-N 3.01Å
297	P	68.6	Low	90.2	Very high	128 Å²	128	63.2 Å²	63.2	83%	0.831	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-30.1	-173.1	19.7	-31	0	0	0	113.9	S326	P297-S326 WeakPolarHBondContact O-CB 3.45Å; P297-S326 PolarHBondContact O-OG 2.85Å
298	A	77.6	Confident	90.1	Very high	32 Å²	32	65.5 Å²	65.5	26%	0.264	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	11.8	179.8	0	0	0	0	0	114	G296 T300 N328	G296-A298 PolarHBondContact O-N 3.1Å; G296-A298 VanDerWaalsContact O-N 3.11Å; A298-T300 PolarHBondContact O-N 3.47Å; A298-N328 HydrophobicContact CB-CB 4.4Å
299	D	83.5	Confident	90.2	Very high	88 Å²	88	61.8 Å²	61.8	47%	0.471	35%	0.35	S	S	.	.			trans	-66.4	133.6	179.6	-81.1	-17.1	0	0	0	111.1	G296	G296-D299 PolarHBondContact N-OD2 2.74Å; G296-D299 WeakPolarHBondContact O-CB 3.43Å; G296-D299 PolarHBondContact O-N 3.01Å
300	T	85.5	Confident	90.2	Very high	24 Å²	24	62.7 Å²	62.7	15%	0.147	35%	0.348	C	S	.	.	S	Bend	trans	-80.9	-31.2	-177.1	-48.9	0	0	0	0	111.9	A298 I316 F323 R329	A298-T300 PolarHBondContact O-N 3.47Å; T300-I316 HydrophobicContact CG2-CG2 4.07Å; T300-F323 HydrophobicContact CG2-CD1 3.89Å; T300-F323 HydrophobicContact CG2-CD2 4.16Å; T300-F323 HydrophobicContact CG2-CE1 3.48Å; T300-F323 VanDerWaalsContact CG2-CE1 3.48Å; T300-F323 HydrophobicContact CG2-CE2 3.83Å; T300-F323 HydrophobicContact CG2-CG 4.22Å; T300-F323 HydrophobicContact CG2-CZ 3.45Å; T300-F323 VanDerWaalsContact CG2-CZ 3.45Å; T300-F323 WeakPolarHBondContact O-CD1 3.23Å; T300-R329 VanDerWaalsContact OG1-CZ 3.27Å; T300-R329 PolarHBondContact OG1-NH1 3.11Å; T300-R329 PolarHBondContact OG1-NH2 3.42Å
301	A	91.3	Very high	90.2	Very high	5 Å²	5	62.3 Å²	62.3	4%	0.041	35%	0.347	C	S	.	.	S	Bend	trans	-100.2	136.8	-177.4	0	0	0	0	0	109.3	T303 F315 I316	A301-T303 PolarHBondContact O-N 3.24Å; A301-F315 VanDerWaalsContact CA-O 3.29Å; A301-F315 WeakPolarHBondContact CA-O 3.03Å; A301-I316 HydrophobicContact CB-CG1 4.14Å
302	K	94.3	Very high	90.2	Very high	25 Å²	25	59.4 Å²	59.4	11%	0.109	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	111.7	163.6	-63.2	167	-177.4	150.4	0	107.4	Y276 F304 G314 F315 T317 D321	Y276-K302 HydrophobicContact CE1-CD 4.03Å; Y276-K302 HydrophobicContact CE2-CD 4.29Å; K302-F304 HydrophobicContact CB-CE2 3.94Å; K302-F304 WeakPolarHBondContact O-CD2 3.38Å; K302-G314 CarbonylContact O-C 3.56Å; K302-G314 WeakPolarHBondContact O-CA 3.38Å; K302-F315 PolarHBondContact N-O 2.91Å; K302-F315 PolarHBondContact O-N 2.86Å; K302-T317 HydrophobicContact CD-CG2 4.16Å; K302-T317 PolarHBondContact NZ-OG1 2.8Å; K302-D321 WeakPolarHBondContact CE-OD2 3.39Å; K302-D321 VanDerWaalsContact NZ-CG 3.29Å; K302-D321 IonicContact NZ-OD2 3.82Å; K302-D321 PolarHBondContact NZ-OD2 3.36Å
303	T	95.8	Very high	90.3	Very high	11 Å²	11	52.1 Å²	52.1	7%	0.067	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	138.5	-172.4	-49.5	0	0	0	0	111.3	L293 A301 Q312 L313	L293-T303 HydrophobicContact CB-CG2 4.29Å; L293-T303 HydrophobicContact CD1-CG2 3.89Å; L293-T303 HydrophobicContact CG-CG2 4.4Å; L293-T303 PolarHBondContact N-O 3.26Å; A301-T303 PolarHBondContact O-N 3.24Å; T303-Q312 HydrophobicContact CG2-CB 4.24Å; T303-Q312 HydrophobicContact CG2-CG 3.97Å; T303-L313 CarbonylContact C-O 3.59Å; T303-L313 VanDerWaalsContact CA-O 3.24Å; T303-L313 WeakPolarHBondContact CA-O 3.34Å; T303-L313 WeakPolarHBondContact CG2-O 3.46Å
304	F	97.1	Very high	90.5	Very high	2 Å²	2	49.6 Å²	49.6	1%	0.009	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	158.5	177.9	-70.4	-100.7	0	0	0	110.5	Y276 L280 L290 E291 R292 K302 Q312 L313 F315	Y276-F304 HydrophobicContact CE2-CE2 4.31Å; Y276-F304 WeakPolarHBondContact OH-CE2 3.49Å; Y276-F304 WeakPolarHBondContact OH-CZ 3.48Å; L280-F304 HydrophobicContact CD1-CD1 4.43Å; L280-F304 HydrophobicContact CD1-CE1 4.16Å; L280-F304 HydrophobicContact CD1-CZ 4.31Å; L280-F304 HydrophobicContact CD2-CZ 4.49Å; L290-F304 HydrophobicContact CD1-CB 4Å; L290-F304 HydrophobicContact CD2-CB 4.01Å; L290-F304 HydrophobicContact CD2-CD1 3.84Å; L290-F304 HydrophobicContact CD2-CG 4.1Å; L290-F304 HydrophobicContact CG-CB 3.95Å; L290-F304 HydrophobicContact CG-CD1 3.97Å; L290-F304 HydrophobicContact CG-CG 4.34Å; E291-F304 CarbonylContact O-C 3.51Å; E291-F304 WeakPolarHBondContact O-CA 3.33Å; E291-F304 WeakPolarHBondContact O-CB 3.46Å; E291-F304 WeakPolarHBondContact O-CD1 3.25Å; R292-F304 HydrophobicContact CB-CD1 3.88Å; R292-F304 HydrophobicContact CB-CE1 3.54Å; R292-F304 HydrophobicContact CB-CZ 4Å; R292-F304 HydrophobicContact CG-CD1 4.35Å; R292-F304 HydrophobicContact CG-CE1 3.89Å; R292-F304 HydrophobicContact CG-CE2 4.24Å; R292-F304 HydrophobicContact CG-CZ 3.81Å; K302-F304 HydrophobicContact CB-CE2 3.94Å; K302-F304 WeakPolarHBondContact O-CD2 3.38Å; F304-Q312 WeakPolarHBondContact O-CB 3.4Å; F304-L313 HydrophobicContact CB-CB 4.45Å; F304-L313 PolarHBondContact N-O 2.78Å; F304-L313 PolarHBondContact O-N 3.36Å; F304-F315 AromaticContact CD2-CD2 3.59Å; F304-F315 HydrophobicContact CD2-CD2 3.59Å; F304-F315 AromaticContact CD2-CE2 3.58Å; F304-F315 HydrophobicContact CD2-CE2 3.58Å; F304-F315 AromaticContact CE2-CD2 3.8Å; F304-F315 HydrophobicContact CE2-CD2 3.8Å; F304-F315 HydrophobicContact CE2-CE2 4.03Å; F304-F315 HydrophobicContact CG-CE2 4.19Å
305	K	97	Very high	91	Very high	72 Å²	72	40 Å²	40	31%	0.313	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	136.9	176.5	-173.6	168.8	-175.4	176.2	0	110.6	E291 L293 F309	E291-K305 PolarHBondContact N-O 3.16Å; E291-K305 PolarHBondContact O-N 3.29Å; L293-K305 HydrophobicContact CD1-CB 4.06Å; L293-K305 HydrophobicContact CD2-CB 4.03Å; L293-K305 HydrophobicContact CG-CB 4.08Å; K305-F309 WeakPolarHBondContact CE-O 3.48Å; K305-F309 PolarHBondContact NZ-O 3.12Å
306	V	97.8	Very high	91.9	Very high	8 Å²	8	38.8 Å²	38.8	5%	0.048	24%	0.238	C	C	.	.			trans	-82.6	125.4	167.8	179.8	0	0	0	0	107.4	V245 W287 L290 G308 F309	V245-V306 HydrophobicContact CG1-CG2 3.95Å; W287-V306 HydrophobicContact CB-CG1 4.28Å; W287-V306 HydrophobicContact CB-CG2 4.16Å; W287-V306 VanDerWaalsContact CD1-CG1 3.49Å; W287-V306 HydrophobicContact CD2-CG2 4.29Å; W287-V306 HydrophobicContact CG-CG1 3.91Å; W287-V306 HydrophobicContact CG-CG2 4Å; L290-V306 HydrophobicContact CD1-CB 4.45Å; L290-V306 HydrophobicContact CD1-CG2 3.5Å; V306-G308 PolarHBondContact O-N 3.04Å; V306-F309 HydrophobicContact CB-CB 4.17Å; V306-F309 HydrophobicContact CB-CD1 4.04Å; V306-F309 HydrophobicContact CB-CD2 3.77Å; V306-F309 HydrophobicContact CB-CE1 4.42Å; V306-F309 HydrophobicContact CB-CE2 4.18Å; V306-F309 HydrophobicContact CB-CG 3.71Å; V306-F309 HydrophobicContact CB-CZ 4.5Å; V306-F309 HydrophobicContact CG1-CD1 3.73Å; V306-F309 HydrophobicContact CG1-CD2 4.18Å; V306-F309 HydrophobicContact CG1-CE1 3.79Å; V306-F309 HydrophobicContact CG1-CE2 4.23Å; V306-F309 HydrophobicContact CG1-CG 3.95Å; V306-F309 HydrophobicContact CG1-CZ 4.06Å; V306-F309 HydrophobicContact CG2-CD2 4.16Å; V306-F309 HydrophobicContact CG2-CE2 4.3Å; V306-F309 WeakPolarHBondContact O-CB 3.37Å; V306-F309 PolarHBondContact O-N 2.85Å
307	P	96.8	Very high	92.7	Very high	63 Å²	63	37.3 Å²	37.3	41%	0.409	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.1	134.8	176	-28.9	36.5	0	0	0	111.9	N289 E291 F309	N289-P307 HydrophobicContact CB-CG 4.22Å; N289-P307 WeakPolarHBondContact O-CD 3.22Å; N289-P307 VanDerWaalsContact O-CG 3.29Å; N289-P307 WeakPolarHBondContact O-CG 3.33Å; E291-P307 HydrophobicContact CG-CG 4.41Å; P307-F309 VanDerWaalsContact C-N 3.29Å; P307-F309 PolarHBondContact O-N 2.92Å
308	G	95.8	Very high	93.6	Very high	81 Å²	81	31.5 Å²	31.5	84%	0.835	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.7	-16	-176.6	0	0	0	0	0	115.5	V306	V306-G308 PolarHBondContact O-N 3.04Å
309	F	97.3	Very high	94.1	Very high	19 Å²	19	31 Å²	31	8%	0.083	18%	0.177	C	C	.	.			trans	-78.5	145.7	177.6	-75.2	24.8	0	0	0	110.7	V245 T248 E249 W287 K305 V306 P307	V245-F309 HydrophobicContact CG1-CE2 4.08Å; T248-F309 WeakPolarHBondContact OG1-CD2 3.5Å; E249-F309 HydrophobicContact CB-CD1 4.12Å; E249-F309 HydrophobicContact CB-CD2 3.93Å; E249-F309 HydrophobicContact CB-CE1 4.01Å; E249-F309 HydrophobicContact CB-CE2 3.81Å; E249-F309 HydrophobicContact CB-CG 4.08Å; E249-F309 HydrophobicContact CB-CZ 3.85Å; E249-F309 HydrophobicContact CG-CD1 3.94Å; E249-F309 HydrophobicContact CG-CE1 3.78Å; E249-F309 HydrophobicContact CG-CE2 4.49Å; E249-F309 HydrophobicContact CG-CG 4.36Å; E249-F309 HydrophobicContact CG-CZ 4.07Å; W287-F309 HydrophobicContact CZ2-CE2 4.44Å; W287-F309 HydrophobicContact CZ2-CZ 4.22Å; W287-F309 AromaticContact NE1-CZ 3.71Å; K305-F309 WeakPolarHBondContact CE-O 3.48Å; K305-F309 PolarHBondContact NZ-O 3.12Å; V306-F309 HydrophobicContact CB-CB 4.17Å; V306-F309 HydrophobicContact CB-CD1 4.04Å; V306-F309 HydrophobicContact CB-CD2 3.77Å; V306-F309 HydrophobicContact CB-CE1 4.42Å; V306-F309 HydrophobicContact CB-CE2 4.18Å; V306-F309 HydrophobicContact CB-CG 3.71Å; V306-F309 HydrophobicContact CB-CZ 4.5Å; V306-F309 HydrophobicContact CG1-CD1 3.73Å; V306-F309 HydrophobicContact CG1-CD2 4.18Å; V306-F309 HydrophobicContact CG1-CE1 3.79Å; V306-F309 HydrophobicContact CG1-CE2 4.23Å; V306-F309 HydrophobicContact CG1-CG 3.95Å; V306-F309 HydrophobicContact CG1-CZ 4.06Å; V306-F309 HydrophobicContact CG2-CD2 4.16Å; V306-F309 HydrophobicContact CG2-CE2 4.3Å; V306-F309 WeakPolarHBondContact O-CB 3.37Å; V306-F309 PolarHBondContact O-N 2.85Å; P307-F309 VanDerWaalsContact C-N 3.29Å; P307-F309 PolarHBondContact O-N 2.92Å
310	K	96.3	Very high	94.4	Very high	146 Å²	146	29.6 Å²	29.6	64%	0.635	17%	0.174	S	C	*	.	S	Bend	trans	-73.1	-41.6	177.2	-70.4	-166.4	-172.7	173.1	0	112.3	T248 E249 K250	T248-K310 PolarHBondContact O-N 3.44Å; E249-K310 PolarHBondContact O-N 3.06Å; K250-K310 WeakPolarHBondContact O-CD 3.19Å
311	G	96.6	Very high	94.6	Very high	4 Å²	4	32.6 Å²	32.6	4%	0.041	19%	0.19	C	C	.	.	S	Bend	trans	-88.3	-166.1	-179.3	0	0	0	0	0	113.7	T248 K251 L253	T248-G311 PolarHBondContact O-N 3.23Å; K251-G311 WeakPolarHBondContact O-CA 3.29Å; K251-G311 PolarHBondContact O-N 2.69Å; L253-G311 CarbonylContact O-C 3.49Å; L253-G311 WeakPolarHBondContact O-CA 3.06Å
312	Q	96.9	Very high	94.5	Very high	53 Å²	53	34.8 Å²	34.8	25%	0.248	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	166.2	-177.8	70.1	-169.4	35.5	0	0	111.4	L253 E254 V255 T303 F304	L253-Q312 PolarHBondContact O-N 3.4Å; E254-Q312 VanDerWaalsContact CA-O 3.3Å; E254-Q312 WeakPolarHBondContact CA-O 3.4Å; E254-Q312 HydrophobicContact CB-CG 3.87Å; E254-Q312 HydrophobicContact CG-CG 3.78Å; E254-Q312 PolarHBondContact OE2-NE2 3.14Å; V255-Q312 PolarHBondContact N-O 2.81Å; T303-Q312 HydrophobicContact CG2-CB 4.24Å; T303-Q312 HydrophobicContact CG2-CG 3.97Å; F304-Q312 WeakPolarHBondContact O-CB 3.4Å
313	L	96.9	Very high	94.4	Very high	1 Å²	1	35.6 Å²	35.6	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	151.7	179.9	-51.4	175.7	0	0	0	110	V245 T248 V255 F257 I283 L290 T303 F304	V245-L313 HydrophobicContact CB-CD1 4.27Å; V245-L313 HydrophobicContact CB-CD2 4.21Å; V245-L313 HydrophobicContact CG1-CD1 3.87Å; V245-L313 HydrophobicContact CG1-CD2 4.25Å; V245-L313 HydrophobicContact CG2-CD1 3.51Å; V245-L313 HydrophobicContact CG2-CD2 3.79Å; V245-L313 HydrophobicContact CG2-CG 4.28Å; T248-L313 HydrophobicContact CG2-CD2 3.99Å; V255-L313 HydrophobicContact CB-CD2 4.3Å; V255-L313 CarbonylContact O-C 3.59Å; V255-L313 VanDerWaalsContact O-CA 3.29Å; V255-L313 WeakPolarHBondContact O-CA 3.42Å; F257-L313 HydrophobicContact CE2-CD2 4.27Å; I283-L313 HydrophobicContact CD1-CD1 4.49Å; I283-L313 HydrophobicContact CG2-CD1 4.22Å; L290-L313 HydrophobicContact CD1-CD1 4Å; T303-L313 CarbonylContact C-O 3.59Å; T303-L313 VanDerWaalsContact CA-O 3.24Å; T303-L313 WeakPolarHBondContact CA-O 3.34Å; T303-L313 WeakPolarHBondContact CG2-O 3.46Å; F304-L313 HydrophobicContact CB-CB 4.45Å; F304-L313 PolarHBondContact N-O 2.78Å; F304-L313 PolarHBondContact O-N 3.36Å
314	G	96.8	Very high	94.2	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	143.7	173.1	0	0	0	0	0	111.3	V255 R256 F257 K302	V255-G314 PolarHBondContact O-N 2.81Å; R256-G314 CarbonylContact C-O 3.5Å; R256-G314 WeakPolarHBondContact CA-O 3.41Å; F257-G314 PolarHBondContact N-O 3.22Å; K302-G314 CarbonylContact O-C 3.56Å; K302-G314 WeakPolarHBondContact O-CA 3.38Å
315	F	97.3	Very high	93.9	Very high	1 Å²	1	38.4 Å²	38.4	0%	0.004	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	120.4	173.1	-60.6	-90	0	0	0	110.2	F257 Y276 M279 L280 I283 A301 K302 F304 T317	F257-F315 HydrophobicContact CB-CD1 4.14Å; F257-F315 HydrophobicContact CB-CE1 4.45Å; F257-F315 HydrophobicContact CD2-CD1 4.19Å; F257-F315 AromaticContact CD2-CE1 3.79Å; F257-F315 HydrophobicContact CD2-CE1 3.79Å; F257-F315 HydrophobicContact CD2-CZ 4.28Å; Y276-F315 HydrophobicContact CD2-CB 3.52Å; Y276-F315 AromaticContact CD2-CD1 3.78Å; Y276-F315 HydrophobicContact CD2-CD1 3.78Å; Y276-F315 HydrophobicContact CD2-CD2 4.18Å; Y276-F315 AromaticContact CD2-CG 3.56Å; Y276-F315 HydrophobicContact CD2-CG 3.56Å; Y276-F315 HydrophobicContact CE2-CB 3.72Å; Y276-F315 HydrophobicContact CE2-CD1 4.11Å; Y276-F315 AromaticContact CE2-CD2 3.69Å; Y276-F315 HydrophobicContact CE2-CD2 3.69Å; Y276-F315 HydrophobicContact CE2-CE2 4.3Å; Y276-F315 AromaticContact CE2-CG 3.57Å; Y276-F315 HydrophobicContact CE2-CG 3.57Å; M279-F315 HydrophobicContact CB-CD1 4.36Å; M279-F315 HydrophobicContact CB-CE1 3.84Å; M279-F315 HydrophobicContact CE-CD1 4.4Å; L280-F315 HydrophobicContact CB-CZ 4.49Å; L280-F315 HydrophobicContact CD1-CE2 4.09Å; L280-F315 HydrophobicContact CD1-CZ 4.14Å; I283-F315 HydrophobicContact CD1-CE1 4.01Å; I283-F315 HydrophobicContact CD1-CZ 3.7Å; A301-F315 VanDerWaalsContact CA-O 3.29Å; A301-F315 WeakPolarHBondContact CA-O 3.03Å; K302-F315 PolarHBondContact N-O 2.91Å; K302-F315 PolarHBondContact O-N 2.86Å; F304-F315 AromaticContact CD2-CD2 3.59Å; F304-F315 HydrophobicContact CD2-CD2 3.59Å; F304-F315 AromaticContact CD2-CE2 3.58Å; F304-F315 HydrophobicContact CD2-CE2 3.58Å; F304-F315 AromaticContact CE2-CD2 3.8Å; F304-F315 HydrophobicContact CE2-CD2 3.8Å; F304-F315 HydrophobicContact CE2-CE2 4.03Å; F304-F315 HydrophobicContact CG-CE2 4.19Å; F315-T317 HydrophobicContact CB-CG2 3.93Å
316	I	95.8	Very high	93.6	Very high	19 Å²	19	37.1 Å²	37.1	10%	0.097	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	95.6	173.1	-58.3	-169.9	0	0	0	108	R256 F257 I258 E259 T300 A301 S318 F323	R256-I316 HydrophobicContact CB-CD1 4.48Å; F257-I316 PolarHBondContact O-N 3.11Å; I258-I316 HydrophobicContact CB-CB 4.37Å; I258-I316 HydrophobicContact CD1-CD1 3.92Å; I258-I316 HydrophobicContact CG1-CB 4.07Å; I258-I316 HydrophobicContact CG1-CD1 3.91Å; I258-I316 HydrophobicContact CG1-CG1 4.21Å; I258-I316 HydrophobicContact CG2-CB 4.22Å; I258-I316 HydrophobicContact CG2-CG2 4.16Å; E259-I316 PolarHBondContact N-O 2.59Å; T300-I316 HydrophobicContact CG2-CG2 4.07Å; A301-I316 HydrophobicContact CB-CG1 4.14Å; I316-S318 VanDerWaalsContact C-N 3.28Å; I316-S318 WeakPolarHBondContact CG2-OG 3.34Å; I316-S318 PolarHBondContact O-N 2.77Å; I316-S318 VanDerWaalsContact O-N 3.13Å; I316-F323 HydrophobicContact CG2-CE1 3.81Å; I316-F323 HydrophobicContact CG2-CZ 4.23Å
317	T	92.7	Very high	93.4	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.006	24%	0.237	C	C	.	.			trans	-91.9	52.6	-168.3	57.4	0	0	0	0	111.9	E259 Y276 K302 F315 M319 D321 N322	E259-T317 WeakPolarHBondContact OE2-CA 3.35Å; Y276-T317 VanDerWaalsContact CB-CG2 3.45Å; Y276-T317 HydrophobicContact CD1-CG2 4Å; Y276-T317 HydrophobicContact CD2-CG2 3.65Å; Y276-T317 HydrophobicContact CE2-CG2 4.44Å; Y276-T317 HydrophobicContact CG-CG2 3.39Å; K302-T317 HydrophobicContact CD-CG2 4.16Å; K302-T317 PolarHBondContact NZ-OG1 2.8Å; F315-T317 HydrophobicContact CB-CG2 3.93Å; T317-M319 PolarHBondContact O-N 3.34Å; T317-M319 VanDerWaalsContact O-N 3.11Å; T317-D321 WeakPolarHBondContact CB-O 3.35Å; T317-D321 CarbonylContact O-C 3.51Å; T317-D321 PolarHBondContact O-N 2.9Å; T317-D321 PolarHBondContact OG1-O 3.42Å; T317-N322 WeakPolarHBondContact O-CA 3.25Å; T317-N322 PolarHBondContact O-N 3.26Å
318	S	86.3	Confident	93.3	Very high	6 Å²	6	35.3 Å²	35.3	4%	0.042	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-24.3	-169.5	-57.6	0	0	0	0	114.6	E259 M261 I316 H378	E259-S318 PolarHBondContact OE2-N 2.98Å; M261-S318 WeakPolarHBondContact SD-CB 3.39Å; M261-S318 PolarHBondContact SD-OG 3.11Å; I316-S318 VanDerWaalsContact C-N 3.28Å; I316-S318 WeakPolarHBondContact CG2-OG 3.34Å; I316-S318 PolarHBondContact O-N 2.77Å; I316-S318 VanDerWaalsContact O-N 3.13Å; S318-H378 PolarHBondContact O-CE1 3.05Å; S318-H378 PolarHBondContact O-NE2 3.27Å
319	M	88.9	Confident	93.3	Very high	21 Å²	21	31.8 Å²	31.8	10%	0.103	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.6	-48.3	-172.2	-54.6	-53.6	-66.4	0	0	112.3	E259 M261 P262 M273 T317 F343 M381 I384	E259-M319 WeakPolarHBondContact OE2-CA 3.36Å; E259-M319 PolarHBondContact OE2-N 3.43Å; M261-M319 HydrophobicContact CB-SD 4.35Å; M261-M319 HydrophobicContact CG-CG 3.97Å; M261-M319 HydrophobicContact CG-SD 3.78Å; P262-M319 HydrophobicContact CG-CE 3.99Å; M273-M319 HydrophobicContact CE-CB 3.63Å; M273-M319 HydrophobicContact CE-CG 4.45Å; M273-M319 HydrophobicContact SD-CB 4.09Å; T317-M319 PolarHBondContact O-N 3.34Å; T317-M319 VanDerWaalsContact O-N 3.11Å; M319-F343 HydrophobicContact SD-CZ 4.04Å; M319-M381 HydrophobicContact CB-SD 4.07Å; M319-M381 HydrophobicContact CE-CB 3.39Å; M319-M381 HydrophobicContact CE-CG 3.32Å; M319-M381 HydrophobicContact CE-SD 3.75Å; M319-M381 HydrophobicContact CG-SD 4.37Å; M319-I384 HydrophobicContact CE-CD1 4.24Å
320	S	90.1	Very high	93.3	Very high	60 Å²	60	30.9 Å²	30.9	42%	0.42	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-36.6	-174.8	62.7	0	0	0	0	113.8	E259	E259-S320 VanDerWaalsContact CD-OG 3.31Å; E259-S320 WeakPolarHBondContact OE1-CB 3.34Å; E259-S320 PolarHBondContact OE1-OG 3.31Å; E259-S320 PolarHBondContact OE2-N 3.33Å; E259-S320 PolarHBondContact OE2-OG 2.65Å
321	D	89.2	Confident	93.4	Very high	87 Å²	87	24.5 Å²	24.5	47%	0.465	15%	0.152	S	C	.	.	S	Bend	trans	-148.5	75.4	-177	-174.3	15.8	0	0	0	110	K302 T317	K302-D321 WeakPolarHBondContact CE-OD2 3.39Å; K302-D321 VanDerWaalsContact NZ-CG 3.29Å; K302-D321 IonicContact NZ-OD2 3.82Å; K302-D321 PolarHBondContact NZ-OD2 3.36Å; T317-D321 WeakPolarHBondContact CB-O 3.35Å; T317-D321 CarbonylContact O-C 3.51Å; T317-D321 PolarHBondContact O-N 2.9Å; T317-D321 PolarHBondContact OG1-O 3.42Å
322	N	89.8	Confident	93.5	Very high	51 Å²	51	24.4 Å²	24.4	27%	0.273	15%	0.15	S	C	.	.			trans	-66	152.5	-167.4	78.4	87.6	0	0	0	113.7	T317 C324 H378	T317-N322 WeakPolarHBondContact O-CA 3.25Å; T317-N322 PolarHBondContact O-N 3.26Å; N322-C324 VanDerWaalsContact OD1-CB 3.23Å; N322-C324 WeakPolarHBondContact OD1-CB 3.32Å; N322-C324 PolarHBondContact OD1-N 2.92Å; N322-C324 VanDerWaalsContact OD1-N 3.1Å; N322-C324 PolarHBondContact OD1-SG 2.99Å; N322-H378 WeakPolarHBondContact CB-NE2 3.22Å
323	F	90.8	Very high	93.5	Very high	41 Å²	41	21.9 Å²	21.9	18%	0.18	14%	0.138	C	C	.	.			trans	-103.3	25.8	179	46.6	-105.4	0	0	0	113	T300 I316 G325 S326 C327	T300-F323 HydrophobicContact CG2-CD1 3.89Å; T300-F323 HydrophobicContact CG2-CD2 4.16Å; T300-F323 HydrophobicContact CG2-CE1 3.48Å; T300-F323 VanDerWaalsContact CG2-CE1 3.48Å; T300-F323 HydrophobicContact CG2-CE2 3.83Å; T300-F323 HydrophobicContact CG2-CG 4.22Å; T300-F323 HydrophobicContact CG2-CZ 3.45Å; T300-F323 VanDerWaalsContact CG2-CZ 3.45Å; T300-F323 WeakPolarHBondContact O-CD1 3.23Å; I316-F323 HydrophobicContact CG2-CE1 3.81Å; I316-F323 HydrophobicContact CG2-CZ 4.23Å; F323-G325 VanDerWaalsContact C-N 3.26Å; F323-G325 PolarHBondContact O-N 3.5Å; F323-S326 PolarHBondContact O-N 3.32Å; F323-C327 PolarHBondContact O-N 2.94Å
324	C	91.9	Very high	93.5	Very high	11 Å²	11	21.9 Å²	21.9	7%	0.074	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-64.5	-30.7	-173	-66.5	0	0	0	0	113.4	R79 N322 S326 C327 K376 Q377 H378	R79-C324 PolarHBondContact NH1-O 3.26Å; N322-C324 VanDerWaalsContact OD1-CB 3.23Å; N322-C324 WeakPolarHBondContact OD1-CB 3.32Å; N322-C324 PolarHBondContact OD1-N 2.92Å; N322-C324 VanDerWaalsContact OD1-N 3.1Å; N322-C324 PolarHBondContact OD1-SG 2.99Å; C324-S326 PolarHBondContact O-N 3.47Å; C324-C327 WeakPolarHBondContact O-CB 3.41Å; C324-C327 PolarHBondContact O-N 2.86Å; C324-C327 VanDerWaalsContact O-N 3.14Å; C324-K376 WeakPolarHBondContact CB-O 3.42Å; C324-Q377 HydrophobicContact CB-CB 3.65Å; C324-H378 PolarHBondContact SG-CD2 3.46Å
325	G	90.8	Very high	93.5	Very high	62 Å²	62	22.7 Å²	22.7	64%	0.639	14%	0.143	S	C	*	.	G	3₁₀ helix	trans	-59.3	-29.3	-179.1	0	0	0	0	0	113.9	R79 F323	R79-G325 VanDerWaalsContact CD-O 3.29Å; R79-G325 WeakPolarHBondContact CD-O 3.27Å; F323-G325 VanDerWaalsContact C-N 3.26Å; F323-G325 PolarHBondContact O-N 3.5Å
326	S	90.4	Very high	93.5	Very high	45 Å²	45	22.6 Å²	22.6	32%	0.315	14%	0.142	S	C	.	.	G	3₁₀ helix	trans	-113.7	14.7	177.5	62.4	0	0	0	0	113.6	P297 F323 C324 N328	P297-S326 WeakPolarHBondContact O-CB 3.45Å; P297-S326 PolarHBondContact O-OG 2.85Å; F323-S326 PolarHBondContact O-N 3.32Å; C324-S326 PolarHBondContact O-N 3.47Å; S326-N328 PolarHBondContact O-N 2.98Å
327	C	94.1	Very high	93.6	Very high	15 Å²	15	22.7 Å²	22.7	10%	0.101	14%	0.143	C	C	.	.			trans	-69.2	117.8	-177.8	-177.1	0	0	0	0	111.7	H81 F323 C324	H81-C327 PolarHBondContact CE1-O 3.41Å; H81-C327 PolarHBondContact ND1-O 2.85Å; F323-C327 PolarHBondContact O-N 2.94Å; C324-C327 WeakPolarHBondContact O-CB 3.41Å; C324-C327 PolarHBondContact O-N 2.86Å; C324-C327 VanDerWaalsContact O-N 3.14Å
328	N	95.3	Very high	93.8	Very high	18 Å²	18	22.8 Å²	22.8	10%	0.096	14%	0.143	C	C	.	.			trans	-106.9	19	178.6	63.6	-17.7	0	0	0	113.8	R80 H81 N82 Y83 A298 S326	R80-N328 WeakPolarHBondContact O-CB 3.18Å; H81-N328 CarbonylContact C-O 3.51Å; H81-N328 VanDerWaalsContact CA-O 3.25Å; H81-N328 WeakPolarHBondContact CA-O 3.35Å; H81-N328 VanDerWaalsContact ND1-C 3.32Å; H81-N328 WeakPolarHBondContact ND1-CA 3.37Å; N82-N328 PolarHBondContact OD1-ND2 3.35Å; Y83-N328 PolarHBondContact N-O 2.99Å; Y83-N328 VanDerWaalsContact N-O 3.16Å; A298-N328 HydrophobicContact CB-CB 4.4Å; S326-N328 PolarHBondContact O-N 2.98Å
329	R	95.9	Very high	94.3	Very high	6 Å²	6	22.5 Å²	22.5	2%	0.023	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	133.4	-168	-73.4	178.7	-67.5	-74.4	11	113.9	Y83 T300 K374	Y83-R329 HydrophobicContact CD1-CG 3.39Å; Y83-R329 HydrophobicContact CE1-CG 3.87Å; Y83-R329 HydrophobicContact CG-CG 3.87Å; Y83-R329 VanDerWaalsContact O-CA 3.3Å; Y83-R329 WeakPolarHBondContact O-CA 3.45Å; T300-R329 VanDerWaalsContact OG1-CZ 3.27Å; T300-R329 PolarHBondContact OG1-NH1 3.11Å; T300-R329 PolarHBondContact OG1-NH2 3.42Å; R329-K374 PolarHBondContact O-NZ 3.3Å
330	L	97.1	Very high	94.6	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	157.3	165.5	-60.7	175.5	0	0	0	110.3	L73 H81 Y83 L84 R85 F126 L338 V340 V371	L73-L330 HydrophobicContact CD2-CD1 3.99Å; H81-L330 HydrophobicContact CB-CD1 3.79Å; H81-L330 HydrophobicContact CB-CD2 4.39Å; H81-L330 HydrophobicContact CB-CG 3.79Å; Y83-L330 PolarHBondContact O-N 3.44Å; L84-L330 HydrophobicContact CD1-CB 4.06Å; R85-L330 PolarHBondContact N-O 3.28Å; F126-L330 HydrophobicContact CD1-CD1 4.45Å; F126-L330 HydrophobicContact CE1-CD1 3.78Å; L330-L338 HydrophobicContact CB-CD1 4.37Å; L330-V340 HydrophobicContact CD2-CB 4.09Å; L330-V340 HydrophobicContact CD2-CG1 3.99Å; L330-V371 HydrophobicContact CD1-CG2 3.87Å; L330-V371 HydrophobicContact CD2-CG2 3.99Å
331	R	97.8	Very high	94.7	Very high	13 Å²	13	21.4 Å²	21.4	5%	0.049	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	137.9	-179.5	-57.6	-174.3	172.6	70.7	-2.8	111.2	R85 L338 K339	R85-R331 HydrophobicContact CB-CG 4.15Å; R85-R331 CarbonylContact O-C 3.44Å; R85-R331 VanDerWaalsContact O-CA 3.29Å; R85-R331 WeakPolarHBondContact O-CA 3.31Å; R331-L338 CarbonylContact O-C 3.52Å; R331-L338 WeakPolarHBondContact O-CA 3.39Å; R331-K339 HydrophobicContact CB-CB 4.32Å; R331-K339 PolarHBondContact N-O 3.37Å; R331-K339 PolarHBondContact O-N 3.1Å
332	I	98.1	Very high	94.8	Very high	1 Å²	1	18.4 Å²	18.4	1%	0.005	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	120.9	165.6	-62.9	169	0	0	0	106.9	L84 R85 S87 L114 L122 F126 N337 L350	L84-I332 HydrophobicContact CD1-CD1 4.03Å; L84-I332 HydrophobicContact CD1-CG1 4.08Å; L84-I332 HydrophobicContact CD2-CD1 4.14Å; R85-I332 PolarHBondContact O-N 2.94Å; S87-I332 PolarHBondContact N-O 3.21Å; L114-I332 HydrophobicContact CD1-CG2 3.58Å; L122-I332 HydrophobicContact CB-CD1 4.17Å; L122-I332 HydrophobicContact CD1-CD1 4.28Å; L122-I332 HydrophobicContact CD1-CG2 4.5Å; F126-I332 HydrophobicContact CD2-CD1 4.12Å; F126-I332 HydrophobicContact CE2-CD1 3.74Å; I332-N337 WeakPolarHBondContact CA-O 3.47Å; I332-L350 HydrophobicContact CD1-CD1 4.45Å; I332-L350 HydrophobicContact CG1-CD1 4.45Å
333	T	97.7	Very high	94.6	Very high	0 Å²	0	17 Å²	17	0%	0	11%	0.11	C	C	.	.			trans	-74.9	165.7	175.3	56.9	0	0	0	0	110.7	D335 G336 N337	T333-D335 VanDerWaalsContact C-N 3.26Å; T333-D335 VanDerWaalsContact CB-OD1 3.25Å; T333-D335 WeakPolarHBondContact CB-OD1 3.41Å; T333-D335 PolarHBondContact O-N 3.41Å; T333-D335 PolarHBondContact OG1-OD1 3.46Å; T333-G336 WeakPolarHBondContact O-CA 3.18Å; T333-G336 PolarHBondContact O-N 2.89Å; T333-N337 PolarHBondContact N-O 3.23Å; T333-N337 WeakPolarHBondContact OG1-CA 3.37Å; T333-N337 WeakPolarHBondContact OG1-CB 3.45Å; T333-N337 PolarHBondContact OG1-N 3.37Å; T333-N337 PolarHBondContact OG1-O 3.29Å
334	A	97.3	Very high	94.2	Very high	2 Å²	2	16 Å²	16	2%	0.017	11%	0.112	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-27.1	-175.6	0	0	0	0	0	113.6	S87 E90 L113 L114	S87-A334 WeakPolarHBondContact O-CA 3.39Å; E90-A334 HydrophobicContact CG-CB 3.82Å; L113-A334 HydrophobicContact CD2-CB 4.08Å; L114-A334 PolarHBondContact N-O 3.17Å
335	D	96.8	Very high	93.6	Very high	16 Å²	16	19 Å²	19	9%	0.086	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.5	1.8	170.2	66.5	-14.1	0	0	0	113.2	T108 T333 N337 R351 R390	T108-D335 HydrophobicContact CG2-CB 4.04Å; T333-D335 VanDerWaalsContact C-N 3.26Å; T333-D335 VanDerWaalsContact CB-OD1 3.25Å; T333-D335 WeakPolarHBondContact CB-OD1 3.41Å; T333-D335 PolarHBondContact O-N 3.41Å; T333-D335 PolarHBondContact OG1-OD1 3.46Å; D335-N337 PolarHBondContact OD1-ND2 2.92Å; D335-N337 PolarHBondContact OD2-ND2 2.92Å; D335-R351 WeakPolarHBondContact O-CD 3.49Å; D335-R351 PolarHBondContact O-NH1 3.41Å; D335-R390 VanDerWaalsContact CG-NH1 3.32Å; D335-R390 IonicContact OD1-CZ 2.66Å; D335-R390 IonicContact OD1-NH1 4Å; D335-R390 PolarHBondContact OD1-NH1 3.14Å; D335-R390 IonicContact OD1-NH2 3.98Å; D335-R390 IonicContact OD2-CZ 3.05Å; D335-R390 VanDerWaalsContact OD2-CZ 3.31Å; D335-R390 IonicContact OD2-NH1 2.81Å; D335-R390 PolarHBondContact OD2-NH1 3.42Å; D335-R390 IonicContact OD2-NH2 3.82Å; D335-R390 PolarHBondContact OD2-NH2 3.3Å
336	G	97.3	Very high	93.4	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	13%	0.132	C	C	.	.			trans	84.5	26.4	169.9	0	0	0	0	0	116.1	T333 L350 R351	T333-G336 WeakPolarHBondContact O-CA 3.18Å; T333-G336 PolarHBondContact O-N 2.89Å; G336-L350 PolarHBondContact O-N 3.39Å; G336-R351 PolarHBondContact O-N 2.77Å
337	N	97.6	Very high	93.6	Very high	21 Å²	21	21.2 Å²	21.2	11%	0.112	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	134.6	171.9	-67.2	-85.8	0	0	0	111.6	I332 T333 D335 E347 V348 S349 R390	I332-N337 WeakPolarHBondContact CA-O 3.47Å; T333-N337 PolarHBondContact N-O 3.23Å; T333-N337 WeakPolarHBondContact OG1-CA 3.37Å; T333-N337 WeakPolarHBondContact OG1-CB 3.45Å; T333-N337 PolarHBondContact OG1-N 3.37Å; T333-N337 PolarHBondContact OG1-O 3.29Å; D335-N337 PolarHBondContact OD1-ND2 2.92Å; D335-N337 PolarHBondContact OD2-ND2 2.92Å; N337-E347 HydrophobicContact CB-CB 4.1Å; N337-E347 HydrophobicContact CB-CG 4.47Å; N337-V348 CarbonylContact C-O 3.5Å; N337-V348 VanDerWaalsContact CA-O 3.31Å; N337-V348 WeakPolarHBondContact CA-O 3.41Å; N337-S349 WeakPolarHBondContact OD1-CA 3.27Å; N337-S349 WeakPolarHBondContact OD1-CB 3.4Å; N337-S349 PolarHBondContact OD1-N 2.82Å; N337-R390 PolarHBondContact ND2-NH2 3.14Å; N337-R390 VanDerWaalsContact ND2-NH2 3.18Å
338	L	97.6	Very high	93.6	Very high	2 Å²	2	22.1 Å²	22.1	1%	0.01	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	124.8	168.3	178.9	64.5	0	0	0	110.1	F126 L330 R331 V340 E347 V348 L350 I367 A370	F126-L338 HydrophobicContact CZ-CD1 4.06Å; L330-L338 HydrophobicContact CB-CD1 4.37Å; R331-L338 CarbonylContact O-C 3.52Å; R331-L338 WeakPolarHBondContact O-CA 3.39Å; L338-V340 HydrophobicContact CG-CG1 4.44Å; L338-E347 WeakPolarHBondContact O-CA 3.28Å; L338-V348 PolarHBondContact N-O 3.1Å; L338-V348 PolarHBondContact O-N 2.84Å; L338-L350 HydrophobicContact CB-CD1 3.85Å; L338-L350 HydrophobicContact CB-CD2 4.29Å; L338-L350 HydrophobicContact CB-CG 3.85Å; L338-L350 HydrophobicContact CD2-CD1 4.5Å; L338-I367 HydrophobicContact CD2-CB 4.38Å; L338-I367 HydrophobicContact CD2-CG1 4.12Å; L338-I367 HydrophobicContact CD2-CG2 4.24Å; L338-A370 HydrophobicContact CD2-CB 3.84Å
339	K	95.6	Very high	93.7	Very high	1 Å²	1	22.3 Å²	22.3	0%	0.004	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	116.3	174.4	-153.5	-166.3	-179.9	73.8	0	109.7	R331 C341 L342 G344 E347 N389 I395	R331-K339 HydrophobicContact CB-CB 4.32Å; R331-K339 PolarHBondContact N-O 3.37Å; R331-K339 PolarHBondContact O-N 3.1Å; K339-C341 WeakPolarHBondContact CD-O 3.12Å; K339-C341 WeakPolarHBondContact CE-O 3.45Å; K339-C341 WeakPolarHBondContact CG-O 3.37Å; K339-L342 VanDerWaalsContact CE-O 3.22Å; K339-L342 WeakPolarHBondContact CE-O 3.47Å; K339-G344 WeakPolarHBondContact CE-O 3.5Å; K339-G344 PolarHBondContact NZ-O 3.26Å; K339-E347 HydrophobicContact CB-CG 4.24Å; K339-E347 HydrophobicContact CG-CG 3.89Å; K339-E347 IonicContact NZ-OE1 2.69Å; K339-E347 PolarHBondContact NZ-OE1 2.99Å; K339-N389 PolarHBondContact NZ-OD1 3.25Å; K339-I395 HydrophobicContact CD-CG2 4.16Å
340	V	94.8	Very high	93.8	Very high	20 Å²	20	22 Å²	22	12%	0.121	13%	0.134	C	C	.	.	S	Bend	trans	-83.7	-15.2	-176.2	-57.8	0	0	0	0	113.6	L330 L338 A370 V371 K374	L330-V340 HydrophobicContact CD2-CB 4.09Å; L330-V340 HydrophobicContact CD2-CG1 3.99Å; L338-V340 HydrophobicContact CG-CG1 4.44Å; V340-A370 HydrophobicContact CG1-CB 4.12Å; V340-V371 HydrophobicContact CG1-CG2 4.47Å; V340-K374 HydrophobicContact CB-CB 4.25Å; V340-K374 HydrophobicContact CB-CD 4.34Å; V340-K374 HydrophobicContact CB-CG 4.29Å; V340-K374 HydrophobicContact CG2-CB 4.05Å; V340-K374 HydrophobicContact CG2-CG 4.2Å; V340-K374 WeakPolarHBondContact O-CE 3.33Å; V340-K374 PolarHBondContact O-NZ 3.32Å
341	C	93.3	Very high	93.8	Very high	38 Å²	38	23.2 Å²	23.2	26%	0.257	14%	0.138	S	C	.	.	S	Bend	trans	-136	153.8	175.2	-171.7	0	0	0	0	109.9	K339 F343	K339-C341 WeakPolarHBondContact CD-O 3.12Å; K339-C341 WeakPolarHBondContact CE-O 3.45Å; K339-C341 WeakPolarHBondContact CG-O 3.37Å; C341-F343 WeakPolarHBondContact CB-O 3.33Å; C341-F343 PolarHBondContact O-N 3.01Å
342	L	90.9	Very high	93.8	Very high	23 Å²	23	26.2 Å²	26.2	12%	0.12	16%	0.156	C	C	.	.	S	Bend	trans	-68.2	-29.4	173.9	-174.7	58.6	0	0	0	111.9	M261 F263 K339 N389 M392 I395	M261-L342 HydrophobicContact CE-CD2 4.42Å; M261-L342 HydrophobicContact SD-CD2 4.25Å; F263-L342 HydrophobicContact CE1-CD1 4.21Å; F263-L342 HydrophobicContact CE1-CG 4.04Å; F263-L342 HydrophobicContact CZ-CD1 4.23Å; F263-L342 HydrophobicContact CZ-CD2 3.85Å; F263-L342 HydrophobicContact CZ-CG 3.83Å; K339-L342 VanDerWaalsContact CE-O 3.22Å; K339-L342 WeakPolarHBondContact CE-O 3.47Å; L342-N389 PolarHBondContact O-ND2 3.43Å; L342-M392 HydrophobicContact CD1-SD 4.49Å; L342-I395 HydrophobicContact CD1-CD1 4.42Å; L342-I395 HydrophobicContact CD1-CG2 3.92Å
343	F	86.7	Confident	93.7	Very high	22 Å²	22	27.6 Å²	27.6	10%	0.096	16%	0.163	C	C	.	.	S	Bend	trans	-105.8	144.8	-178.4	-57.4	-67.2	0	0	0	111.4	M261 F263 M319 C341 H378 I384	M261-F343 HydrophobicContact CB-CE1 4.36Å; M261-F343 HydrophobicContact CB-CZ 4.2Å; M261-F343 HydrophobicContact CG-CZ 4.05Å; M261-F343 HydrophobicContact SD-CE1 4.44Å; M261-F343 HydrophobicContact SD-CE2 4.39Å; M261-F343 HydrophobicContact SD-CZ 3.61Å; F263-F343 HydrophobicContact CE1-CD1 4.41Å; F263-F343 HydrophobicContact CE1-CE1 4.19Å; F263-F343 HydrophobicContact CE2-CE1 4.38Å; F263-F343 HydrophobicContact CZ-CD1 4.47Å; F263-F343 AromaticContact CZ-CE1 3.83Å; F263-F343 HydrophobicContact CZ-CE1 3.83Å; F263-F343 HydrophobicContact CZ-CZ 4.46Å; M319-F343 HydrophobicContact SD-CZ 4.04Å; C341-F343 WeakPolarHBondContact CB-O 3.33Å; C341-F343 PolarHBondContact O-N 3.01Å; F343-H378 HydrophobicContact CB-CB 4.35Å; F343-H378 HydrophobicContact CD2-CB 3.81Å; F343-H378 AromaticContact CD2-CD2 3.92Å; F343-H378 AromaticContact CD2-CG 3.87Å; F343-H378 AromaticContact CE2-CD2 3.98Å; F343-H378 HydrophobicContact CG-CB 4.48Å; F343-I384 HydrophobicContact CB-CD1 4.42Å; F343-I384 HydrophobicContact CB-CG2 4.3Å; F343-I384 HydrophobicContact CD1-CD1 4.26Å; F343-I384 HydrophobicContact CD1-CG2 3.46Å; F343-I384 VanDerWaalsContact CD1-CG2 3.46Å; F343-I384 HydrophobicContact CD2-CD1 3.94Å; F343-I384 HydrophobicContact CE1-CD1 4.49Å; F343-I384 HydrophobicContact CE1-CG2 3.91Å; F343-I384 HydrophobicContact CE2-CD1 4.18Å; F343-I384 HydrophobicContact CG-CD1 3.96Å; F343-I384 HydrophobicContact CG-CG2 4.01Å; F343-I384 HydrophobicContact CZ-CD1 4.44Å
344	G	81.8	Confident	93.6	Very high	21 Å²	21	29.3 Å²	29.3	22%	0.216	17%	0.171	C	C	.	.	S	Bend	trans	96.1	159.7	179.5	0	0	0	0	0	113.7	K339 N389	K339-G344 WeakPolarHBondContact CE-O 3.5Å; K339-G344 PolarHBondContact NZ-O 3.26Å; G344-N389 PolarHBondContact O-OD1 3.36Å
345	N	79.6	Confident	93.6	Very high	73 Å²	73	34.6 Å²	34.6	39%	0.39	19%	0.191	S	C	.	.	S	Bend	trans	-94.5	-5.6	-172.7	-75.2	-31.9	0	0	0	115.9	E347 K388 N389	N345-E347 PolarHBondContact O-N 3.25Å; N345-E347 VanDerWaalsContact O-N 3.08Å; N345-K388 WeakPolarHBondContact ND2-CB 3.36Å; N345-K388 VanDerWaalsContact ND2-CG 3.26Å; N345-K388 WeakPolarHBondContact ND2-CG 3.42Å; N345-K388 PolarHBondContact ND2-O 3.46Å; N345-K388 PolarHBondContact OD1-O 3.04Å; N345-N389 WeakPolarHBondContact OD1-CA 3.48Å; N345-N389 PolarHBondContact OD1-N 3.12Å
346	S	86.9	Confident	93.6	Very high	108 Å²	108	38.4 Å²	38.4	76%	0.755	22%	0.219	S	C	*	.			trans	-68.1	113.4	-176.8	-57.5	0	0	0	0	109.8
347	E	93.2	Very high	93.5	Very high	45 Å²	45	41.5 Å²	41.5	21%	0.21	25%	0.251	C	S	.	.			trans	-141	150.6	-174.3	-76.5	175.1	-165.6	0	0	109	N337 L338 K339 N345 R390	N337-E347 HydrophobicContact CB-CB 4.1Å; N337-E347 HydrophobicContact CB-CG 4.47Å; L338-E347 WeakPolarHBondContact O-CA 3.28Å; K339-E347 HydrophobicContact CB-CG 4.24Å; K339-E347 HydrophobicContact CG-CG 3.89Å; K339-E347 IonicContact NZ-OE1 2.69Å; K339-E347 PolarHBondContact NZ-OE1 2.99Å; N345-E347 PolarHBondContact O-N 3.25Å; N345-E347 VanDerWaalsContact O-N 3.08Å; E347-R390 IonicContact OE1-NE 2.67Å; E347-R390 PolarHBondContact OE1-NE 3.16Å; E347-R390 IonicContact OE2-CZ 3.38Å; E347-R390 IonicContact OE2-NE 2.61Å; E347-R390 PolarHBondContact OE2-NE 3.03Å; E347-R390 IonicContact OE2-NH2 3.31Å; E347-R390 PolarHBondContact OE2-NH2 2.62Å
348	V	95.1	Very high	93.4	Very high	35 Å²	35	41.5 Å²	41.5	21%	0.212	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	126.7	177.1	-177.9	0	0	0	0	108.9	N337 L338 L350 I353 I366 A370	N337-V348 CarbonylContact C-O 3.5Å; N337-V348 VanDerWaalsContact CA-O 3.31Å; N337-V348 WeakPolarHBondContact CA-O 3.41Å; L338-V348 PolarHBondContact N-O 3.1Å; L338-V348 PolarHBondContact O-N 2.84Å; V348-L350 PolarHBondContact O-N 2.89Å; V348-L350 VanDerWaalsContact O-N 3.08Å; V348-I353 HydrophobicContact CG1-CD1 3.93Å; V348-I366 HydrophobicContact CG1-CG2 3.55Å; V348-A370 HydrophobicContact CG2-CB 4.37Å
349	S	96.9	Very high	93.4	Very high	21 Å²	21	44.1 Å²	44.1	15%	0.147	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	93.7	-177.4	-175.3	0	0	0	0	111.3	N337 R351 D352 I353	N337-S349 WeakPolarHBondContact OD1-CA 3.27Å; N337-S349 WeakPolarHBondContact OD1-CB 3.4Å; N337-S349 PolarHBondContact OD1-N 2.82Å; S349-R351 VanDerWaalsContact C-N 3.25Å; S349-R351 PolarHBondContact O-N 3.43Å; S349-D352 WeakPolarHBondContact CB-OD2 3.26Å; S349-D352 PolarHBondContact O-N 3.29Å; S349-D352 WeakPolarHBondContact OG-CB 3.49Å; S349-D352 PolarHBondContact OG-N 3.32Å; S349-D352 PolarHBondContact OG-OD2 3.32Å; S349-I353 VanDerWaalsContact O-CD1 3.24Å; S349-I353 WeakPolarHBondContact O-CD1 3.39Å; S349-I353 VanDerWaalsContact O-CG1 3.3Å; S349-I353 WeakPolarHBondContact O-CG1 3.35Å; S349-I353 PolarHBondContact O-N 3.17Å
350	L	97.8	Very high	93.3	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-67	-30.7	174.2	-59.8	-174.5	0	0	0	111.5	L122 F126 I332 G336 L338 V348 I353 L354 L363 I367	L122-L350 HydrophobicContact CD1-CB 4.3Å; L122-L350 HydrophobicContact CD2-CB 4.14Å; L122-L350 HydrophobicContact CD2-CD1 4.21Å; F126-L350 HydrophobicContact CE2-CD1 4.05Å; F126-L350 HydrophobicContact CZ-CD1 4.32Å; I332-L350 HydrophobicContact CD1-CD1 4.45Å; I332-L350 HydrophobicContact CG1-CD1 4.45Å; G336-L350 PolarHBondContact O-N 3.39Å; L338-L350 HydrophobicContact CB-CD1 3.85Å; L338-L350 HydrophobicContact CB-CD2 4.29Å; L338-L350 HydrophobicContact CB-CG 3.85Å; L338-L350 HydrophobicContact CD2-CD1 4.5Å; V348-L350 PolarHBondContact O-N 2.89Å; V348-L350 VanDerWaalsContact O-N 3.08Å; L350-I353 HydrophobicContact CD2-CD1 4.49Å; L350-L354 VanDerWaalsContact O-CB 3.23Å; L350-L354 WeakPolarHBondContact O-CB 3.39Å; L350-L354 PolarHBondContact O-N 2.86Å; L350-L363 HydrophobicContact CD2-CD2 4.31Å; L350-I367 HydrophobicContact CD1-CD1 4.4Å; L350-I367 HydrophobicContact CD1-CG1 4.3Å; L350-I367 HydrophobicContact CD2-CG1 3.93Å
351	R	97.4	Very high	93.3	Very high	25 Å²	25	51.3 Å²	51.3	9%	0.094	31%	0.307	C	S	.	.	H	α-helix	trans	-57.8	-50.8	174.6	-178.1	-161.3	74.8	-150.1	-2.5	111.6	Q112 L114 D335 G336 S349 I353 L354 R355	Q112-R351 PolarHBondContact O-NH1 2.99Å; L114-R351 HydrophobicContact CD2-CB 3.83Å; L114-R351 HydrophobicContact CD2-CG 4Å; D335-R351 WeakPolarHBondContact O-CD 3.49Å; D335-R351 PolarHBondContact O-NH1 3.41Å; G336-R351 PolarHBondContact O-N 2.77Å; S349-R351 VanDerWaalsContact C-N 3.25Å; S349-R351 PolarHBondContact O-N 3.43Å; R351-I353 VanDerWaalsContact C-N 3.33Å; R351-I353 PolarHBondContact O-N 3.26Å; R351-L354 PolarHBondContact O-N 3.13Å; R351-R355 WeakPolarHBondContact O-CB 3.31Å; R351-R355 VanDerWaalsContact O-CG 3.29Å; R351-R355 WeakPolarHBondContact O-CG 3.31Å; R351-R355 PolarHBondContact O-N 3.1Å
352	D	97	Very high	93.5	Very high	77 Å²	77	54.6 Å²	54.6	41%	0.412	32%	0.318	S	S	.	.	H	α-helix	trans	-69	-37.5	-174.3	-63.8	-31.1	0	0	0	111.3	S349 R355 S356	S349-D352 WeakPolarHBondContact CB-OD2 3.26Å; S349-D352 PolarHBondContact O-N 3.29Å; S349-D352 WeakPolarHBondContact OG-CB 3.49Å; S349-D352 PolarHBondContact OG-N 3.32Å; S349-D352 PolarHBondContact OG-OD2 3.32Å; D352-R355 PolarHBondContact O-N 2.51Å; D352-S356 PolarHBondContact O-N 2.79Å; D352-S356 PolarHBondContact O-OG 3.03Å
353	I	96.8	Very high	93.8	Very high	30 Å²	30	53.5 Å²	53.5	15%	0.154	31%	0.313	C	S	.	.	H	α-helix	trans	-63.3	-45.6	174.1	-62.6	159.6	0	0	0	110.9	V348 S349 L350 R351 R355 S356 A358 L363 I366	V348-I353 HydrophobicContact CG1-CD1 3.93Å; S349-I353 VanDerWaalsContact O-CD1 3.24Å; S349-I353 WeakPolarHBondContact O-CD1 3.39Å; S349-I353 VanDerWaalsContact O-CG1 3.3Å; S349-I353 WeakPolarHBondContact O-CG1 3.35Å; S349-I353 PolarHBondContact O-N 3.17Å; L350-I353 HydrophobicContact CD2-CD1 4.49Å; R351-I353 VanDerWaalsContact C-N 3.33Å; R351-I353 PolarHBondContact O-N 3.26Å; I353-R355 VanDerWaalsContact C-N 3.31Å; I353-R355 PolarHBondContact O-N 3.04Å; I353-S356 PolarHBondContact O-N 3.05Å; I353-S356 PolarHBondContact O-OG 3.5Å; I353-A358 HydrophobicContact CG2-CB 3.49Å; I353-A358 VanDerWaalsContact CG2-CB 3.49Å; I353-A358 VanDerWaalsContact O-CB 3.25Å; I353-A358 WeakPolarHBondContact O-CB 3.48Å; I353-A358 PolarHBondContact O-N 3.45Å; I353-L363 HydrophobicContact CB-CD2 4.02Å; I353-L363 HydrophobicContact CG2-CD2 3.54Å; I353-L363 HydrophobicContact CG2-CG 4.07Å; I353-I366 HydrophobicContact CD1-CD1 3.62Å; I353-I366 HydrophobicContact CD1-CG2 3.84Å; I353-I366 HydrophobicContact CG1-CD1 4.18Å; I353-I366 HydrophobicContact CG2-CD1 3.98Å
354	L	96	Very high	94.2	Very high	35 Å²	35	53 Å²	53	18%	0.183	31%	0.311	C	S	.	.	H	α-helix	trans	-60.8	-42.6	176.5	-176.7	67.6	0	0	0	111	E118 T121 L350 R351 S356 G357 L363	E118-L354 HydrophobicContact CB-CD2 3.92Å; E118-L354 HydrophobicContact CG-CD2 3.82Å; T121-L354 HydrophobicContact CG2-CD1 4.01Å; T121-L354 HydrophobicContact CG2-CD2 4.5Å; L350-L354 VanDerWaalsContact O-CB 3.23Å; L350-L354 WeakPolarHBondContact O-CB 3.39Å; L350-L354 PolarHBondContact O-N 2.86Å; R351-L354 PolarHBondContact O-N 3.13Å; L354-S356 VanDerWaalsContact C-N 3.33Å; L354-S356 PolarHBondContact O-N 3.38Å; L354-G357 PolarHBondContact O-N 3.03Å; L354-G357 VanDerWaalsContact O-N 3.13Å; L354-L363 HydrophobicContact CD1-CD1 3.89Å
355	R	97.3	Very high	94.9	Very high	114 Å²	114	56.9 Å²	56.9	43%	0.43	32%	0.323	S	S	.	.	H	α-helix	trans	-71.5	-22.7	179.1	-72.8	179.3	-176	-174.7	3.1	114.2	G111 L113 E118 R351 D352 I353 G357	G111-R355 PolarHBondContact O-NH1 3.18Å; L113-R355 PolarHBondContact O-NH2 3.04Å; L113-R355 VanDerWaalsContact O-NH2 3.12Å; E118-R355 WeakPolarHBondContact OE1-CG 3.31Å; E118-R355 IonicContact OE1-CZ 3.31Å; E118-R355 IonicContact OE1-NE 2.87Å; E118-R355 PolarHBondContact OE1-NE 2.85Å; E118-R355 IonicContact OE1-NH2 3.89Å; E118-R355 PolarHBondContact OE1-NH2 2.91Å; E118-R355 IonicContact OE2-CZ 3.09Å; E118-R355 IonicContact OE2-NE 2.71Å; E118-R355 IonicContact OE2-NH2 2.69Å; E118-R355 PolarHBondContact OE2-NH2 3.44Å; R351-R355 WeakPolarHBondContact O-CB 3.31Å; R351-R355 VanDerWaalsContact O-CG 3.29Å; R351-R355 WeakPolarHBondContact O-CG 3.31Å; R351-R355 PolarHBondContact O-N 3.1Å; D352-R355 PolarHBondContact O-N 2.51Å; I353-R355 VanDerWaalsContact C-N 3.31Å; I353-R355 PolarHBondContact O-N 3.04Å; R355-G357 PolarHBondContact O-N 3.45Å
356	S	96.8	Very high	95.7	Very high	96 Å²	96	56.1 Å²	56.1	67%	0.671	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.9	-0.6	170.9	59.4	0	0	0	0	113.3	D352 I353 L354	D352-S356 PolarHBondContact O-N 2.79Å; D352-S356 PolarHBondContact O-OG 3.03Å; I353-S356 PolarHBondContact O-N 3.05Å; I353-S356 PolarHBondContact O-OG 3.5Å; L354-S356 VanDerWaalsContact C-N 3.33Å; L354-S356 PolarHBondContact O-N 3.38Å
357	G	95.1	Very high	96.2	Very high	65 Å²	65	51 Å²	51	67%	0.67	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.8	23.4	179.8	0	0	0	0	0	113.6	L354 R355	L354-G357 PolarHBondContact O-N 3.03Å; L354-G357 VanDerWaalsContact O-N 3.13Å; R355-G357 PolarHBondContact O-N 3.45Å
358	A	95.6	Very high	96.4	Very high	21 Å²	21	49.7 Å²	49.7	17%	0.174	28%	0.281	C	S	.	.			trans	-61	143.2	175.6	0	0	0	0	0	111	I353 E362	I353-A358 HydrophobicContact CG2-CB 3.49Å; I353-A358 VanDerWaalsContact CG2-CB 3.49Å; I353-A358 VanDerWaalsContact O-CB 3.25Å; I353-A358 WeakPolarHBondContact O-CB 3.48Å; I353-A358 PolarHBondContact O-N 3.45Å; A358-E362 WeakPolarHBondContact CA-OE2 3.46Å; A358-E362 HydrophobicContact CB-CB 4.22Å
359	S	96.2	Very high	96.4	Very high	56 Å²	56	50.5 Å²	50.5	39%	0.392	29%	0.291	S	S	.	.			trans	-68.7	161.6	172.3	62.3	0	0	0	0	112.1	E361 E362 L363	S359-E361 PolarHBondContact O-N 3.08Å; S359-E362 WeakPolarHBondContact CB-OE2 3.17Å; S359-E362 PolarHBondContact N-OE2 2.92Å; S359-E362 PolarHBondContact O-N 3.41Å; S359-E362 WeakPolarHBondContact OG-CG 3.42Å; S359-E362 PolarHBondContact OG-N 3.5Å; S359-E362 PolarHBondContact OG-OE2 2.94Å; S359-L363 PolarHBondContact O-N 3.25Å; S359-L363 VanDerWaalsContact O-N 3.1Å
360	D	94.9	Very high	96.4	Very high	72 Å²	72	49.9 Å²	49.9	39%	0.385	29%	0.287	S	S	.	.	H	α-helix	trans	-54.9	-42	173.8	-77.2	5.1	0	0	0	111.1	L125 R128 L363 L364	L125-D360 HydrophobicContact CD1-CB 3.95Å; R128-D360 IonicContact NH1-OD2 2.62Å; R128-D360 PolarHBondContact NH1-OD2 3.44Å; D360-L363 WeakPolarHBondContact O-CB 3.45Å; D360-L363 PolarHBondContact O-N 3.14Å; D360-L364 VanDerWaalsContact O-CG 3.27Å; D360-L364 WeakPolarHBondContact O-CG 3.33Å; D360-L364 PolarHBondContact O-N 3.46Å
361	E	95.1	Very high	96.3	Very high	100 Å²	100	49.9 Å²	49.9	47%	0.467	29%	0.287	S	S	.	.	H	α-helix	trans	-63.2	-44.6	179.5	-175.8	59.9	-153.4	0	0	112	S359 L363 L364 Q365	S359-E361 PolarHBondContact O-N 3.08Å; E361-L363 VanDerWaalsContact C-N 3.32Å; E361-L363 PolarHBondContact O-N 3.46Å; E361-L364 WeakPolarHBondContact O-CB 3.4Å; E361-L364 PolarHBondContact O-N 3.29Å; E361-L364 VanDerWaalsContact O-N 3.14Å; E361-Q365 WeakPolarHBondContact O-CG 3.18Å; E361-Q365 PolarHBondContact O-N 2.92Å; E361-Q365 PolarHBondContact OE1-NE2 2.8Å
362	E	96.2	Very high	96.2	Very high	107 Å²	107	50.1 Å²	50.1	50%	0.5	30%	0.298	S	S	.	.	H	α-helix	trans	-62.4	-40.6	176.9	-72.8	165.6	129.9	0	0	111.8	A358 S359 L364 Q365 I366	A358-E362 WeakPolarHBondContact CA-OE2 3.46Å; A358-E362 HydrophobicContact CB-CB 4.22Å; S359-E362 WeakPolarHBondContact CB-OE2 3.17Å; S359-E362 PolarHBondContact N-OE2 2.92Å; S359-E362 PolarHBondContact O-N 3.41Å; S359-E362 WeakPolarHBondContact OG-CG 3.42Å; S359-E362 PolarHBondContact OG-N 3.5Å; S359-E362 PolarHBondContact OG-OE2 2.94Å; E362-L364 VanDerWaalsContact C-N 3.34Å; E362-Q365 PolarHBondContact O-N 3.28Å; E362-I366 WeakPolarHBondContact O-CG1 3.19Å; E362-I366 PolarHBondContact O-N 3.32Å; E362-I366 VanDerWaalsContact O-N 3.17Å
363	L	96.5	Very high	96	Very high	1 Å²	1	54.8 Å²	54.8	1%	0.005	31%	0.31	C	S	.	.	H	α-helix	trans	-60.6	-44.5	172.8	-81.8	165.1	0	0	0	111.3	L125 L350 I353 L354 S359 D360 E361 I366 I367	L125-L363 HydrophobicContact CD2-CB 3.83Å; L125-L363 HydrophobicContact CD2-CD1 4.28Å; L350-L363 HydrophobicContact CD2-CD2 4.31Å; I353-L363 HydrophobicContact CB-CD2 4.02Å; I353-L363 HydrophobicContact CG2-CD2 3.54Å; I353-L363 HydrophobicContact CG2-CG 4.07Å; L354-L363 HydrophobicContact CD1-CD1 3.89Å; S359-L363 PolarHBondContact O-N 3.25Å; S359-L363 VanDerWaalsContact O-N 3.1Å; D360-L363 WeakPolarHBondContact O-CB 3.45Å; D360-L363 PolarHBondContact O-N 3.14Å; E361-L363 VanDerWaalsContact C-N 3.32Å; E361-L363 PolarHBondContact O-N 3.46Å; L363-I366 PolarHBondContact O-N 3.1Å; L363-I367 WeakPolarHBondContact O-CB 3.47Å; L363-I367 WeakPolarHBondContact O-CD1 3.27Å; L363-I367 WeakPolarHBondContact O-CG1 3.49Å; L363-I367 PolarHBondContact O-N 3.36Å
364	L	96.3	Very high	95.9	Very high	12 Å²	12	53.9 Å²	53.9	6%	0.063	31%	0.305	C	S	.	.	H	α-helix	trans	-63.3	-42	179	-71.5	176.1	0	0	0	112.7	F72 L125 E129 D360 E361 E362 I366 I367 G368	F72-L364 HydrophobicContact CD1-CB 4.31Å; F72-L364 WeakPolarHBondContact CD1-O 3.47Å; F72-L364 HydrophobicContact CD2-CB 3.92Å; F72-L364 HydrophobicContact CD2-CD1 4.2Å; F72-L364 HydrophobicContact CD2-CD2 4.4Å; F72-L364 HydrophobicContact CD2-CG 4.4Å; F72-L364 HydrophobicContact CE1-CB 4.36Å; F72-L364 HydrophobicContact CE2-CB 3.96Å; F72-L364 HydrophobicContact CE2-CD1 4.15Å; F72-L364 HydrophobicContact CG-CB 4.1Å; F72-L364 HydrophobicContact CZ-CB 4.18Å; L125-L364 HydrophobicContact CD1-CD1 4.19Å; L125-L364 HydrophobicContact CD1-CD2 3.85Å; L125-L364 HydrophobicContact CD1-CG 3.91Å; L125-L364 HydrophobicContact CD2-CD2 4.19Å; L125-L364 HydrophobicContact CD2-CG 4.49Å; L125-L364 HydrophobicContact CG-CD2 3.89Å; L125-L364 HydrophobicContact CG-CG 4.4Å; E129-L364 HydrophobicContact CG-CD1 4.4Å; E129-L364 HydrophobicContact CG-CD2 3.38Å; D360-L364 VanDerWaalsContact O-CG 3.27Å; D360-L364 WeakPolarHBondContact O-CG 3.33Å; D360-L364 PolarHBondContact O-N 3.46Å; E361-L364 WeakPolarHBondContact O-CB 3.4Å; E361-L364 PolarHBondContact O-N 3.29Å; E361-L364 VanDerWaalsContact O-N 3.14Å; E362-L364 VanDerWaalsContact C-N 3.34Å; L364-I366 VanDerWaalsContact C-N 3.31Å; L364-I366 PolarHBondContact O-N 3.25Å; L364-I367 PolarHBondContact O-N 2.84Å; L364-G368 PolarHBondContact O-N 3.24Å
365	Q	96.5	Very high	95.7	Very high	101 Å²	101	59.9 Å²	59.9	47%	0.472	33%	0.329	S	S	.	.	H	α-helix	trans	-60	-42.9	175.5	-67.6	-63.1	-23.7	0	0	111.4	F72 E361 E362 G368 A369	F72-Q365 HydrophobicContact CE1-CG 4.44Å; E361-Q365 WeakPolarHBondContact O-CG 3.18Å; E361-Q365 PolarHBondContact O-N 2.92Å; E361-Q365 PolarHBondContact OE1-NE2 2.8Å; E362-Q365 PolarHBondContact O-N 3.28Å; Q365-G368 PolarHBondContact O-N 3.39Å; Q365-A369 WeakPolarHBondContact O-CB 3.43Å; Q365-A369 PolarHBondContact O-N 2.77Å
366	I	96.4	Very high	95.5	Very high	58 Å²	58	60.9 Å²	60.9	30%	0.297	34%	0.337	S	S	.	.	H	α-helix	trans	-67.6	-42.5	178.1	-67.5	169	0	0	0	111.3	V348 I353 E362 L363 L364 A369 A370	V348-I366 HydrophobicContact CG1-CG2 3.55Å; I353-I366 HydrophobicContact CD1-CD1 3.62Å; I353-I366 HydrophobicContact CD1-CG2 3.84Å; I353-I366 HydrophobicContact CG1-CD1 4.18Å; I353-I366 HydrophobicContact CG2-CD1 3.98Å; E362-I366 WeakPolarHBondContact O-CG1 3.19Å; E362-I366 PolarHBondContact O-N 3.32Å; E362-I366 VanDerWaalsContact O-N 3.17Å; L363-I366 PolarHBondContact O-N 3.1Å; L364-I366 VanDerWaalsContact C-N 3.31Å; L364-I366 PolarHBondContact O-N 3.25Å; I366-A369 PolarHBondContact O-N 3.41Å; I366-A370 PolarHBondContact O-N 3Å
367	I	97.3	Very high	95.3	Very high	1 Å²	1	61.7 Å²	61.7	1%	0.005	33%	0.33	C	S	.	.	H	α-helix	trans	-60.5	-48.9	174.9	-69.6	162.2	0	0	0	109.7	L73 L125 F126 L338 L350 L363 L364 A369 A370 V371	L73-I367 HydrophobicContact CD2-CG2 3.8Å; L125-I367 HydrophobicContact CD2-CD1 3.9Å; F126-I367 HydrophobicContact CE1-CG2 3.96Å; F126-I367 HydrophobicContact CE2-CD1 3.94Å; F126-I367 HydrophobicContact CZ-CD1 3.79Å; F126-I367 HydrophobicContact CZ-CG1 4.12Å; F126-I367 HydrophobicContact CZ-CG2 3.99Å; L338-I367 HydrophobicContact CD2-CB 4.38Å; L338-I367 HydrophobicContact CD2-CG1 4.12Å; L338-I367 HydrophobicContact CD2-CG2 4.24Å; L350-I367 HydrophobicContact CD1-CD1 4.4Å; L350-I367 HydrophobicContact CD1-CG1 4.3Å; L350-I367 HydrophobicContact CD2-CG1 3.93Å; L363-I367 WeakPolarHBondContact O-CB 3.47Å; L363-I367 WeakPolarHBondContact O-CD1 3.27Å; L363-I367 WeakPolarHBondContact O-CG1 3.49Å; L363-I367 PolarHBondContact O-N 3.36Å; L364-I367 PolarHBondContact O-N 2.84Å; I367-A369 PolarHBondContact O-N 3.36Å; I367-A370 WeakPolarHBondContact O-CB 3.27Å; I367-A370 PolarHBondContact O-N 3.03Å; I367-A370 VanDerWaalsContact O-N 3.08Å; I367-V371 HydrophobicContact CG2-CG2 4.17Å; I367-V371 WeakPolarHBondContact O-CG2 3.2Å; I367-V371 PolarHBondContact O-N 2.99Å
368	G	96.5	Very high	95	Very high	16 Å²	16	59.9 Å²	59.9	17%	0.165	30%	0.304	C	S	.	.	H	α-helix	trans	-57.8	-45.2	178	0	0	0	0	0	112.6	F72 L364 Q365 A370 V371 G372	F72-G368 WeakPolarHBondContact O-CA 3.33Å; L364-G368 PolarHBondContact O-N 3.24Å; Q365-G368 PolarHBondContact O-N 3.39Å; G368-A370 VanDerWaalsContact C-N 3.32Å; G368-A370 PolarHBondContact O-N 3.31Å; G368-V371 PolarHBondContact O-N 3.47Å; G368-G372 PolarHBondContact O-N 2.71Å
369	A	96.2	Very high	94.5	Very high	52 Å²	52	60.5 Å²	60.5	43%	0.43	31%	0.309	S	S	.	.	H	α-helix	trans	-63.4	-36.6	175.1	0	0	0	0	0	112.7	Q365 I366 I367 R373	Q365-A369 WeakPolarHBondContact O-CB 3.43Å; Q365-A369 PolarHBondContact O-N 2.77Å; I366-A369 PolarHBondContact O-N 3.41Å; I367-A369 PolarHBondContact O-N 3.36Å; A369-R373 WeakPolarHBondContact O-CG 3.33Å; A369-R373 PolarHBondContact O-N 3.33Å; A369-R373 PolarHBondContact O-NE 3.34Å
370	A	96	Very high	93.9	Very high	8 Å²	8	60.3 Å²	60.3	7%	0.066	32%	0.316	C	S	.	.	H	α-helix	trans	-68.2	-46.9	174.6	0	0	0	0	0	111.7	L338 V340 V348 I366 I367 G368 R373	L338-A370 HydrophobicContact CD2-CB 3.84Å; V340-A370 HydrophobicContact CG1-CB 4.12Å; V348-A370 HydrophobicContact CG2-CB 4.37Å; I366-A370 PolarHBondContact O-N 3Å; I367-A370 WeakPolarHBondContact O-CB 3.27Å; I367-A370 PolarHBondContact O-N 3.03Å; I367-A370 VanDerWaalsContact O-N 3.08Å; G368-A370 VanDerWaalsContact C-N 3.32Å; G368-A370 PolarHBondContact O-N 3.31Å; A370-R373 PolarHBondContact O-N 3.34Å
371	V	96.2	Very high	93.3	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-63	-44.1	178.6	172.5	0	0	0	0	111.1	D75 L330 V340 I367 G368 R373 K374	D75-V371 HydrophobicContact CB-CG1 3.97Å; D75-V371 WeakPolarHBondContact CB-O 3.48Å; L330-V371 HydrophobicContact CD1-CG2 3.87Å; L330-V371 HydrophobicContact CD2-CG2 3.99Å; V340-V371 HydrophobicContact CG1-CG2 4.47Å; I367-V371 HydrophobicContact CG2-CG2 4.17Å; I367-V371 WeakPolarHBondContact O-CG2 3.2Å; I367-V371 PolarHBondContact O-N 2.99Å; G368-V371 PolarHBondContact O-N 3.47Å; V371-R373 PolarHBondContact O-N 3.35Å; V371-K374 WeakPolarHBondContact O-CB 3.46Å; V371-K374 PolarHBondContact O-N 2.94Å
372	G	94.6	Very high	92.7	Very high	31 Å²	31	59.9 Å²	59.9	32%	0.32	31%	0.31	S	S	.	.	H	α-helix	trans	-61.3	-26.3	177.3	0	0	0	0	0	113.9	G368 K374	G368-G372 PolarHBondContact O-N 2.71Å; G372-K374 VanDerWaalsContact C-N 3.32Å
373	R	94	Very high	92.1	Very high	175 Å²	175	57.2 Å²	57.2	66%	0.66	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-1.4	174.3	-70.9	-176.9	-64.3	-153.2	2.2	113.9	A369 A370 V371 K375	A369-R373 WeakPolarHBondContact O-CG 3.33Å; A369-R373 PolarHBondContact O-N 3.33Å; A369-R373 PolarHBondContact O-NE 3.34Å; A370-R373 PolarHBondContact O-N 3.34Å; V371-R373 PolarHBondContact O-N 3.35Å; R373-K375 PolarHBondContact O-N 3.02Å; R373-K375 VanDerWaalsContact O-N 3.16Å
374	K	94.1	Very high	91.5	Very high	10 Å²	10	57.5 Å²	57.5	4%	0.043	31%	0.305	C	S	.	.			trans	-63.8	117.1	179.2	-174.4	177.8	178.7	144.4	0	110.1	D75 F77 R79 H81 R329 V340 V371 G372	D75-K374 HydrophobicContact CB-CB 4.36Å; F77-K374 VanDerWaalsContact CE2-O 3.28Å; F77-K374 WeakPolarHBondContact CE2-O 3.44Å; R79-K374 PolarHBondContact NH2-O 3.39Å; H81-K374 VanDerWaalsContact CE1-CD 3.45Å; H81-K374 WeakPolarHBondContact CE1-CD 3.37Å; H81-K374 PolarHBondContact CE1-NZ 3.28Å; H81-K374 PolarHBondContact ND1-NZ 3.3Å; R329-K374 PolarHBondContact O-NZ 3.3Å; V340-K374 HydrophobicContact CB-CB 4.25Å; V340-K374 HydrophobicContact CB-CD 4.34Å; V340-K374 HydrophobicContact CB-CG 4.29Å; V340-K374 HydrophobicContact CG2-CB 4.05Å; V340-K374 HydrophobicContact CG2-CG 4.2Å; V340-K374 WeakPolarHBondContact O-CE 3.33Å; V340-K374 PolarHBondContact O-NZ 3.32Å; V371-K374 WeakPolarHBondContact O-CB 3.46Å; V371-K374 PolarHBondContact O-N 2.94Å; G372-K374 VanDerWaalsContact C-N 3.32Å
375	K	93.1	Very high	90.7	Very high	161 Å²	161	59.3 Å²	59.3	70%	0.7	32%	0.318	S	S	*	.			trans	-60.1	156	179.1	-60.6	-174.6	179.5	-177	0	112.3	R79 R373 Q377	R79-K375 PolarHBondContact NH1-O 3.05Å; R79-K375 PolarHBondContact NH2-O 2.79Å; R373-K375 PolarHBondContact O-N 3.02Å; R373-K375 VanDerWaalsContact O-N 3.16Å; K375-Q377 VanDerWaalsContact C-N 3.27Å; K375-Q377 PolarHBondContact O-N 2.52Å
376	K	92.2	Very high	90.1	Very high	136 Å²	136	62.4 Å²	62.4	59%	0.591	33%	0.333	S	S	*	.	S	Bend	trans	-55.5	-44.2	175.8	-170	175.2	178.9	178.3	0	111.7	F77 R79 C324	F77-K376 HydrophobicContact CD1-CB 4.17Å; F77-K376 HydrophobicContact CD1-CD 4.39Å; F77-K376 HydrophobicContact CD1-CG 4.12Å; F77-K376 HydrophobicContact CD2-CB 4.42Å; F77-K376 HydrophobicContact CE1-CB 3.7Å; F77-K376 HydrophobicContact CE1-CD 4.17Å; F77-K376 HydrophobicContact CE1-CG 4.04Å; F77-K376 HydrophobicContact CE2-CB 3.98Å; F77-K376 VanDerWaalsContact CE2-N 3.26Å; F77-K376 HydrophobicContact CZ-CB 3.59Å; F77-K376 HydrophobicContact CZ-CG 4.42Å; R79-K376 PolarHBondContact NH1-O 2.84Å; C324-K376 WeakPolarHBondContact CB-O 3.42Å
377	Q	91.8	Very high	89.5	Confident	112 Å²	112	63.1 Å²	63.1	52%	0.523	34%	0.336	S	S	.	.	S	Bend	trans	-147.9	163.2	177	62.6	-171.4	19.9	0	0	111.1	C324 K375	C324-Q377 HydrophobicContact CB-CB 3.65Å; K375-Q377 VanDerWaalsContact C-N 3.27Å; K375-Q377 PolarHBondContact O-N 2.52Å
378	H	88.8	Confident	88.9	Confident	28 Å²	28	70.4 Å²	70.4	13%	0.13	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-68.6	164.2	170.1	60.2	68.7	0	0	0	110.8	S318 N322 C324 F343 I384	S318-H378 PolarHBondContact O-CE1 3.05Å; S318-H378 PolarHBondContact O-NE2 3.27Å; N322-H378 WeakPolarHBondContact CB-NE2 3.22Å; C324-H378 PolarHBondContact SG-CD2 3.46Å; F343-H378 HydrophobicContact CB-CB 4.35Å; F343-H378 HydrophobicContact CD2-CB 3.81Å; F343-H378 AromaticContact CD2-CD2 3.92Å; F343-H378 AromaticContact CD2-CG 3.87Å; F343-H378 AromaticContact CE2-CD2 3.98Å; F343-H378 HydrophobicContact CG-CB 4.48Å; H378-I384 HydrophobicContact CB-CD1 4.03Å; H378-I384 WeakPolarHBondContact ND1-CD1 3.42Å
379	A	86	Confident	88.5	Confident	34 Å²	34	70.2 Å²	70.2	28%	0.281	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-64.9	164.4	175.3	0	0	0	0	0	111.3	I384 M387	A379-I384 HydrophobicContact CB-CG1 4.07Å; A379-I384 WeakPolarHBondContact O-CD1 3.5Å; A379-I384 WeakPolarHBondContact O-CG1 2.96Å; A379-M387 HydrophobicContact CB-CE 3.67Å; A379-M387 HydrophobicContact CB-SD 4.19Å
380	G	84	Confident	88.1	Confident	52 Å²	52	69.8 Å²	69.8	54%	0.536	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-59.5	152.4	172.2	0	0	0	0	0	111.4	F382 S383 I384	G380-F382 VanDerWaalsContact C-N 3.32Å; G380-F382 PolarHBondContact O-N 3.31Å; G380-S383 WeakPolarHBondContact O-CA 3.46Å; G380-S383 WeakPolarHBondContact O-CB 3.31Å; G380-S383 PolarHBondContact O-N 2.96Å; G380-I384 PolarHBondContact O-N 2.93Å
381	M	82.4	Confident	87.9	Confident	28 Å²	28	70.5 Å²	70.5	14%	0.138	35%	0.354	C	S	.	.	H	α-helix	trans	-47.6	-47.1	-174.8	178	159.6	59.2	0	0	115	W268 F270 M273 M319 S383 I384 S385	W268-M381 HydrophobicContact CH2-CG 3.74Å; W268-M381 HydrophobicContact CH2-SD 4.3Å; W268-M381 HydrophobicContact CZ2-CE 4.47Å; W268-M381 HydrophobicContact CZ2-CG 3.38Å; W268-M381 HydrophobicContact CZ2-SD 3.53Å; W268-M381 VanDerWaalsContact CZ2-SD 3.53Å; F270-M381 HydrophobicContact CD2-CE 3.21Å; F270-M381 HydrophobicContact CD2-SD 3.96Å; F270-M381 HydrophobicContact CE2-CE 3.32Å; F270-M381 HydrophobicContact CE2-SD 4.41Å; F270-M381 HydrophobicContact CG-CE 4.34Å; F270-M381 HydrophobicContact CZ-CE 4.49Å; M273-M381 HydrophobicContact SD-CE 4.13Å; M273-M381 HydrophobicContact SD-SD 3.58Å; M319-M381 HydrophobicContact CB-SD 4.07Å; M319-M381 HydrophobicContact CE-CB 3.39Å; M319-M381 HydrophobicContact CE-CG 3.32Å; M319-M381 HydrophobicContact CE-SD 3.75Å; M319-M381 HydrophobicContact CG-SD 4.37Å; M381-S383 VanDerWaalsContact C-N 3.31Å; M381-S383 PolarHBondContact O-N 3.48Å; M381-I384 PolarHBondContact O-N 2.91Å; M381-S385 PolarHBondContact O-N 3.47Å
382	F	80.9	Confident	87.6	Confident	135 Å²	135	71.5 Å²	71.5	59%	0.592	36%	0.359	S	S	*	.	H	α-helix	trans	-62.1	-40.3	178.6	-63.8	-72.7	0	0	0	112	G380 S385	G380-F382 VanDerWaalsContact C-N 3.32Å; G380-F382 PolarHBondContact O-N 3.31Å; F382-S385 PolarHBondContact O-N 3.27Å; F382-S385 PolarHBondContact O-OG 3.26Å
383	S	84	Confident	87.5	Confident	51 Å²	51	70.1 Å²	70.1	36%	0.357	34%	0.344	S	S	.	.	H	α-helix	trans	-67.8	-41.7	176.4	-174.6	0	0	0	0	111.3	G380 M381 S385 Q386 M387	G380-S383 WeakPolarHBondContact O-CA 3.46Å; G380-S383 WeakPolarHBondContact O-CB 3.31Å; G380-S383 PolarHBondContact O-N 2.96Å; M381-S383 VanDerWaalsContact C-N 3.31Å; M381-S383 PolarHBondContact O-N 3.48Å; S383-S385 VanDerWaalsContact C-N 3.29Å; S383-S385 PolarHBondContact O-N 3.41Å; S383-Q386 PolarHBondContact O-N 3.48Å; S383-M387 WeakPolarHBondContact O-CG 3.31Å; S383-M387 PolarHBondContact O-N 3.1Å; S383-M387 VanDerWaalsContact O-N 3.16Å; S383-M387 WeakPolarHBondContact OG-CE 3.47Å
384	I	84	Confident	87.4	Confident	7 Å²	7	62.9 Å²	62.9	4%	0.036	32%	0.318	C	S	.	.	H	α-helix	trans	-59.8	-41.4	175.4	-62.5	172.8	0	0	0	110.9	P262 M319 F343 H378 A379 G380 M381 Q386 M387	P262-I384 HydrophobicContact CB-CG2 4.39Å; P262-I384 HydrophobicContact CG-CB 3.99Å; P262-I384 HydrophobicContact CG-CG2 3.59Å; M319-I384 HydrophobicContact CE-CD1 4.24Å; F343-I384 HydrophobicContact CB-CD1 4.42Å; F343-I384 HydrophobicContact CB-CG2 4.3Å; F343-I384 HydrophobicContact CD1-CD1 4.26Å; F343-I384 HydrophobicContact CD1-CG2 3.46Å; F343-I384 VanDerWaalsContact CD1-CG2 3.46Å; F343-I384 HydrophobicContact CD2-CD1 3.94Å; F343-I384 HydrophobicContact CE1-CD1 4.49Å; F343-I384 HydrophobicContact CE1-CG2 3.91Å; F343-I384 HydrophobicContact CE2-CD1 4.18Å; F343-I384 HydrophobicContact CG-CD1 3.96Å; F343-I384 HydrophobicContact CG-CG2 4.01Å; F343-I384 HydrophobicContact CZ-CD1 4.44Å; H378-I384 HydrophobicContact CB-CD1 4.03Å; H378-I384 WeakPolarHBondContact ND1-CD1 3.42Å; A379-I384 HydrophobicContact CB-CG1 4.07Å; A379-I384 WeakPolarHBondContact O-CD1 3.5Å; A379-I384 WeakPolarHBondContact O-CG1 2.96Å; G380-I384 PolarHBondContact O-N 2.93Å; M381-I384 PolarHBondContact O-N 2.91Å; I384-Q386 PolarHBondContact O-N 2.93Å; I384-Q386 VanDerWaalsContact O-N 3.11Å; I384-M387 PolarHBondContact O-N 3.34Å
385	S	80.6	Confident	87.2	Confident	49 Å²	49	62.5 Å²	62.5	34%	0.343	32%	0.317	S	S	.	.	H	α-helix	trans	-62.2	-19.8	-179.1	74.6	0	0	0	0	114.5	W268 M381 F382 S383	W268-S385 VanDerWaalsContact CE3-CB 3.47Å; W268-S385 VanDerWaalsContact CZ3-CB 3.46Å; M381-S385 PolarHBondContact O-N 3.47Å; F382-S385 PolarHBondContact O-N 3.27Å; F382-S385 PolarHBondContact O-OG 3.26Å; S383-S385 VanDerWaalsContact C-N 3.29Å; S383-S385 PolarHBondContact O-N 3.41Å
386	Q	82.6	Confident	86.6	Confident	167 Å²	167	54.8 Å²	54.8	78%	0.78	28%	0.283	S	S	*	.	H	α-helix	trans	-100.2	-13.8	177	-63.8	177.4	-11.1	0	0	112.7	S383 I384	S383-Q386 PolarHBondContact O-N 3.48Å; I384-Q386 PolarHBondContact O-N 2.93Å; I384-Q386 VanDerWaalsContact O-N 3.11Å
387	M	83.6	Confident	85	Confident	72 Å²	72	50.4 Å²	50.4	36%	0.355	28%	0.277	S	S	.	.	S	Bend	trans	-76.2	130.9	175.3	-72.9	174.9	-179.8	0	0	109.1	A379 S383 I384 N389	A379-M387 HydrophobicContact CB-CE 3.67Å; A379-M387 HydrophobicContact CB-SD 4.19Å; S383-M387 WeakPolarHBondContact O-CG 3.31Å; S383-M387 PolarHBondContact O-N 3.1Å; S383-M387 VanDerWaalsContact O-N 3.16Å; S383-M387 WeakPolarHBondContact OG-CE 3.47Å; I384-M387 PolarHBondContact O-N 3.34Å; M387-N389 PolarHBondContact O-N 3.22Å
388	K	85.3	Confident	84.7	Confident	155 Å²	155	47.4 Å²	47.4	67%	0.674	27%	0.265	S	S	*	.			trans	-57.8	140.5	166.3	176.8	-176.5	-174.1	178.6	0	109	N345	N345-K388 WeakPolarHBondContact ND2-CB 3.36Å; N345-K388 VanDerWaalsContact ND2-CG 3.26Å; N345-K388 WeakPolarHBondContact ND2-CG 3.42Å; N345-K388 PolarHBondContact ND2-O 3.46Å; N345-K388 PolarHBondContact OD1-O 3.04Å
389	N	87.4	Confident	84.5	Confident	11 Å²	11	48.4 Å²	48.4	6%	0.059	27%	0.272	C	S	.	.			trans	-146.6	177.3	174.8	-159.1	3.6	0	0	0	109.8	D264 K339 L342 G344 N345 M387	D264-N389 WeakPolarHBondContact CB-O 3.26Å; D264-N389 WeakPolarHBondContact OD1-CA 3.24Å; D264-N389 WeakPolarHBondContact OD1-CB 3.28Å; D264-N389 PolarHBondContact OD1-N 2.95Å; D264-N389 PolarHBondContact OD2-N 2.91Å; K339-N389 PolarHBondContact NZ-OD1 3.25Å; L342-N389 PolarHBondContact O-ND2 3.43Å; G344-N389 PolarHBondContact O-OD1 3.36Å; N345-N389 WeakPolarHBondContact OD1-CA 3.48Å; N345-N389 PolarHBondContact OD1-N 3.12Å; M387-N389 PolarHBondContact O-N 3.22Å
390	R	89.4	Confident	84.4	Confident	43 Å²	43	49.2 Å²	49.2	16%	0.162	27%	0.271	C	S	.	.			trans	-81.6	148.9	165.3	-69.8	-178.2	-177.3	-128.2	2.1	109.9	D335 N337 E347 L394 I395	D335-R390 VanDerWaalsContact CG-NH1 3.32Å; D335-R390 IonicContact OD1-CZ 2.66Å; D335-R390 IonicContact OD1-NH1 4Å; D335-R390 PolarHBondContact OD1-NH1 3.14Å; D335-R390 IonicContact OD1-NH2 3.98Å; D335-R390 IonicContact OD2-CZ 3.05Å; D335-R390 VanDerWaalsContact OD2-CZ 3.31Å; D335-R390 IonicContact OD2-NH1 2.81Å; D335-R390 PolarHBondContact OD2-NH1 3.42Å; D335-R390 IonicContact OD2-NH2 3.82Å; D335-R390 PolarHBondContact OD2-NH2 3.3Å; N337-R390 PolarHBondContact ND2-NH2 3.14Å; N337-R390 VanDerWaalsContact ND2-NH2 3.18Å; E347-R390 IonicContact OE1-NE 2.67Å; E347-R390 PolarHBondContact OE1-NE 3.16Å; E347-R390 IonicContact OE2-CZ 3.38Å; E347-R390 IonicContact OE2-NE 2.61Å; E347-R390 PolarHBondContact OE2-NE 3.03Å; E347-R390 IonicContact OE2-NH2 3.31Å; E347-R390 PolarHBondContact OE2-NH2 2.62Å; R390-L394 HydrophobicContact CB-CB 4.35Å; R390-I395 HydrophobicContact CB-CD1 3.93Å; R390-I395 HydrophobicContact CB-CG1 3.55Å; R390-I395 WeakPolarHBondContact O-CD1 3.46Å
391	P	90.1	Very high	84.4	Confident	23 Å²	23	49 Å²	49	15%	0.149	26%	0.256	C	S	.	.			trans	-54.6	145.5	160.7	-24.2	33.8	0	0	0	110.8	V105 D264 V393 L394	V105-P391 HydrophobicContact CG1-CB 4.04Å; V105-P391 HydrophobicContact CG1-CG 4Å; D264-P391 HydrophobicContact CB-CG 4.47Å; P391-V393 HydrophobicContact CB-CG1 4.29Å; P391-V393 PolarHBondContact O-N 3.12Å; P391-V393 VanDerWaalsContact O-N 3.14Å; P391-L394 HydrophobicContact CG-CD1 4.49Å; P391-L394 PolarHBondContact O-N 3.4Å
392	M	91.4	Very high	84.6	Confident	21 Å²	21	50.3 Å²	50.3	10%	0.103	26%	0.263	C	S	.	.	H	α-helix	trans	-54.4	-39.6	-174.7	179.8	63.6	84.1	0	0	112.9	C99 F263 L342 L394 I395 G396	C99-M392 HydrophobicContact CB-CB 4.35Å; F263-M392 HydrophobicContact CD1-CE 4.41Å; F263-M392 HydrophobicContact CD2-CE 3.78Å; F263-M392 HydrophobicContact CE1-CE 3.85Å; F263-M392 HydrophobicContact CE1-SD 4.45Å; F263-M392 HydrophobicContact CE2-CE 3.11Å; F263-M392 HydrophobicContact CG-CB 4.48Å; F263-M392 HydrophobicContact CG-CE 4.4Å; F263-M392 HydrophobicContact CZ-CE 3.17Å; F263-M392 HydrophobicContact CZ-SD 4.28Å; L342-M392 HydrophobicContact CD1-SD 4.49Å; M392-L394 PolarHBondContact O-N 2.87Å; M392-I395 PolarHBondContact O-N 2.74Å; M392-G396 PolarHBondContact O-N 2.82Å
393	V	91.4	Very high	84.8	Confident	3 Å²	3	44.7 Å²	44.7	2%	0.018	24%	0.241	C	C	.	.	H	α-helix	trans	-59.1	-27.8	179.6	67.7	0	0	0	0	113.5	C92 M100 V105 P391	C92-V393 HydrophobicContact CB-CG2 4.43Å; M100-V393 HydrophobicContact CE-CB 4.3Å; M100-V393 HydrophobicContact CE-CG1 4.18Å; M100-V393 HydrophobicContact CE-CG2 3.73Å; M100-V393 HydrophobicContact CG-CG1 4.45Å; V105-V393 HydrophobicContact CB-CG1 4.45Å; V105-V393 HydrophobicContact CG1-CG1 3.89Å; V105-V393 HydrophobicContact CG2-CG1 3.76Å; P391-V393 HydrophobicContact CB-CG1 4.29Å; P391-V393 PolarHBondContact O-N 3.12Å; P391-V393 VanDerWaalsContact O-N 3.14Å
394	L	91.8	Very high	84.9	Confident	22 Å²	22	44.2 Å²	44.2	12%	0.115	23%	0.233	C	C	.	.	H	α-helix	trans	-89.1	-13.2	178.5	-57.7	-173.7	0	0	0	112.8	E90 V105 R390 P391 M392	E90-L394 HydrophobicContact CB-CD2 3.83Å; E90-L394 HydrophobicContact CG-CD2 3.78Å; V105-L394 HydrophobicContact CB-CD1 4.49Å; V105-L394 HydrophobicContact CB-CD2 4.48Å; V105-L394 HydrophobicContact CG2-CD2 4Å; V105-L394 HydrophobicContact CG2-CG 4.5Å; R390-L394 HydrophobicContact CB-CB 4.35Å; P391-L394 HydrophobicContact CG-CD1 4.49Å; P391-L394 PolarHBondContact O-N 3.4Å; M392-L394 PolarHBondContact O-N 2.87Å
395	I	89.9	Confident	84.9	Confident	2 Å²	2	47.1 Å²	47.1	1%	0.01	25%	0.248	C	C	.	.	H	α-helix	trans	-89.4	-37.3	177.8	-57.8	173.7	0	0	0	111.3	F263 K339 L342 R390 M392	F263-I395 HydrophobicContact CD1-CD1 4.24Å; F263-I395 HydrophobicContact CE1-CD1 4.06Å; K339-I395 HydrophobicContact CD-CG2 4.16Å; L342-I395 HydrophobicContact CD1-CD1 4.42Å; L342-I395 HydrophobicContact CD1-CG2 3.92Å; R390-I395 HydrophobicContact CB-CD1 3.93Å; R390-I395 HydrophobicContact CB-CG1 3.55Å; R390-I395 WeakPolarHBondContact O-CD1 3.46Å; M392-I395 PolarHBondContact O-N 2.74Å
396	G	79.9	Confident	85.3	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.24	C	C	.	.			trans	95.1	90.3	-170.8	0	0	0	0	0	112.2	G138 M392	G138-G396 WeakPolarHBondContact O-CA 3.34Å; M392-G396 PolarHBondContact O-N 2.82Å
397	G	60.6	Low	85.5	Confident	44 Å²	44	36 Å²	36	45%	0.454	19%	0.191	S	C	.	.			trans	-51.9	0	-174.7	0	0	0	0	0	116.3	R85 T137	R85-G397 PolarHBondContact NH1-OXT 3.38Å; T137-G397 VanDerWaalsContact CG2-O 3.31Å; T137-G397 WeakPolarHBondContact CG2-O 3.46Å

Retrieved 397 of 397 residues in 120.9 ms (Link to these results)

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