A0A087YL26_POEFO Loading...

Bifunctional lysine-specific demethylase and histidyl-hydroxylase

Oxygenase that can act as both a histone lysine demethylase and a ribosomal histidine hydroxylase.

AlphaFold DB , UniProt , Accession A0A087YL26, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 553 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.6	Very low	38	Very low	247 Å²	247	129.9 Å²	129.9	100%	1.217	70%	0.698	S	S	*	*				0	87.5	0	-77.2	-173.6	-130.3	0	0	106.7	G3	M1-G3 PolarHBondContact O-N 2.92Å
2	E	28.9	Very low	38.1	Very low	198 Å²	198	130.4 Å²	130.4	93%	0.925	68%	0.684	S	S	*	*			trans	-75.9	110.6	173.5	-74.9	168.8	160.3	0	0	107.8	K4	E2-K4 PolarHBondContact O-N 3.03Å
3	G	32.8	Very low	38.4	Very low	71 Å²	71	129.2 Å²	129.2	73%	0.732	67%	0.673	S	S	*	*			trans	-77.1	107.2	173.4	0	0	0	0	0	108.9	M1 H5	M1-G3 PolarHBondContact O-N 2.92Å; G3-H5 PolarHBondContact O-N 3.03Å
4	K	36.3	Very low	38.4	Very low	203 Å²	203	125.2 Å²	125.2	88%	0.883	66%	0.662	S	S	*	*			trans	-61.5	104.9	162.2	-81	-175.8	174.1	-176.5	0	107.8	E2 M6	E2-K4 PolarHBondContact O-N 3.03Å; K4-M6 PolarHBondContact O-N 3.34Å; K4-M6 VanDerWaalsContact O-N 3.13Å
5	H	37.3	Very low	38.4	Very low	193 Å²	193	125.8 Å²	125.8	89%	0.894	66%	0.664	S	S	*	*			trans	-66.8	106	167	-107.6	-78.1	0	0	0	107.8	G3	G3-H5 PolarHBondContact O-N 3.03Å
6	M	38.3	Very low	38.2	Very low	132 Å²	132	126.1 Å²	126.1	65%	0.65	66%	0.661	S	S	*	*			trans	-80.9	124.4	166.2	-76.4	-173.5	65.4	0	0	108.4	K4 S10	K4-M6 PolarHBondContact O-N 3.34Å; K4-M6 VanDerWaalsContact O-N 3.13Å; M6-S10 WeakPolarHBondContact CE-OG 3.44Å
7	S	50.3	Low	37.8	Very low	70 Å²	70	124.5 Å²	124.5	49%	0.49	66%	0.662	S	S	.	*			trans	-69.3	151.8	176.5	78.6	0	0	0	0	110.4	F9 S10	S7-F9 PolarHBondContact O-N 2.78Å; S7-F9 WeakPolarHBondContact OG-CB 3.16Å; S7-F9 PolarHBondContact OG-N 3.19Å; S7-S10 PolarHBondContact O-N 3.16Å; S7-S10 PolarHBondContact O-OG 3.06Å
8	A	39.9	Very low	37.6	Very low	83 Å²	83	127.2 Å²	127.2	69%	0.686	67%	0.671	S	S	*	*	H	α-helix	trans	-58.2	-22.1	176.1	0	0	0	0	0	112.9	L11 Y12	A8-L11 WeakPolarHBondContact O-CB 3.45Å; A8-L11 PolarHBondContact O-N 2.99Å; A8-Y12 PolarHBondContact O-N 3.48Å
9	F	41.5	Very low	37.4	Very low	87 Å²	87	129.1 Å²	129.1	38%	0.382	68%	0.68	S	S	.	*	H	α-helix	trans	-65	-40.1	173.9	-171.5	-100.2	0	0	0	112.8	S7 L11 Y12 Q13	S7-F9 PolarHBondContact O-N 2.78Å; S7-F9 WeakPolarHBondContact OG-CB 3.16Å; S7-F9 PolarHBondContact OG-N 3.19Å; F9-L11 PolarHBondContact O-N 3.31Å; F9-Y12 PolarHBondContact O-N 3.05Å; F9-Q13 HydrophobicContact CD1-CG 4.29Å; F9-Q13 HydrophobicContact CE1-CG 3.93Å; F9-Q13 VanDerWaalsContact CE1-NE2 3.3Å; F9-Q13 HydrophobicContact CZ-CG 4.25Å; F9-Q13 PolarHBondContact O-N 3.47Å
10	S	42	Very low	37.2	Very low	36 Å²	36	128.5 Å²	128.5	25%	0.252	68%	0.684	S	S	.	*	H	α-helix	trans	-65.7	-27.1	175.8	65.1	0	0	0	0	113.2	M6 S7	M6-S10 WeakPolarHBondContact CE-OG 3.44Å; S7-S10 PolarHBondContact O-N 3.16Å; S7-S10 PolarHBondContact O-OG 3.06Å
11	L	39.2	Very low	36.9	Very low	109 Å²	109	128 Å²	128	57%	0.571	69%	0.688	S	S	*	*	H	α-helix	trans	-77	-24.6	170.8	-93.8	151.8	0	0	0	113.1	A8 F9 S14 L15	A8-L11 WeakPolarHBondContact O-CB 3.45Å; A8-L11 PolarHBondContact O-N 2.99Å; F9-L11 PolarHBondContact O-N 3.31Å; L11-S14 PolarHBondContact O-OG 3.33Å; L11-S14 VanDerWaalsContact O-OG 3.06Å; L11-L15 WeakPolarHBondContact O-CD1 3.23Å
12	Y	39.1	Very low	36.9	Very low	136 Å²	136	122.1 Å²	122.1	53%	0.533	67%	0.669	S	S	.	*	H	α-helix	trans	-84.6	-38.2	179	-174.5	-101.8	0	0	0	112.3	A8 F9 S14 L15 Q16	A8-Y12 PolarHBondContact O-N 3.48Å; F9-Y12 PolarHBondContact O-N 3.05Å; Y12-S14 VanDerWaalsContact C-N 3.3Å; Y12-S14 PolarHBondContact O-N 2.98Å; Y12-L15 PolarHBondContact O-N 2.8Å; Y12-L15 VanDerWaalsContact O-N 3.17Å; Y12-Q16 PolarHBondContact OH-NE2 3.26Å
13	Q	41.9	Very low	37	Very low	114 Å²	114	121.2 Å²	121.2	53%	0.533	67%	0.669	S	S	.	*	H	α-helix	trans	-63.1	-34.1	175.2	-78	-177.8	-39.3	0	0	112.9	F9 L15 Q16	F9-Q13 HydrophobicContact CD1-CG 4.29Å; F9-Q13 HydrophobicContact CE1-CG 3.93Å; F9-Q13 VanDerWaalsContact CE1-NE2 3.3Å; F9-Q13 HydrophobicContact CZ-CG 4.25Å; F9-Q13 PolarHBondContact O-N 3.47Å; Q13-L15 PolarHBondContact O-N 3.45Å; Q13-Q16 PolarHBondContact O-N 3.08Å
14	S	39.1	Very low	36.8	Very low	74 Å²	74	127.8 Å²	127.8	52%	0.517	68%	0.678	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.4	-13.5	177	61	0	0	0	0	114	L11 Y12 S17	L11-S14 PolarHBondContact O-OG 3.33Å; L11-S14 VanDerWaalsContact O-OG 3.06Å; Y12-S14 VanDerWaalsContact C-N 3.3Å; Y12-S14 PolarHBondContact O-N 2.98Å; S14-S17 PolarHBondContact O-OG 2.86Å
15	L	37.2	Very low	36.3	Very low	134 Å²	134	127.8 Å²	127.8	70%	0.702	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.3	-12.8	177.8	-72.4	165.2	0	0	0	113.7	L11 Y12 Q13	L11-L15 WeakPolarHBondContact O-CD1 3.23Å; Y12-L15 PolarHBondContact O-N 2.8Å; Y12-L15 VanDerWaalsContact O-N 3.17Å; Q13-L15 PolarHBondContact O-N 3.45Å
16	Q	36.1	Very low	35.9	Very low	131 Å²	131	124.8 Å²	124.8	61%	0.612	68%	0.675	S	S	*	*	S	Bend	trans	-94	-5.1	-178.4	-75.6	-170.2	-17.4	0	0	114.3	Y12 Q13 E18	Y12-Q16 PolarHBondContact OH-NE2 3.26Å; Q13-Q16 PolarHBondContact O-N 3.08Å; Q16-E18 VanDerWaalsContact C-N 3.32Å; Q16-E18 PolarHBondContact O-N 3.39Å
17	S	31	Very low	35.1	Very low	98 Å²	98	124.6 Å²	124.6	69%	0.685	69%	0.685	S	S	*	*			trans	-83.1	3.8	-176.4	58.1	0	0	0	0	115.3	S14	S14-S17 PolarHBondContact O-OG 2.86Å
18	E	33.6	Very low	33.9	Very low	174 Å²	174	130.2 Å²	130.2	81%	0.813	70%	0.704	S	S	*	*	S	Bend	trans	-88.4	117.6	175	-67.1	-164	170.9	0	0	112	Q16	Q16-E18 VanDerWaalsContact C-N 3.32Å; Q16-E18 PolarHBondContact O-N 3.39Å
19	L	34.4	Very low	33.2	Very low	162 Å²	162	137.9 Å²	137.9	85%	0.848	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-49.4	146.7	170.9	-76.8	157.1	0	0	0	111.9
20	P	33.8	Very low	32.3	Very low	117 Å²	117	140.1 Å²	140.1	76%	0.76	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-68.4	136.2	-177.8	26	-31.7	0	0	0	112.1
21	P	31.4	Very low	31.5	Very low	118 Å²	118	147.9 Å²	147.9	77%	0.766	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-75.6	157.5	176.5	28.6	-32.2	0	0	0	112.5
22	P	30.2	Very low	30.7	Very low	125 Å²	125	149 Å²	149	81%	0.812	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-72.4	146.1	-170.3	27.8	-33.2	0	0	0	114.1
23	L	31.3	Very low	29.9	Very low	179 Å²	179	151.1 Å²	151.1	94%	0.937	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-53.6	127.6	-177.1	-71.5	157.6	0	0	0	113.8
24	K	27.9	Very low	29.1	Very low	208 Å²	208	152.4 Å²	152.4	90%	0.904	81%	0.806	S	S	*	*			trans	-110.2	145.4	163.6	-79.7	-176.6	179	175.3	0	111.6
25	K	27.6	Very low	28.4	Very low	203 Å²	203	158.2 Å²	158.2	88%	0.883	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-52.6	156.1	-168.5	-73.5	176.9	177.1	178	0	116.4
26	P	27.1	Very low	27.7	Very low	130 Å²	130	161.9 Å²	161.9	84%	0.844	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-76.6	134.2	-172.5	30.4	-33.7	0	0	0	113
27	C	22.9	Very low	27.2	Very low	128 Å²	128	165.6 Å²	165.6	87%	0.865	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-96.2	142.3	172	-156.6	0	0	0	0	111.1
28	Q	24.5	Very low	26.8	Very low	189 Å²	189	171.1 Å²	171.1	88%	0.883	86%	0.858	S	S	*	*	P	Polyproline II helix	trans	-64.6	134.6	-168.7	-67.5	168.4	-22.9	0	0	113.5
29	R	25.4	Very low	26.5	Very low	244 Å²	244	172.8 Å²	172.8	92%	0.921	86%	0.863	S	S	*	*	P	Polyproline II helix	trans	-89.8	121.6	172.2	-78.6	-176.6	176.1	-179.3	-0.7	111.4
30	V	23.3	Very low	26.1	Very low	134 Å²	134	175 Å²	175	81%	0.812	87%	0.865	S	S	*	*	P	Polyproline II helix	trans	-76.8	132.1	166.8	176.9	0	0	0	0	109.4
31	K	23.7	Very low	25.8	Very low	199 Å²	199	176.1 Å²	176.1	87%	0.865	87%	0.87	S	S	*	*	P	Polyproline II helix	trans	-79.3	136.3	175.8	-71.6	177.9	176.1	177	0	110.6
32	V	23.6	Very low	25.5	Very low	133 Å²	133	177.9 Å²	177.9	81%	0.806	87%	0.873	S	S	*	*			trans	-124	122.8	165.7	-178.8	0	0	0	0	109.3
33	E	22.5	Very low	25.8	Very low	179 Å²	179	175.7 Å²	175.7	84%	0.836	87%	0.873	S	S	*	*			trans	-77.2	136.7	175.5	-73.2	-178.3	142.9	0	0	111.8
34	V	24.5	Very low	25.9	Very low	141 Å²	141	173 Å²	173	86%	0.855	87%	0.869	S	S	*	*			trans	-99.2	114.8	174	179.8	0	0	0	0	110.3
35	K	23.2	Very low	26.2	Very low	197 Å²	197	167 Å²	167	86%	0.857	86%	0.859	S	S	*	*			trans	-80.7	129.1	171.1	-82.3	-179.7	176.2	172.7	0	111.5
36	K	23.6	Very low	26.5	Very low	210 Å²	210	161 Å²	161	91%	0.913	85%	0.847	S	S	*	*			trans	-71.5	132.6	173.2	-74.3	176.3	175.4	172.3	0	111.9
37	K	24.9	Very low	26.9	Very low	210 Å²	210	158.6 Å²	158.6	91%	0.913	84%	0.838	S	S	*	*			trans	-119.2	126.3	159.5	-103.7	-178.3	177.5	176.6	0	110.7
38	K	24.2	Very low	27.6	Very low	214 Å²	214	159 Å²	159	93%	0.93	83%	0.83	S	S	*	*			trans	-75.1	135.5	173.7	-76.7	175.2	172.6	175.1	0	110.1
39	K	25.9	Very low	28.3	Very low	208 Å²	208	154 Å²	154	90%	0.904	81%	0.812	S	S	*	*			trans	-118.3	128.9	162.3	-123.1	178.1	-178.8	178	0	109.2
40	K	25.6	Very low	28.9	Very low	209 Å²	209	147.7 Å²	147.7	91%	0.909	80%	0.797	S	S	*	*			trans	-67.2	140	173.4	-84	175.5	169.1	177.8	0	109.8
41	V	28.2	Very low	29.7	Very low	140 Å²	140	148.5 Å²	148.5	85%	0.848	79%	0.791	S	S	*	*			trans	-122.7	126.5	168.2	179	0	0	0	0	108.4
42	N	25.6	Very low	30.4	Very low	155 Å²	155	144.8 Å²	144.8	83%	0.829	78%	0.777	S	S	*	*			trans	-78.1	154.7	175.7	-87.3	-15	0	0	0	111.6
43	G	36.8	Very low	31.2	Very low	79 Å²	79	147 Å²	147	81%	0.814	77%	0.771	S	S	*	*	S	Bend	trans	-68.7	137.2	-169.1	0	0	0	0	0	115.9
44	S	33.1	Very low	32	Very low	123 Å²	123	141.2 Å²	141.2	86%	0.86	75%	0.754	S	S	*	*	S	Bend	trans	176.7	5.4	149.9	45.3	0	0	0	0	112.5
45	A	34	Very low	32.8	Very low	83 Å²	83	142.1 Å²	142.1	69%	0.686	75%	0.746	S	S	*	*			trans	-103.1	28.2	177.2	0	0	0	0	0	114.9
46	A	33.8	Very low	33.6	Very low	77 Å²	77	141.6 Å²	141.6	64%	0.636	74%	0.739	S	S	*	*	S	Bend	trans	-99.7	-10.7	-177	0	0	0	0	0	115.1
47	A	35.9	Very low	34.5	Very low	79 Å²	79	141.2 Å²	141.2	65%	0.653	73%	0.731	S	S	*	*	S	Bend	trans	-90.7	-27.5	-177.3	0	0	0	0	0	114.1
48	I	38.1	Very low	35.2	Very low	137 Å²	137	139.2 Å²	139.2	70%	0.703	72%	0.723	S	S	*	*	H	α-helix	trans	-87.2	-28.9	-174.2	-61.5	173.6	0	0	0	111.9	N50	I48-N50 VanDerWaalsContact C-N 3.34Å; I48-N50 PolarHBondContact O-N 3.11Å
49	V	38.7	Very low	36.1	Very low	83 Å²	83	134.1 Å²	134.1	50%	0.503	71%	0.705	S	S	.	*	H	α-helix	trans	-73.2	-22.6	-179.4	179.9	0	0	0	0	113
50	N	38.1	Very low	36.9	Very low	112 Å²	112	132.4 Å²	132.4	60%	0.599	69%	0.693	S	S	*	*	H	α-helix	trans	-82.4	-26	-178.9	-87	-24.4	0	0	0	114	I48 A54	I48-N50 VanDerWaalsContact C-N 3.34Å; I48-N50 PolarHBondContact O-N 3.11Å; N50-A54 PolarHBondContact O-N 3.25Å
51	Q	39.2	Very low	37.5	Very low	150 Å²	150	129.9 Å²	129.9	70%	0.701	68%	0.682	S	S	*	*	H	α-helix	trans	-75.5	-33.3	176.5	-77.1	-173	-12	0	0	112.6	K55	Q51-K55 PolarHBondContact O-N 3.47Å
52	E	39.6	Very low	38.3	Very low	122 Å²	122	131.5 Å²	131.5	57%	0.57	68%	0.677	S	S	*	*	H	α-helix	trans	-73.6	-36	176.2	-73.1	-159.2	136.2	0	0	113.3	A54 K55 R56	E52-A54 VanDerWaalsContact C-N 3.32Å; E52-A54 PolarHBondContact O-N 2.86Å; E52-K55 PolarHBondContact O-N 2.98Å; E52-R56 WeakPolarHBondContact O-CG 3.38Å; E52-R56 PolarHBondContact O-N 2.61Å
53	R	40.5	Very low	38.9	Very low	180 Å²	180	129.8 Å²	129.8	68%	0.679	67%	0.667	S	S	*	*	H	α-helix	trans	-65.5	-33.5	174.6	-90.2	-177.9	168.2	-174	-2.6	112.7	R57	R53-R57 PolarHBondContact O-N 3.42Å
54	A	38.4	Very low	38.9	Very low	56 Å²	56	130.9 Å²	130.9	46%	0.463	65%	0.651	S	S	.	*	H	α-helix	trans	-71.9	-37.2	175.8	0	0	0	0	0	112.9	N50 E52 K58	N50-A54 PolarHBondContact O-N 3.25Å; E52-A54 VanDerWaalsContact C-N 3.32Å; E52-A54 PolarHBondContact O-N 2.86Å; A54-K58 PolarHBondContact O-N 3.37Å
55	K	40.9	Very low	39	Very low	160 Å²	160	133.2 Å²	133.2	70%	0.696	65%	0.646	S	S	*	*	H	α-helix	trans	-66.8	-43.1	173.8	-82.2	-178	176.7	177.3	0	112.1	Q51 E52 R57 K58 I59	Q51-K55 PolarHBondContact O-N 3.47Å; E52-K55 PolarHBondContact O-N 2.98Å; K55-R57 VanDerWaalsContact C-N 3.34Å; K55-R57 PolarHBondContact O-N 3.47Å; K55-K58 PolarHBondContact O-N 3.23Å; K55-I59 WeakPolarHBondContact O-CG1 3.42Å; K55-I59 PolarHBondContact O-N 3.21Å
56	R	41.3	Very low	39.4	Very low	187 Å²	187	132.1 Å²	132.1	71%	0.706	64%	0.637	S	S	*	*	H	α-helix	trans	-64.8	-33.8	176.7	-71.5	-176.1	-178.8	-155.2	2.1	113.1	E52 R60	E52-R56 WeakPolarHBondContact O-CG 3.38Å; E52-R56 PolarHBondContact O-N 2.61Å; R56-R60 PolarHBondContact O-N 3.07Å; R56-R60 VanDerWaalsContact O-N 3.16Å
57	R	40.8	Very low	39.5	Very low	201 Å²	201	131.2 Å²	131.2	76%	0.758	63%	0.629	S	S	*	*	H	α-helix	trans	-70.6	-33.8	174.8	-116.5	175.4	163.9	-176.9	-4.9	113.5	R53 K55 K61	R53-R57 PolarHBondContact O-N 3.42Å; K55-R57 VanDerWaalsContact C-N 3.34Å; K55-R57 PolarHBondContact O-N 3.47Å; R57-K61 PolarHBondContact O-N 3.17Å
58	K	39.5	Very low	39.4	Very low	169 Å²	169	133.2 Å²	133.2	74%	0.735	63%	0.629	S	S	*	*	H	α-helix	trans	-71.6	-35.1	175.6	-81.3	-175.2	176.5	-179.2	0	112.6	A54 K55 K62	A54-K58 PolarHBondContact O-N 3.37Å; K55-K58 PolarHBondContact O-N 3.23Å; K58-K62 PolarHBondContact O-N 3.33Å
59	I	44.9	Very low	39.2	Very low	106 Å²	106	135.2 Å²	135.2	54%	0.544	63%	0.633	S	S	.	*	H	α-helix	trans	-70.2	-42.5	176.3	-65.5	167.9	0	0	0	110.8	K55 K61 K62 L63	K55-I59 WeakPolarHBondContact O-CG1 3.42Å; K55-I59 PolarHBondContact O-N 3.21Å; I59-K61 PolarHBondContact O-N 3.4Å; I59-K62 WeakPolarHBondContact O-CB 3.22Å; I59-K62 PolarHBondContact O-N 3.35Å; I59-K62 VanDerWaalsContact O-N 3.09Å; I59-L63 HydrophobicContact CG2-CD1 4.08Å; I59-L63 PolarHBondContact O-N 3.45Å; I59-L63 VanDerWaalsContact O-N 3.09Å
60	R	41	Very low	39	Very low	173 Å²	173	139.8 Å²	139.8	65%	0.653	65%	0.649	S	S	*	*	H	α-helix	trans	-62.2	-41.5	177.4	-170.2	171.9	174.6	164.7	2.2	113.2	R56 K62 L63 E64	R56-R60 PolarHBondContact O-N 3.07Å; R56-R60 VanDerWaalsContact O-N 3.16Å; R60-K62 VanDerWaalsContact C-N 3.29Å; R60-K62 PolarHBondContact O-N 2.94Å; R60-L63 PolarHBondContact O-N 3.05Å; R60-E64 IonicContact NE-OE1 3.36Å; R60-E64 PolarHBondContact NE-OE1 3.09Å; R60-E64 PolarHBondContact O-N 3.21Å
61	K	39.5	Very low	38.6	Very low	156 Å²	156	142.3 Å²	142.3	68%	0.678	66%	0.657	S	S	*	*	H	α-helix	trans	-67.9	-23.5	173.5	-84.9	-172.5	172.9	-174.7	0	114.1	R57 I59 K65	R57-K61 PolarHBondContact O-N 3.17Å; I59-K61 PolarHBondContact O-N 3.4Å; K61-K65 PolarHBondContact O-N 2.85Å
62	K	44.2	Very low	38.2	Very low	174 Å²	174	139.7 Å²	139.7	76%	0.757	66%	0.655	S	S	*	*	H	α-helix	trans	-78.7	-33.8	176.1	-132.4	-177.9	-178.4	-172.8	0	111.5	K58 I59 R60 A66	K58-K62 PolarHBondContact O-N 3.33Å; I59-K62 WeakPolarHBondContact O-CB 3.22Å; I59-K62 PolarHBondContact O-N 3.35Å; I59-K62 VanDerWaalsContact O-N 3.09Å; R60-K62 VanDerWaalsContact C-N 3.29Å; R60-K62 PolarHBondContact O-N 2.94Å; K62-A66 PolarHBondContact O-N 3.38Å
63	L	39.5	Very low	37.7	Very low	119 Å²	119	143.8 Å²	143.8	62%	0.623	67%	0.671	S	S	*	*	H	α-helix	trans	-75.1	-39	175.1	-71.2	165	0	0	0	112.4	I59 R60 K65 A66 A67	I59-L63 HydrophobicContact CG2-CD1 4.08Å; I59-L63 PolarHBondContact O-N 3.45Å; I59-L63 VanDerWaalsContact O-N 3.09Å; R60-L63 PolarHBondContact O-N 3.05Å; L63-K65 VanDerWaalsContact C-N 3.33Å; L63-K65 PolarHBondContact O-N 3.19Å; L63-A66 PolarHBondContact O-N 3.39Å; L63-A67 PolarHBondContact O-N 3.02Å; L63-A67 VanDerWaalsContact O-N 3.1Å
64	E	35.7	Very low	37.3	Very low	101 Å²	101	144.6 Å²	144.6	47%	0.472	68%	0.679	S	S	.	*	H	α-helix	trans	-66.8	-31	175.1	-75.1	165.5	-175.2	0	0	112.5	R60 N68	R60-E64 IonicContact NE-OE1 3.36Å; R60-E64 PolarHBondContact NE-OE1 3.09Å; R60-E64 PolarHBondContact O-N 3.21Å; E64-N68 PolarHBondContact O-N 3.14Å
65	K	36.4	Very low	36.9	Very low	173 Å²	173	150.3 Å²	150.3	75%	0.752	70%	0.702	S	S	*	*	H	α-helix	trans	-75.6	-21.5	172.5	-94.1	-173.2	173.8	-174.4	0	114.3	K61 L63	K61-K65 PolarHBondContact O-N 2.85Å; L63-K65 VanDerWaalsContact C-N 3.33Å; L63-K65 PolarHBondContact O-N 3.19Å
66	A	41.1	Very low	36.1	Very low	59 Å²	59	146.1 Å²	146.1	49%	0.488	70%	0.704	S	S	.	*	H	α-helix	trans	-80.9	-37.1	174.2	0	0	0	0	0	111.2	K62 L63 K69	K62-A66 PolarHBondContact O-N 3.38Å; L63-A66 PolarHBondContact O-N 3.39Å; A66-K69 PolarHBondContact O-N 2.61Å
67	A	36.4	Very low	35.7	Very low	59 Å²	59	142.9 Å²	142.9	49%	0.488	71%	0.707	S	S	.	*	H	α-helix	trans	-65.4	-42.7	174.4	0	0	0	0	0	112.5	L63 K69 Q70	L63-A67 PolarHBondContact O-N 3.02Å; L63-A67 VanDerWaalsContact O-N 3.1Å; A67-K69 PolarHBondContact O-N 2.85Å; A67-Q70 PolarHBondContact O-N 3.22Å
68	N	33.4	Very low	35.5	Very low	120 Å²	120	141 Å²	141	64%	0.642	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	-4.7	178.1	-90.6	19.5	0	0	0	115.1	E64	E64-N68 PolarHBondContact O-N 3.14Å
69	K	34.1	Very low	35	Very low	180 Å²	180	139.6 Å²	139.6	78%	0.783	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95	-6.5	175.7	-128.2	-179	-178.3	-172.7	0	113.3	A66 A67	A66-K69 PolarHBondContact O-N 2.61Å; A67-K69 PolarHBondContact O-N 2.85Å
70	Q	34.2	Very low	34.3	Very low	179 Å²	179	141 Å²	141	84%	0.836	73%	0.727	S	S	*	*	S	Bend	trans	-99.4	-6.5	173.7	-80.4	-176.1	-28.2	0	0	113.7	A67	A67-Q70 PolarHBondContact O-N 3.22Å
71	E	30.1	Very low	34	Very low	165 Å²	165	141 Å²	141	77%	0.771	73%	0.734	S	S	*	*	S	Bend	trans	-96.1	11	-177.3	-111.9	-179.7	173.4	0	0	115.6
72	S	29.9	Very low	33.7	Very low	95 Å²	95	142.5 Å²	142.5	66%	0.664	74%	0.744	S	S	*	*	S	Bend	trans	-124.5	51.2	180	54.4	0	0	0	0	113.9
73	K	29.9	Very low	33.6	Very low	207 Å²	207	140.8 Å²	140.8	90%	0.9	74%	0.738	S	S	*	*			trans	-149.4	73	154.9	-74.7	-164.5	178.9	179	0	110.1
74	K	31.3	Very low	33.8	Very low	198 Å²	198	143.9 Å²	143.9	86%	0.861	75%	0.749	S	S	*	*			trans	-102.5	112.4	156.4	-92.9	-175.1	175.6	179.5	0	107.3
75	N	29.9	Very low	34.6	Very low	176 Å²	176	142.6 Å²	142.6	94%	0.941	75%	0.751	S	S	*	*			trans	-178.9	112.6	145.6	-88.6	-10.2	0	0	0	107.8
76	G	25.3	Very low	35.7	Very low	71 Å²	71	136.3 Å²	136.3	73%	0.732	73%	0.727	S	S	*	*			trans	171.9	146.1	176	0	0	0	0	0	110.8
77	P	32.6	Very low	36.5	Very low	119 Å²	119	139.7 Å²	139.7	77%	0.773	74%	0.742	S	S	*	*				-95.1	168.2	-125.8	35.3	-35.6	0	0	0	115	N79	P77-N79 PolarHBondContact O-N 3.25Å
78	D	36	Very low	38	Very low	163 Å²	163	138.1 Å²	138.1	87%	0.872	73%	0.729	S	S	*	*			trans	-41.4	116.9	163.6	-149.8	3.7	0	0	0	110.6
79	N	29.1	Very low	40.4	Very low	138 Å²	138	135.7 Å²	135.7	74%	0.738	71%	0.714	S	S	*	*			trans	-148	103.6	174.9	-129.5	5.7	0	0	0	109.3	P77 Q81	P77-N79 PolarHBondContact O-N 3.25Å; N79-Q81 PolarHBondContact O-N 3.49Å
80	T	31.5	Very low	43.1	Very low	137 Å²	137	129.7 Å²	129.7	84%	0.84	70%	0.695	S	S	*	*			trans	-48.3	99.1	164	-14.2	0	0	0	0	109.2	Q82	T80-Q82 PolarHBondContact O-N 3.16Å
81	Q	34.1	Very low	46.1	Very low	173 Å²	173	121.2 Å²	121.2	81%	0.808	66%	0.655	S	S	*	*			trans	-77.4	103.9	169.8	-80.6	-177.4	-11.5	0	0	108.4	N79 Q83	N79-Q81 PolarHBondContact O-N 3.49Å; Q81-Q83 PolarHBondContact O-N 3.07Å
82	Q	33.7	Very low	49.1	Very low	187 Å²	187	117.4 Å²	117.4	87%	0.874	64%	0.64	S	S	*	*			trans	-54.2	109.4	153.9	-77.6	174.2	-18.6	0	0	107.3	T80 E84	T80-Q82 PolarHBondContact O-N 3.16Å; Q82-E84 PolarHBondContact O-N 2.65Å
83	Q	40.4	Very low	52.2	Low	137 Å²	137	114.5 Å²	114.5	64%	0.64	62%	0.621	S	S	*	*			trans	-76	104	175.9	-88.2	172.6	-39.9	0	0	108.8	Q81 S85 K139	Q81-Q83 PolarHBondContact O-N 3.07Å; Q83-S85 PolarHBondContact O-N 3.35Å; Q83-K139 VanDerWaalsContact CD-NZ 3.31Å
84	E	44	Very low	55.4	Low	185 Å²	185	105.2 Å²	105.2	86%	0.864	58%	0.582	S	S	*	*			trans	-61.4	128.6	174.2	-70.5	177.6	157.8	0	0	110.7	Q82	Q82-E84 PolarHBondContact O-N 2.65Å
85	S	53	Low	58.6	Low	73 Å²	73	96.7 Å²	96.7	51%	0.51	55%	0.546	S	S	.	.			trans	-63.6	133.7	168.8	54.9	0	0	0	0	109.6	Q83 T87	Q83-S85 PolarHBondContact O-N 3.35Å; S85-T87 PolarHBondContact O-N 2.97Å
86	V	58.7	Low	61.7	Low	41 Å²	41	92 Å²	92	25%	0.248	52%	0.523	C	S	.	.			trans	-68.8	102.9	175.2	-178.2	0	0	0	0	108.8	A88 N117	V86-A88 HydrophobicContact CG1-CB 4.43Å; V86-A88 PolarHBondContact O-N 2.79Å; V86-N117 VanDerWaalsContact CG1-ND2 3.26Å; V86-N117 WeakPolarHBondContact CG1-ND2 3.34Å
87	T	59.9	Low	65.1	Low	131 Å²	131	93 Å²	93	80%	0.804	51%	0.509	S	S	*	.			trans	-76.5	74.8	173	56.3	0	0	0	0	109.1	S85	S85-T87 PolarHBondContact O-N 2.97Å
88	A	66.6	Low	68.2	Low	25 Å²	25	87.7 Å²	87.7	21%	0.207	47%	0.474	C	S	.	.	P	Polyproline II helix	trans	-88.5	150.9	166.2	0	0	0	0	0	109.8	V86 Y143	V86-A88 HydrophobicContact CG1-CB 4.43Å; V86-A88 PolarHBondContact O-N 2.79Å; A88-Y143 HydrophobicContact CB-CD2 3.96Å; A88-Y143 HydrophobicContact CB-CE2 3.22Å
89	E	84	Confident	71	Confident	69 Å²	69	82.3 Å²	82.3	32%	0.322	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-58.2	145.4	170.4	-172.3	178.8	-158.5	0	0	111	A93 E97 W114	E89-A93 HydrophobicContact CG-CB 3.5Å; E89-A93 VanDerWaalsContact CG-CB 3.5Å; E89-A93 VanDerWaalsContact OE1-C 3.29Å; E89-A93 WeakPolarHBondContact OE1-CB 3.37Å; E89-E97 VanDerWaalsContact OE1-CD 3.26Å; E89-W114 PolarHBondContact O-NE1 2.8Å
90	S	91.3	Very high	74.2	Confident	54 Å²	54	85.2 Å²	85.2	38%	0.378	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-65.2	157	176.5	66	0	0	0	0	111.3	D92 A93 L94	S90-D92 VanDerWaalsContact C-N 3.3Å; S90-D92 PolarHBondContact O-N 2.84Å; S90-A93 PolarHBondContact O-N 2.9Å; S90-A93 WeakPolarHBondContact OG-CB 3.32Å; S90-A93 PolarHBondContact OG-N 3.1Å; S90-L94 WeakPolarHBondContact O-CB 3.46Å; S90-L94 PolarHBondContact O-N 3.1Å
91	L	95.8	Very high	77.3	Confident	1 Å²	1	80 Å²	80	1%	0.005	42%	0.416	C	S	.	.	H	α-helix	trans	-57.9	-42	178.5	179.2	61.9	0	0	0	112.3	A93 L94 L95 L111 W114 L147 T213 V217	L91-A93 VanDerWaalsContact C-N 3.34Å; L91-A93 PolarHBondContact O-N 2.87Å; L91-L94 HydrophobicContact CD1-CD2 4.36Å; L91-L94 PolarHBondContact O-N 2.88Å; L91-L95 HydrophobicContact CD1-CD1 4.04Å; L91-L95 HydrophobicContact CD1-CD2 4.26Å; L91-L95 HydrophobicContact CD1-CG 3.84Å; L91-L95 HydrophobicContact CD2-CD1 4.47Å; L91-L95 HydrophobicContact CG-CD1 3.91Å; L91-L95 HydrophobicContact CG-CG 4.13Å; L91-L95 WeakPolarHBondContact O-CB 3.34Å; L91-L95 VanDerWaalsContact O-CG 3.27Å; L91-L95 WeakPolarHBondContact O-CG 3.37Å; L91-L95 PolarHBondContact O-N 2.99Å; L91-L111 HydrophobicContact CD1-CD1 4.4Å; L91-W114 HydrophobicContact CB-CH2 3.89Å; L91-W114 HydrophobicContact CB-CZ2 4.07Å; L91-W114 HydrophobicContact CD1-CH2 3.88Å; L91-W114 HydrophobicContact CD1-CZ2 4.45Å; L91-W114 HydrophobicContact CD1-CZ3 3.94Å; L91-W114 HydrophobicContact CG-CH2 4.38Å; L91-L147 HydrophobicContact CD2-CB 3.6Å; L91-L147 HydrophobicContact CD2-CD1 4.05Å; L91-L147 HydrophobicContact CD2-CG 4.32Å; L91-T213 HydrophobicContact CD2-CG2 4.17Å; L91-V217 HydrophobicContact CD1-CG2 4.32Å; L91-V217 HydrophobicContact CD2-CG2 4.49Å
92	D	94.3	Very high	80.1	Confident	86 Å²	86	75.5 Å²	75.5	46%	0.46	40%	0.397	S	S	.	.	H	α-helix	trans	-63.7	-40.9	-179.4	-67.3	-24.7	0	0	0	112.2	S90 T96	S90-D92 VanDerWaalsContact C-N 3.3Å; S90-D92 PolarHBondContact O-N 2.84Å; D92-T96 WeakPolarHBondContact O-CB 3.49Å; D92-T96 PolarHBondContact O-N 2.95Å; D92-T96 PolarHBondContact O-OG1 3.03Å
93	A	95	Very high	83.2	Confident	33 Å²	33	68.3 Å²	68.3	27%	0.273	36%	0.364	S	S	.	.	H	α-helix	trans	-68.9	-45.1	177.9	0	0	0	0	0	110.2	E89 S90 L91 L95 T96 E97	E89-A93 HydrophobicContact CG-CB 3.5Å; E89-A93 VanDerWaalsContact CG-CB 3.5Å; E89-A93 VanDerWaalsContact OE1-C 3.29Å; E89-A93 WeakPolarHBondContact OE1-CB 3.37Å; S90-A93 PolarHBondContact O-N 2.9Å; S90-A93 WeakPolarHBondContact OG-CB 3.32Å; S90-A93 PolarHBondContact OG-N 3.1Å; L91-A93 VanDerWaalsContact C-N 3.34Å; L91-A93 PolarHBondContact O-N 2.87Å; A93-L95 PolarHBondContact O-N 3.11Å; A93-T96 CarbonylContact O-C 3.54Å; A93-T96 WeakPolarHBondContact O-CA 3.44Å; A93-T96 WeakPolarHBondContact O-CB 3.24Å; A93-T96 PolarHBondContact O-N 3.09Å; A93-T96 VanDerWaalsContact O-N 3.11Å; A93-E97 WeakPolarHBondContact O-CG 3.39Å; A93-E97 PolarHBondContact O-N 3.48Å
94	L	97.2	Very high	85.9	Confident	13 Å²	13	61.8 Å²	61.8	7%	0.068	33%	0.334	C	S	.	.	H	α-helix	trans	-55.2	-52.6	171.8	176.4	74.6	0	0	0	111.9	S90 L91 T96 E97 L98 L111 W114	S90-L94 WeakPolarHBondContact O-CB 3.46Å; S90-L94 PolarHBondContact O-N 3.1Å; L91-L94 HydrophobicContact CD1-CD2 4.36Å; L91-L94 PolarHBondContact O-N 2.88Å; L94-T96 PolarHBondContact O-N 2.92Å; L94-E97 WeakPolarHBondContact O-CB 3.45Å; L94-E97 PolarHBondContact O-N 3.13Å; L94-L98 HydrophobicContact CD1-CD2 4.45Å; L94-L98 HydrophobicContact CD1-CG 4.41Å; L94-L98 HydrophobicContact CG-CD1 4.34Å; L94-L98 HydrophobicContact CG-CG 4.3Å; L94-L98 VanDerWaalsContact O-CG 3.3Å; L94-L98 WeakPolarHBondContact O-CG 3.16Å; L94-L98 PolarHBondContact O-N 2.85Å; L94-L111 HydrophobicContact CD2-CD1 3.6Å; L94-W114 HydrophobicContact CD1-CB 4.32Å; L94-W114 HydrophobicContact CD1-CG 4.37Å; L94-W114 HydrophobicContact CD2-CB 3.67Å; L94-W114 HydrophobicContact CD2-CD2 3.47Å; L94-W114 VanDerWaalsContact CD2-CD2 3.47Å; L94-W114 HydrophobicContact CD2-CE3 3.88Å; L94-W114 HydrophobicContact CD2-CG 3.37Å; L94-W114 HydrophobicContact CG-CG 4.4Å
95	L	97.4	Very high	88.4	Confident	19 Å²	19	58 Å²	58	10%	0.099	32%	0.315	C	S	.	.	H	α-helix	trans	-59.9	-34.8	-179.2	-71.3	178.7	0	0	0	111.3	L91 A93 L98 T99 T213 V217 I220	L91-L95 HydrophobicContact CD1-CD1 4.04Å; L91-L95 HydrophobicContact CD1-CD2 4.26Å; L91-L95 HydrophobicContact CD1-CG 3.84Å; L91-L95 HydrophobicContact CD2-CD1 4.47Å; L91-L95 HydrophobicContact CG-CD1 3.91Å; L91-L95 HydrophobicContact CG-CG 4.13Å; L91-L95 WeakPolarHBondContact O-CB 3.34Å; L91-L95 VanDerWaalsContact O-CG 3.27Å; L91-L95 WeakPolarHBondContact O-CG 3.37Å; L91-L95 PolarHBondContact O-N 2.99Å; A93-L95 PolarHBondContact O-N 3.11Å; L95-L98 HydrophobicContact CD2-CD1 4.29Å; L95-L98 PolarHBondContact O-N 2.82Å; L95-T99 WeakPolarHBondContact O-CG2 3.35Å; L95-T99 PolarHBondContact O-N 3.3Å; L95-T213 HydrophobicContact CD1-CG2 3.98Å; L95-V217 HydrophobicContact CD2-CG2 4.35Å; L95-I220 HydrophobicContact CD2-CD1 4.38Å
96	T	96.4	Very high	90.6	Very high	76 Å²	76	59 Å²	59	47%	0.466	31%	0.311	S	S	.	.	H	α-helix	trans	-66.2	-45.5	172.7	-57.6	0	0	0	0	111.2	D92 A93 L94 L98 T99	D92-T96 WeakPolarHBondContact O-CB 3.49Å; D92-T96 PolarHBondContact O-N 2.95Å; D92-T96 PolarHBondContact O-OG1 3.03Å; A93-T96 CarbonylContact O-C 3.54Å; A93-T96 WeakPolarHBondContact O-CA 3.44Å; A93-T96 WeakPolarHBondContact O-CB 3.24Å; A93-T96 PolarHBondContact O-N 3.09Å; A93-T96 VanDerWaalsContact O-N 3.11Å; L94-T96 PolarHBondContact O-N 2.92Å; T96-L98 VanDerWaalsContact C-N 3.33Å; T96-L98 PolarHBondContact O-N 3.16Å; T96-T99 WeakPolarHBondContact O-CB 3.45Å; T96-T99 PolarHBondContact O-N 3.24Å; T96-T99 VanDerWaalsContact O-N 3.15Å; T96-T99 PolarHBondContact O-OG1 3.41Å
97	E	96.6	Very high	92.5	Very high	94 Å²	94	57.3 Å²	57.3	44%	0.439	30%	0.3	S	S	.	.	H	α-helix	trans	-60.7	-41.3	175.1	-67.8	-160.2	153.7	0	0	112.2	E89 A93 L94 T99 R100	E89-E97 VanDerWaalsContact OE1-CD 3.26Å; A93-E97 WeakPolarHBondContact O-CG 3.39Å; A93-E97 PolarHBondContact O-N 3.48Å; L94-E97 WeakPolarHBondContact O-CB 3.45Å; L94-E97 PolarHBondContact O-N 3.13Å; E97-T99 PolarHBondContact O-N 3.48Å; E97-T99 VanDerWaalsContact O-N 3.15Å; E97-R100 WeakPolarHBondContact O-CB 3.24Å; E97-R100 PolarHBondContact O-N 3.46Å
98	L	97.3	Very high	94.3	Very high	7 Å²	7	51.1 Å²	51.1	4%	0.037	26%	0.262	C	S	.	.	H	α-helix	trans	-59.8	-26.8	177.2	-66.5	-173.8	0	0	0	112.4	L94 L95 T96 R100 V101 R107 N110 L111 I220	L94-L98 HydrophobicContact CD1-CD2 4.45Å; L94-L98 HydrophobicContact CD1-CG 4.41Å; L94-L98 HydrophobicContact CG-CD1 4.34Å; L94-L98 HydrophobicContact CG-CG 4.3Å; L94-L98 VanDerWaalsContact O-CG 3.3Å; L94-L98 WeakPolarHBondContact O-CG 3.16Å; L94-L98 PolarHBondContact O-N 2.85Å; L95-L98 HydrophobicContact CD2-CD1 4.29Å; L95-L98 PolarHBondContact O-N 2.82Å; T96-L98 VanDerWaalsContact C-N 3.33Å; T96-L98 PolarHBondContact O-N 3.16Å; L98-R100 PolarHBondContact O-N 3.25Å; L98-V101 PolarHBondContact O-N 3.1Å; L98-R107 HydrophobicContact CB-CG 4.2Å; L98-R107 HydrophobicContact CD2-CB 4.23Å; L98-R107 HydrophobicContact CD2-CG 4.35Å; L98-R107 WeakPolarHBondContact O-CD 3.44Å; L98-R107 WeakPolarHBondContact O-CG 3.38Å; L98-N110 HydrophobicContact CD2-CB 3.73Å; L98-L111 HydrophobicContact CD1-CB 3.96Å; L98-I220 HydrophobicContact CD1-CD1 4.23Å
99	T	95.8	Very high	95.8	Very high	50 Å²	50	53.3 Å²	53.3	31%	0.307	27%	0.271	S	S	.	.	H	α-helix	trans	-63.9	-24.9	175	70.5	0	0	0	0	113.1	L95 T96 E97 T421	L95-T99 WeakPolarHBondContact O-CG2 3.35Å; L95-T99 PolarHBondContact O-N 3.3Å; T96-T99 WeakPolarHBondContact O-CB 3.45Å; T96-T99 PolarHBondContact O-N 3.24Å; T96-T99 VanDerWaalsContact O-N 3.15Å; T96-T99 PolarHBondContact O-OG1 3.41Å; E97-T99 PolarHBondContact O-N 3.48Å; E97-T99 VanDerWaalsContact O-N 3.15Å; T99-T421 HydrophobicContact CG2-CG2 4.14Å
100	R	95.4	Very high	96.5	Very high	199 Å²	199	53 Å²	53	75%	0.751	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-11.2	179.7	-56.3	177.4	-179.7	162.2	0.5	112.9	E97 L98 N102	E97-R100 WeakPolarHBondContact O-CB 3.24Å; E97-R100 PolarHBondContact O-N 3.46Å; L98-R100 PolarHBondContact O-N 3.25Å; R100-N102 PolarHBondContact O-N 3.32Å
101	V	96.6	Very high	96.8	Very high	28 Å²	28	50.6 Å²	50.6	17%	0.17	25%	0.254	C	S	.	.			trans	-85.5	109.8	-179.6	179.9	0	0	0	0	109.3	L98 N103 E106 R107	L98-V101 PolarHBondContact O-N 3.1Å; V101-N103 VanDerWaalsContact C-N 3.27Å; V101-N103 PolarHBondContact O-N 3.46Å; V101-E106 HydrophobicContact CG1-CB 3.84Å; V101-E106 HydrophobicContact CG1-CG 3.88Å; V101-R107 HydrophobicContact CB-CG 3.74Å; V101-R107 HydrophobicContact CG1-CG 3.93Å; V101-R107 PolarHBondContact O-NE 3.43Å; V101-R107 PolarHBondContact O-NH2 3.47Å
102	N	93.6	Very high	97	Very high	77 Å²	77	50.6 Å²	50.6	41%	0.412	25%	0.254	S	S	.	.	S	Bend	trans	-60.9	-32.8	-174.7	-174.3	35.2	0	0	0	113.6	R100 R107 K455 P509	R100-N102 PolarHBondContact O-N 3.32Å; N102-R107 PolarHBondContact O-NH2 3.4Å; N102-K455 PolarHBondContact OD1-NZ 3.08Å; N102-P509 PolarHBondContact ND2-O 3.35Å; N102-P509 VanDerWaalsContact ND2-O 3.1Å
103	N	97.3	Very high	97.1	Very high	36 Å²	36	49.6 Å²	49.6	19%	0.193	25%	0.247	C	C	.	.			trans	-93.8	118.2	-177.6	-173.9	-14.2	0	0	0	112.1	V101 K105 E106 R107 Y508 P509	V101-N103 VanDerWaalsContact C-N 3.27Å; V101-N103 PolarHBondContact O-N 3.46Å; N103-K105 PolarHBondContact O-N 3.34Å; N103-K105 WeakPolarHBondContact OD1-CB 3.27Å; N103-K105 PolarHBondContact OD1-N 2.92Å; N103-E106 HydrophobicContact CB-CB 3.88Å; N103-E106 WeakPolarHBondContact O-CB 3.25Å; N103-E106 PolarHBondContact O-N 2.85Å; N103-E106 VanDerWaalsContact O-N 3.14Å; N103-R107 PolarHBondContact O-N 3.42Å; N103-Y508 WeakPolarHBondContact OD1-CE1 3.31Å; N103-P509 HydrophobicContact CB-CB 3.87Å; N103-P509 HydrophobicContact CB-CG 3.95Å
104	S	97.9	Very high	97.3	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-66.3	-34.6	-179.7	63.2	0	0	0	0	113.1	E106 R107 A108 E223 R458 G459 Y508	S104-E106 PolarHBondContact O-N 3.26Å; S104-R107 WeakPolarHBondContact O-CB 3.45Å; S104-R107 PolarHBondContact O-N 3.46Å; S104-R107 VanDerWaalsContact O-N 3.13Å; S104-A108 PolarHBondContact O-N 2.85Å; S104-E223 WeakPolarHBondContact CB-OE2 2.91Å; S104-E223 VanDerWaalsContact OG-CD 3.26Å; S104-E223 PolarHBondContact OG-OE1 3.37Å; S104-E223 PolarHBondContact OG-OE2 2.86Å; S104-E223 VanDerWaalsContact OG-OE2 3.05Å; S104-R458 VanDerWaalsContact CB-CD 3.49Å; S104-G459 PolarHBondContact OG-N 3.41Å; S104-Y508 VanDerWaalsContact CB-OH 3.32Å; S104-Y508 WeakPolarHBondContact CB-OH 3.12Å; S104-Y508 PolarHBondContact N-OH 3.38Å; S104-Y508 PolarHBondContact OG-OH 2.85Å
105	K	97.1	Very high	97.3	Very high	106 Å²	106	48.9 Å²	48.9	46%	0.461	24%	0.237	S	C	.	.	H	α-helix	trans	-63.6	-34.5	173.1	-61.4	-177	178	177.3	0	111.2	N103 N109 E223 G459	N103-K105 PolarHBondContact O-N 3.34Å; N103-K105 WeakPolarHBondContact OD1-CB 3.27Å; N103-K105 PolarHBondContact OD1-N 2.92Å; K105-N109 PolarHBondContact O-N 3.11Å; K105-N109 PolarHBondContact O-ND2 3.43Å; K105-E223 HydrophobicContact CG-CG 4.25Å; K105-E223 WeakPolarHBondContact CG-OE1 3.41Å; K105-E223 PolarHBondContact N-OE1 3.15Å; K105-G459 WeakPolarHBondContact CE-O 3.36Å
106	E	98.1	Very high	97.3	Very high	93 Å²	93	48 Å²	48	44%	0.435	23%	0.232	S	C	.	.	H	α-helix	trans	-70.5	-41.3	173.3	-169.9	178.3	174.8	0	0	111.4	V101 N103 S104 A108 N109 N110	V101-E106 HydrophobicContact CG1-CB 3.84Å; V101-E106 HydrophobicContact CG1-CG 3.88Å; N103-E106 HydrophobicContact CB-CB 3.88Å; N103-E106 WeakPolarHBondContact O-CB 3.25Å; N103-E106 PolarHBondContact O-N 2.85Å; N103-E106 VanDerWaalsContact O-N 3.14Å; S104-E106 PolarHBondContact O-N 3.26Å; E106-A108 VanDerWaalsContact C-N 3.28Å; E106-A108 PolarHBondContact O-N 3.04Å; E106-N109 PolarHBondContact O-N 2.94Å; E106-N109 VanDerWaalsContact O-N 3.15Å; E106-N110 WeakPolarHBondContact O-CB 3.39Å; E106-N110 VanDerWaalsContact O-CG 3.25Å; E106-N110 PolarHBondContact O-N 3.15Å; E106-N110 PolarHBondContact O-OD1 3.35Å
107	R	98.3	Very high	97.3	Very high	6 Å²	6	46.8 Å²	46.8	2%	0.023	22%	0.223	C	C	.	.	H	α-helix	trans	-55.5	-45.2	171.7	-65.2	174.4	-125.7	-169.1	11.5	111.8	L98 V101 N102 N103 S104 N110 L111 I220 E424	L98-R107 HydrophobicContact CB-CG 4.2Å; L98-R107 HydrophobicContact CD2-CB 4.23Å; L98-R107 HydrophobicContact CD2-CG 4.35Å; L98-R107 WeakPolarHBondContact O-CD 3.44Å; L98-R107 WeakPolarHBondContact O-CG 3.38Å; V101-R107 HydrophobicContact CB-CG 3.74Å; V101-R107 HydrophobicContact CG1-CG 3.93Å; V101-R107 PolarHBondContact O-NE 3.43Å; V101-R107 PolarHBondContact O-NH2 3.47Å; N102-R107 PolarHBondContact O-NH2 3.4Å; N103-R107 PolarHBondContact O-N 3.42Å; S104-R107 WeakPolarHBondContact O-CB 3.45Å; S104-R107 PolarHBondContact O-N 3.46Å; S104-R107 VanDerWaalsContact O-N 3.13Å; R107-N110 PolarHBondContact O-N 3.44Å; R107-L111 WeakPolarHBondContact O-CB 3.36Å; R107-L111 PolarHBondContact O-N 3.5Å; R107-I220 HydrophobicContact CB-CG2 4.47Å; R107-E424 IonicContact CZ-OE1 3.93Å; R107-E424 VanDerWaalsContact CZ-OE1 3.22Å; R107-E424 IonicContact NH1-OE1 3.56Å; R107-E424 PolarHBondContact NH1-OE1 3.2Å; R107-E424 IonicContact NH2-OE1 2.64Å; R107-E424 PolarHBondContact NH2-OE1 3.26Å
108	A	98.4	Very high	97.3	Very high	1 Å²	1	46 Å²	46	1%	0.008	23%	0.226	C	C	.	.	H	α-helix	trans	-61.2	-43.4	177.1	0	0	0	0	0	112.3	S104 E106 F112 I220 E223 K224	S104-A108 PolarHBondContact O-N 2.85Å; E106-A108 VanDerWaalsContact C-N 3.28Å; E106-A108 PolarHBondContact O-N 3.04Å; A108-F112 VanDerWaalsContact O-CB 3.23Å; A108-F112 WeakPolarHBondContact O-CB 3.44Å; A108-F112 PolarHBondContact O-N 3.42Å; A108-I220 HydrophobicContact CB-CG2 4.15Å; A108-I220 VanDerWaalsContact CB-O 3.27Å; A108-I220 WeakPolarHBondContact CB-O 3.33Å; A108-E223 HydrophobicContact CB-CB 4.19Å; A108-K224 HydrophobicContact CB-CB 4.05Å
109	N	98.3	Very high	97.3	Very high	72 Å²	72	47 Å²	47	39%	0.385	23%	0.232	S	C	.	.	H	α-helix	trans	-63.8	-43	174.6	-74.2	-47.9	0	0	0	112.6	K105 E106 F112 Q113 K224	K105-N109 PolarHBondContact O-N 3.11Å; K105-N109 PolarHBondContact O-ND2 3.43Å; E106-N109 PolarHBondContact O-N 2.94Å; E106-N109 VanDerWaalsContact O-N 3.15Å; N109-F112 PolarHBondContact O-N 3.15Å; N109-Q113 VanDerWaalsContact O-CB 3.3Å; N109-Q113 WeakPolarHBondContact O-CB 3.37Å; N109-Q113 PolarHBondContact O-N 3.2Å; N109-K224 WeakPolarHBondContact OD1-CD 3.45Å; N109-K224 WeakPolarHBondContact OD1-CE 3.49Å; N109-K224 PolarHBondContact OD1-NZ 3.35Å
110	N	98.2	Very high	97.4	Very high	63 Å²	63	48.1 Å²	48.1	34%	0.337	24%	0.24	S	C	.	.	H	α-helix	trans	-67.6	-46.6	-179	-69.1	-6.1	0	0	0	111.1	L98 E106 R107 F112 Q113 W114	L98-N110 HydrophobicContact CD2-CB 3.73Å; E106-N110 WeakPolarHBondContact O-CB 3.39Å; E106-N110 VanDerWaalsContact O-CG 3.25Å; E106-N110 PolarHBondContact O-N 3.15Å; E106-N110 PolarHBondContact O-OD1 3.35Å; R107-N110 PolarHBondContact O-N 3.44Å; N110-F112 PolarHBondContact O-N 2.76Å; N110-Q113 PolarHBondContact O-N 3Å; N110-W114 WeakPolarHBondContact O-CB 3.26Å; N110-W114 PolarHBondContact O-N 3.25Å
111	L	98.6	Very high	97.5	Very high	3 Å²	3	39.3 Å²	39.3	2%	0.016	21%	0.21	C	C	.	.	H	α-helix	trans	-61.1	-43.9	175.6	-178.2	59.6	0	0	0	111.7	L91 L94 L98 R107 W114 L115 V217 I220 L221	L91-L111 HydrophobicContact CD1-CD1 4.4Å; L94-L111 HydrophobicContact CD2-CD1 3.6Å; L98-L111 HydrophobicContact CD1-CB 3.96Å; R107-L111 WeakPolarHBondContact O-CB 3.36Å; R107-L111 PolarHBondContact O-N 3.5Å; L111-W114 HydrophobicContact CD1-CE3 4.28Å; L111-W114 PolarHBondContact O-N 2.83Å; L111-L115 WeakPolarHBondContact O-CB 3.41Å; L111-L115 PolarHBondContact O-N 3.27Å; L111-V217 HydrophobicContact CD2-CG1 4.24Å; L111-I220 HydrophobicContact CB-CG2 3.94Å; L111-I220 HydrophobicContact CD2-CB 3.68Å; L111-I220 HydrophobicContact CD2-CD1 4.21Å; L111-I220 HydrophobicContact CD2-CG2 3.46Å; L111-I220 VanDerWaalsContact CD2-CG2 3.46Å; L111-I220 HydrophobicContact CG-CG2 4.35Å; L111-L221 HydrophobicContact CD2-CD2 4.15Å; L111-L221 HydrophobicContact CD2-CG 3.98Å; L111-L221 HydrophobicContact CG-CD2 4.12Å; L111-L221 HydrophobicContact CG-CG 4.44Å
112	F	98.6	Very high	97.5	Very high	1 Å²	1	46.6 Å²	46.6	0%	0.004	24%	0.239	C	C	.	.	H	α-helix	trans	-66.4	-38.9	178.3	-174.7	-107.7	0	0	0	112.4	A108 N109 N110 L115 L116 A121 F124 F125 L221 K224 F225 F253	A108-F112 VanDerWaalsContact O-CB 3.23Å; A108-F112 WeakPolarHBondContact O-CB 3.44Å; A108-F112 PolarHBondContact O-N 3.42Å; N109-F112 PolarHBondContact O-N 3.15Å; N110-F112 PolarHBondContact O-N 2.76Å; F112-L115 WeakPolarHBondContact O-CB 3.37Å; F112-L115 PolarHBondContact O-N 3.32Å; F112-L116 HydrophobicContact CD1-CD1 3.95Å; F112-L116 HydrophobicContact CE1-CD1 3.3Å; F112-L116 HydrophobicContact CE1-CG 4.19Å; F112-L116 HydrophobicContact CE2-CD1 4.25Å; F112-L116 HydrophobicContact CE2-CG 4.39Å; F112-L116 HydrophobicContact CZ-CD1 3.49Å; F112-L116 VanDerWaalsContact CZ-CD1 3.49Å; F112-L116 HydrophobicContact CZ-CG 4.1Å; F112-L116 WeakPolarHBondContact O-CG 3.5Å; F112-L116 PolarHBondContact O-N 3.22Å; F112-L116 VanDerWaalsContact O-N 3.09Å; F112-A121 HydrophobicContact CD1-CB 3.94Å; F112-A121 HydrophobicContact CE1-CB 4.03Å; F112-F124 HydrophobicContact CE1-CD1 4.21Å; F112-F124 AromaticContact CZ-CD1 3.85Å; F112-F124 HydrophobicContact CZ-CD1 3.85Å; F112-F124 AromaticContact CZ-CE1 3.8Å; F112-F124 HydrophobicContact CZ-CE1 3.8Å; F112-F125 AromaticContact CD1-CE2 3.95Å; F112-F125 HydrophobicContact CD1-CE2 3.95Å; F112-F125 HydrophobicContact CD1-CZ 4.23Å; F112-F125 HydrophobicContact CE1-CD2 4.21Å; F112-F125 HydrophobicContact CE1-CE1 4.47Å; F112-F125 AromaticContact CE1-CE2 3.25Å; F112-F125 HydrophobicContact CE1-CE2 3.25Å; F112-F125 AromaticContact CE1-CZ 3.42Å; F112-F125 HydrophobicContact CE1-CZ 3.42Å; F112-F125 VanDerWaalsContact CE1-CZ 3.42Å; F112-F125 HydrophobicContact CZ-CE1 4.37Å; F112-F125 AromaticContact CZ-CE2 3.94Å; F112-F125 HydrophobicContact CZ-CE2 3.94Å; F112-F125 AromaticContact CZ-CZ 3.61Å; F112-F125 HydrophobicContact CZ-CZ 3.61Å; F112-L221 HydrophobicContact CB-CD2 4.11Å; F112-L221 HydrophobicContact CD2-CD2 4.14Å; F112-K224 HydrophobicContact CB-CD 4.38Å; F112-K224 HydrophobicContact CB-CG 3.87Å; F112-K224 HydrophobicContact CD1-CD 4.44Å; F112-K224 HydrophobicContact CD1-CG 4.16Å; F112-K224 HydrophobicContact CD2-CG 4.22Å; F112-K224 HydrophobicContact CG-CD 4.46Å; F112-K224 HydrophobicContact CG-CG 3.82Å; F112-F225 HydrophobicContact CD2-CE1 4.25Å; F112-F225 AromaticContact CD2-CZ 3.97Å; F112-F225 HydrophobicContact CD2-CZ 3.97Å; F112-F225 AromaticContact CE2-CE1 3.67Å; F112-F225 HydrophobicContact CE2-CE1 3.67Å; F112-F225 AromaticContact CE2-CZ 3.59Å; F112-F225 HydrophobicContact CE2-CZ 3.59Å; F112-F225 HydrophobicContact CZ-CE1 4.19Å; F112-F253 HydrophobicContact CE2-CE1 4.16Å; F112-F253 AromaticContact CE2-CZ 3.87Å; F112-F253 HydrophobicContact CE2-CZ 3.87Å; F112-F253 HydrophobicContact CZ-CZ 4.28Å
113	Q	98.1	Very high	97.7	Very high	65 Å²	65	47.6 Å²	47.6	30%	0.304	24%	0.238	S	C	.	.	H	α-helix	trans	-65.9	-40.3	174.7	-177.6	54.9	75.4	0	0	111.7	N109 N110 L115 L116 N117 V119	N109-Q113 VanDerWaalsContact O-CB 3.3Å; N109-Q113 WeakPolarHBondContact O-CB 3.37Å; N109-Q113 PolarHBondContact O-N 3.2Å; N110-Q113 PolarHBondContact O-N 3Å; Q113-L115 VanDerWaalsContact C-N 3.34Å; Q113-L116 PolarHBondContact O-N 2.65Å; Q113-N117 PolarHBondContact O-N 3.1Å; Q113-V119 PolarHBondContact NE2-O 3.44Å
114	W	98.1	Very high	97.8	Very high	25 Å²	25	45.9 Å²	45.9	10%	0.095	23%	0.229	C	C	.	.	H	α-helix	trans	-61.5	-43.3	171.8	177.7	95.9	0	0	0	111.1	E89 L91 L94 N110 L111 L116 N117 Y143 Y144	E89-W114 PolarHBondContact O-NE1 2.8Å; L91-W114 HydrophobicContact CB-CH2 3.89Å; L91-W114 HydrophobicContact CB-CZ2 4.07Å; L91-W114 HydrophobicContact CD1-CH2 3.88Å; L91-W114 HydrophobicContact CD1-CZ2 4.45Å; L91-W114 HydrophobicContact CD1-CZ3 3.94Å; L91-W114 HydrophobicContact CG-CH2 4.38Å; L94-W114 HydrophobicContact CD1-CB 4.32Å; L94-W114 HydrophobicContact CD1-CG 4.37Å; L94-W114 HydrophobicContact CD2-CB 3.67Å; L94-W114 HydrophobicContact CD2-CD2 3.47Å; L94-W114 VanDerWaalsContact CD2-CD2 3.47Å; L94-W114 HydrophobicContact CD2-CE3 3.88Å; L94-W114 HydrophobicContact CD2-CG 3.37Å; L94-W114 HydrophobicContact CG-CG 4.4Å; N110-W114 WeakPolarHBondContact O-CB 3.26Å; N110-W114 PolarHBondContact O-N 3.25Å; L111-W114 HydrophobicContact CD1-CE3 4.28Å; L111-W114 PolarHBondContact O-N 2.83Å; W114-L116 PolarHBondContact O-N 2.78Å; W114-N117 WeakPolarHBondContact O-CB 3.38Å; W114-N117 PolarHBondContact O-N 3.25Å; W114-Y143 AromaticContact CD2-CE1 3.89Å; W114-Y143 HydrophobicContact CD2-CE1 3.89Å; W114-Y143 AromaticContact CE2-CE1 3.52Å; W114-Y143 AromaticContact CE2-CZ 3.79Å; W114-Y143 HydrophobicContact CE3-CE1 4.07Å; W114-Y143 AromaticContact CH2-CD1 3.71Å; W114-Y143 HydrophobicContact CH2-CD1 3.71Å; W114-Y143 AromaticContact CH2-CE1 3.56Å; W114-Y143 HydrophobicContact CH2-CE1 3.56Å; W114-Y143 WeakPolarHBondContact CH2-O 3.48Å; W114-Y143 AromaticContact CZ2-CD1 3.62Å; W114-Y143 HydrophobicContact CZ2-CD1 3.62Å; W114-Y143 AromaticContact CZ2-CE1 3.36Å; W114-Y143 HydrophobicContact CZ2-CE1 3.36Å; W114-Y143 HydrophobicContact CZ2-CG 4.45Å; W114-Y143 WeakPolarHBondContact CZ2-O 2.85Å; W114-Y143 HydrophobicContact CZ3-CD1 4.41Å; W114-Y143 AromaticContact CZ3-CE1 3.91Å; W114-Y143 HydrophobicContact CZ3-CE1 3.91Å; W114-Y143 AromaticContact NE1-CZ 3.97Å; W114-Y143 PolarHBondContact O-OH 3.16Å; W114-Y144 AromaticContact CH2-CD1 3.72Å; W114-Y144 HydrophobicContact CH2-CD1 3.72Å; W114-Y144 AromaticContact CH2-CE1 4Å; W114-Y144 HydrophobicContact CH2-CE1 4Å; W114-Y144 HydrophobicContact CZ3-CD1 4.03Å; W114-Y144 AromaticContact CZ3-CE1 3.95Å; W114-Y144 HydrophobicContact CZ3-CE1 3.95Å
115	L	98.2	Very high	97.8	Very high	6 Å²	6	49 Å²	49	3%	0.031	24%	0.242	C	C	.	.	H	α-helix	trans	-59.4	-34.8	177.8	179.8	62.6	0	0	0	112.4	L111 F112 Q113 R138 Y144 L221 F253 I255 L302	L111-L115 WeakPolarHBondContact O-CB 3.41Å; L111-L115 PolarHBondContact O-N 3.27Å; F112-L115 WeakPolarHBondContact O-CB 3.37Å; F112-L115 PolarHBondContact O-N 3.32Å; Q113-L115 VanDerWaalsContact C-N 3.34Å; L115-R138 PolarHBondContact O-NH2 3.29Å; L115-Y144 HydrophobicContact CD1-CE1 4.09Å; L115-L221 HydrophobicContact CD2-CD1 4.23Å; L115-F253 HydrophobicContact CD2-CD1 4.46Å; L115-I255 HydrophobicContact CD1-CD1 3.66Å; L115-I255 HydrophobicContact CD1-CG1 4.14Å; L115-L302 HydrophobicContact CD1-CD1 4.19Å; L115-L302 WeakPolarHBondContact O-CD2 3.27Å
116	L	97.6	Very high	97.8	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-91.7	-13.2	-177.8	-71.2	-177.2	0	0	0	115.2	F112 Q113 W114 V119 A121 F124 F253 L302	F112-L116 HydrophobicContact CD1-CD1 3.95Å; F112-L116 HydrophobicContact CE1-CD1 3.3Å; F112-L116 HydrophobicContact CE1-CG 4.19Å; F112-L116 HydrophobicContact CE2-CD1 4.25Å; F112-L116 HydrophobicContact CE2-CG 4.39Å; F112-L116 HydrophobicContact CZ-CD1 3.49Å; F112-L116 VanDerWaalsContact CZ-CD1 3.49Å; F112-L116 HydrophobicContact CZ-CG 4.1Å; F112-L116 WeakPolarHBondContact O-CG 3.5Å; F112-L116 PolarHBondContact O-N 3.22Å; F112-L116 VanDerWaalsContact O-N 3.09Å; Q113-L116 PolarHBondContact O-N 2.65Å; W114-L116 PolarHBondContact O-N 2.78Å; L116-V119 HydrophobicContact CB-CB 4.43Å; L116-V119 WeakPolarHBondContact CB-O 3.47Å; L116-V119 WeakPolarHBondContact O-CB 3.27Å; L116-V119 PolarHBondContact O-N 2.87Å; L116-A121 HydrophobicContact CD1-CB 4.31Å; L116-F124 HydrophobicContact CD1-CB 3.68Å; L116-F124 HydrophobicContact CD1-CD1 3.85Å; L116-F124 HydrophobicContact CD1-CD2 4.07Å; L116-F124 HydrophobicContact CD1-CG 3.59Å; L116-F124 HydrophobicContact CD2-CD2 3.95Å; L116-F124 HydrophobicContact CD2-CE2 4.02Å; L116-F124 HydrophobicContact CD2-CG 4.31Å; L116-F124 HydrophobicContact CD2-CZ 4.45Å; L116-F253 HydrophobicContact CD2-CE1 4.12Å; L116-L302 HydrophobicContact CD2-CD2 3.97Å
117	N	95.9	Very high	97.8	Very high	49 Å²	49	49.9 Å²	49.9	26%	0.262	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.8	129.7	-172.5	-177.3	57.5	0	0	0	111.6	V86 Q113 W114 R138 Y143	V86-N117 VanDerWaalsContact CG1-ND2 3.26Å; V86-N117 WeakPolarHBondContact CG1-ND2 3.34Å; Q113-N117 PolarHBondContact O-N 3.1Å; W114-N117 WeakPolarHBondContact O-CB 3.38Å; W114-N117 PolarHBondContact O-N 3.25Å; N117-R138 PolarHBondContact O-NE 2.8Å; N117-R138 PolarHBondContact O-NH2 3.07Å; N117-R138 VanDerWaalsContact O-NH2 3.08Å; N117-Y143 WeakPolarHBondContact CB-OH 3.38Å
118	P	96.1	Very high	97.8	Very high	79 Å²	79	49.6 Å²	49.6	51%	0.513	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	cis	-91.8	8.9	11.2	37.6	-36.1	0	0	0	116.1	P120	P118-P120 VanDerWaalsContact O-CD 3.27Å; P118-P120 WeakPolarHBondContact O-CD 3.23Å
119	V	97.4	Very high	97.8	Very high	26 Å²	26	50.4 Å²	50.4	16%	0.158	24%	0.244	C	C	.	.	S	Bend	trans	-73.2	122	179.6	-175	0	0	0	0	109.9	Q113 L116 A121 Y123 F124 V134 V136	Q113-V119 PolarHBondContact NE2-O 3.44Å; L116-V119 HydrophobicContact CB-CB 4.43Å; L116-V119 WeakPolarHBondContact CB-O 3.47Å; L116-V119 WeakPolarHBondContact O-CB 3.27Å; L116-V119 PolarHBondContact O-N 2.87Å; V119-A121 PolarHBondContact O-N 2.62Å; V119-Y123 HydrophobicContact CG1-CD1 4.05Å; V119-F124 HydrophobicContact CG1-CB 4.19Å; V119-V134 HydrophobicContact CG2-CG1 4.39Å; V119-V136 HydrophobicContact CG2-CG2 3.94Å
120	P	97.7	Very high	97.8	Very high	74 Å²	74	49.7 Å²	49.7	48%	0.481	24%	0.238	S	C	.	.			trans	-66.8	131.8	176.3	-21.6	34.4	0	0	0	111.1	P118 K122 Y123 F124	P118-P120 VanDerWaalsContact O-CD 3.27Å; P118-P120 WeakPolarHBondContact O-CD 3.23Å; P120-K122 PolarHBondContact O-N 2.84Å; P120-Y123 WeakPolarHBondContact O-CA 3.35Å; P120-Y123 WeakPolarHBondContact O-CB 3.34Å; P120-Y123 PolarHBondContact O-N 3.27Å; P120-F124 PolarHBondContact O-N 3.09Å
121	A	97.5	Very high	97.8	Very high	14 Å²	14	52.6 Å²	52.6	12%	0.116	25%	0.248	C	C	.	.	H	α-helix	trans	-56.7	-38.4	-178	0	0	0	0	0	112.4	F112 L116 V119 Y123 F124 F125	F112-A121 HydrophobicContact CD1-CB 3.94Å; F112-A121 HydrophobicContact CE1-CB 4.03Å; L116-A121 HydrophobicContact CD1-CB 4.31Å; V119-A121 PolarHBondContact O-N 2.62Å; A121-Y123 VanDerWaalsContact C-N 3.32Å; A121-Y123 PolarHBondContact O-N 2.95Å; A121-F124 WeakPolarHBondContact O-CB 3.41Å; A121-F124 PolarHBondContact O-N 3.06Å; A121-F125 VanDerWaalsContact O-CD2 3.26Å; A121-F125 WeakPolarHBondContact O-CD2 3.4Å; A121-F125 PolarHBondContact O-N 2.7Å
122	K	97.2	Very high	97.8	Very high	181 Å²	181	56.5 Å²	56.5	79%	0.787	27%	0.265	S	S	*	.	H	α-helix	trans	-60.8	-39	175	-68.9	-176.5	-179.9	177.5	0	112.7	P120 R126	P120-K122 PolarHBondContact O-N 2.84Å; K122-R126 WeakPolarHBondContact O-CB 3.2Å; K122-R126 PolarHBondContact O-N 3.21Å
123	Y	98	Very high	97.8	Very high	98 Å²	98	57.5 Å²	57.5	38%	0.384	27%	0.271	S	S	.	.	H	α-helix	trans	-70.2	-43.2	175.4	175.3	-88.4	0	0	0	110.6	V119 P120 A121 R126 E127	V119-Y123 HydrophobicContact CG1-CD1 4.05Å; P120-Y123 WeakPolarHBondContact O-CA 3.35Å; P120-Y123 WeakPolarHBondContact O-CB 3.34Å; P120-Y123 PolarHBondContact O-N 3.27Å; A121-Y123 VanDerWaalsContact C-N 3.32Å; A121-Y123 PolarHBondContact O-N 2.95Å; Y123-R126 PolarHBondContact O-N 2.87Å; Y123-E127 HydrophobicContact CD1-CB 4.49Å; Y123-E127 HydrophobicContact CD2-CB 4.41Å; Y123-E127 HydrophobicContact CD2-CG 3.79Å; Y123-E127 HydrophobicContact CE1-CB 4.07Å; Y123-E127 HydrophobicContact CE1-CG 4.45Å; Y123-E127 HydrophobicContact CE2-CB 4.01Å; Y123-E127 HydrophobicContact CE2-CG 3.54Å; Y123-E127 HydrophobicContact CG-CG 4.36Å; Y123-E127 WeakPolarHBondContact O-CB 3.45Å; Y123-E127 PolarHBondContact O-N 2.8Å
124	F	98.5	Very high	97.8	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-56	-54.3	179.1	177.5	-93.6	0	0	0	112.1	F112 L116 V119 P120 A121 R126 T128 W129 F253 F304	F112-F124 HydrophobicContact CE1-CD1 4.21Å; F112-F124 AromaticContact CZ-CD1 3.85Å; F112-F124 HydrophobicContact CZ-CD1 3.85Å; F112-F124 AromaticContact CZ-CE1 3.8Å; F112-F124 HydrophobicContact CZ-CE1 3.8Å; L116-F124 HydrophobicContact CD1-CB 3.68Å; L116-F124 HydrophobicContact CD1-CD1 3.85Å; L116-F124 HydrophobicContact CD1-CD2 4.07Å; L116-F124 HydrophobicContact CD1-CG 3.59Å; L116-F124 HydrophobicContact CD2-CD2 3.95Å; L116-F124 HydrophobicContact CD2-CE2 4.02Å; L116-F124 HydrophobicContact CD2-CG 4.31Å; L116-F124 HydrophobicContact CD2-CZ 4.45Å; V119-F124 HydrophobicContact CG1-CB 4.19Å; P120-F124 PolarHBondContact O-N 3.09Å; A121-F124 WeakPolarHBondContact O-CB 3.41Å; A121-F124 PolarHBondContact O-N 3.06Å; F124-R126 VanDerWaalsContact C-N 3.31Å; F124-R126 PolarHBondContact O-N 2.96Å; F124-T128 HydrophobicContact CD2-CG2 3.78Å; F124-T128 HydrophobicContact CE2-CG2 3.67Å; F124-T128 CarbonylContact O-C 3.55Å; F124-T128 WeakPolarHBondContact O-CA 3.46Å; F124-T128 WeakPolarHBondContact O-CB 3.33Å; F124-T128 PolarHBondContact O-N 3.41Å; F124-W129 HydrophobicContact CD1-CB 4.5Å; F124-W129 HydrophobicContact CE1-CB 4.2Å; F124-W129 HydrophobicContact CE1-CD2 4.36Å; F124-W129 AromaticContact CE1-CE3 3.54Å; F124-W129 HydrophobicContact CE1-CE3 3.54Å; F124-W129 HydrophobicContact CE1-CZ3 4.27Å; F124-W129 AromaticContact CZ-CE3 3.92Å; F124-W129 HydrophobicContact CZ-CE3 3.92Å; F124-W129 PolarHBondContact O-N 3.27Å; F124-F253 HydrophobicContact CE1-CE1 4.28Å; F124-F253 HydrophobicContact CE1-CZ 4.08Å; F124-F253 HydrophobicContact CE2-CE1 4.33Å; F124-F253 AromaticContact CZ-CE1 3.69Å; F124-F253 HydrophobicContact CZ-CE1 3.69Å; F124-F253 AromaticContact CZ-CZ 3.79Å; F124-F253 HydrophobicContact CZ-CZ 3.79Å; F124-F304 HydrophobicContact CE2-CB 4.23Å; F124-F304 AromaticContact CE2-CD1 3.56Å; F124-F304 HydrophobicContact CE2-CD1 3.56Å; F124-F304 HydrophobicContact CE2-CD2 4.2Å; F124-F304 AromaticContact CE2-CE1 3.94Å; F124-F304 HydrophobicContact CE2-CE1 3.94Å; F124-F304 AromaticContact CE2-CG 3.7Å; F124-F304 HydrophobicContact CE2-CG 3.7Å; F124-F304 HydrophobicContact CE2-CZ 4.41Å; F124-F304 AromaticContact CZ-CD1 3.74Å; F124-F304 HydrophobicContact CZ-CD1 3.74Å; F124-F304 AromaticContact CZ-CD2 3.73Å; F124-F304 HydrophobicContact CZ-CD2 3.73Å; F124-F304 AromaticContact CZ-CE1 3.77Å; F124-F304 HydrophobicContact CZ-CE1 3.77Å; F124-F304 AromaticContact CZ-CE2 3.75Å; F124-F304 HydrophobicContact CZ-CE2 3.75Å; F124-F304 AromaticContact CZ-CG 3.72Å; F124-F304 HydrophobicContact CZ-CG 3.72Å; F124-F304 AromaticContact CZ-CZ 3.78Å; F124-F304 HydrophobicContact CZ-CZ 3.78Å
125	F	98	Very high	97.8	Very high	65 Å²	65	57.3 Å²	57.3	29%	0.285	27%	0.271	S	S	.	.	H	α-helix	trans	-63.5	-35.7	179.3	-74.8	-64.8	0	0	0	113.2	F112 A121 W129 K224	F112-F125 AromaticContact CD1-CE2 3.95Å; F112-F125 HydrophobicContact CD1-CE2 3.95Å; F112-F125 HydrophobicContact CD1-CZ 4.23Å; F112-F125 HydrophobicContact CE1-CD2 4.21Å; F112-F125 HydrophobicContact CE1-CE1 4.47Å; F112-F125 AromaticContact CE1-CE2 3.25Å; F112-F125 HydrophobicContact CE1-CE2 3.25Å; F112-F125 AromaticContact CE1-CZ 3.42Å; F112-F125 HydrophobicContact CE1-CZ 3.42Å; F112-F125 VanDerWaalsContact CE1-CZ 3.42Å; F112-F125 HydrophobicContact CZ-CE1 4.37Å; F112-F125 AromaticContact CZ-CE2 3.94Å; F112-F125 HydrophobicContact CZ-CE2 3.94Å; F112-F125 AromaticContact CZ-CZ 3.61Å; F112-F125 HydrophobicContact CZ-CZ 3.61Å; A121-F125 VanDerWaalsContact O-CD2 3.26Å; A121-F125 WeakPolarHBondContact O-CD2 3.4Å; A121-F125 PolarHBondContact O-N 2.7Å; F125-W129 HydrophobicContact CD1-CB 4.04Å; F125-W129 HydrophobicContact CD1-CD2 4.2Å; F125-W129 AromaticContact CD1-CG 3.93Å; F125-W129 HydrophobicContact CD1-CG 3.93Å; F125-W129 HydrophobicContact CE1-CD2 4.17Å; F125-W129 HydrophobicContact CE1-CE3 4.41Å; F125-W129 HydrophobicContact CE1-CG 4.38Å; F125-K224 VanDerWaalsContact CE2-CE 3.41Å
126	R	98.1	Very high	97.8	Very high	147 Å²	147	57.4 Å²	57.4	56%	0.555	27%	0.271	S	S	*	.	H	α-helix	trans	-74.5	-42.6	-178.6	-170	177.9	66.9	-134.4	-4.1	112.7	K122 Y123 F124 K131	K122-R126 WeakPolarHBondContact O-CB 3.2Å; K122-R126 PolarHBondContact O-N 3.21Å; Y123-R126 PolarHBondContact O-N 2.87Å; F124-R126 VanDerWaalsContact C-N 3.31Å; F124-R126 PolarHBondContact O-N 2.96Å; R126-K131 PolarHBondContact O-NZ 3.46Å
127	E	98	Very high	97.8	Very high	71 Å²	71	62.3 Å²	62.3	33%	0.332	29%	0.294	S	S	.	.	H	α-helix	trans	-111.6	-16.5	-166.5	-56.2	-59.4	159.5	0	0	114.4	Y123 K132	Y123-E127 HydrophobicContact CD1-CB 4.49Å; Y123-E127 HydrophobicContact CD2-CB 4.41Å; Y123-E127 HydrophobicContact CD2-CG 3.79Å; Y123-E127 HydrophobicContact CE1-CB 4.07Å; Y123-E127 HydrophobicContact CE1-CG 4.45Å; Y123-E127 HydrophobicContact CE2-CB 4.01Å; Y123-E127 HydrophobicContact CE2-CG 3.54Å; Y123-E127 HydrophobicContact CG-CG 4.36Å; Y123-E127 WeakPolarHBondContact O-CB 3.45Å; Y123-E127 PolarHBondContact O-N 2.8Å; E127-K132 VanDerWaalsContact O-CE 3.22Å; E127-K132 WeakPolarHBondContact O-CE 3.36Å
128	T	98	Very high	97.8	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.4	-50.4	-167	-54.9	0	0	0	0	113.5	F124 E130 K131 K132 V134 F304	F124-T128 HydrophobicContact CD2-CG2 3.78Å; F124-T128 HydrophobicContact CE2-CG2 3.67Å; F124-T128 CarbonylContact O-C 3.55Å; F124-T128 WeakPolarHBondContact O-CA 3.46Å; F124-T128 WeakPolarHBondContact O-CB 3.33Å; F124-T128 PolarHBondContact O-N 3.41Å; T128-E130 PolarHBondContact O-N 2.84Å; T128-K131 WeakPolarHBondContact O-CB 3.48Å; T128-K131 PolarHBondContact O-N 2.7Å; T128-K132 HydrophobicContact CG2-CG 4.3Å; T128-K132 VanDerWaalsContact CG2-O 3.29Å; T128-K132 WeakPolarHBondContact CG2-O 3.4Å; T128-K132 PolarHBondContact O-N 3.41Å; T128-K132 VanDerWaalsContact O-N 3.12Å; T128-V134 HydrophobicContact CG2-CB 4.08Å; T128-V134 HydrophobicContact CG2-CG2 3.32Å; T128-F304 HydrophobicContact CG2-CD1 3.75Å; T128-F304 HydrophobicContact CG2-CE1 3.82Å
129	W	98.6	Very high	97.7	Very high	19 Å²	19	61.3 Å²	61.3	7%	0.072	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.5	129.9	-179.3	-177.1	-103.3	0	0	0	111.4	F124 F125 K131 F225 E251 F253 F304 Y329	F124-W129 HydrophobicContact CD1-CB 4.5Å; F124-W129 HydrophobicContact CE1-CB 4.2Å; F124-W129 HydrophobicContact CE1-CD2 4.36Å; F124-W129 AromaticContact CE1-CE3 3.54Å; F124-W129 HydrophobicContact CE1-CE3 3.54Å; F124-W129 HydrophobicContact CE1-CZ3 4.27Å; F124-W129 AromaticContact CZ-CE3 3.92Å; F124-W129 HydrophobicContact CZ-CE3 3.92Å; F124-W129 PolarHBondContact O-N 3.27Å; F125-W129 HydrophobicContact CD1-CB 4.04Å; F125-W129 HydrophobicContact CD1-CD2 4.2Å; F125-W129 AromaticContact CD1-CG 3.93Å; F125-W129 HydrophobicContact CD1-CG 3.93Å; F125-W129 HydrophobicContact CE1-CD2 4.17Å; F125-W129 HydrophobicContact CE1-CE3 4.41Å; F125-W129 HydrophobicContact CE1-CG 4.38Å; W129-K131 WeakPolarHBondContact O-CG 3.37Å; W129-K131 PolarHBondContact O-N 2.86Å; W129-F225 HydrophobicContact CH2-CD1 4.04Å; W129-F225 AromaticContact CH2-CE1 3.97Å; W129-F225 HydrophobicContact CH2-CE1 3.97Å; W129-F225 HydrophobicContact CZ3-CE1 4.11Å; W129-E251 HydrophobicContact CH2-CB 3.57Å; W129-E251 HydrophobicContact CH2-CG 3.6Å; W129-E251 HydrophobicContact CZ2-CB 4.25Å; W129-E251 HydrophobicContact CZ2-CG 3.76Å; W129-E251 HydrophobicContact CZ3-CB 3.73Å; W129-E251 HydrophobicContact CZ3-CG 4Å; W129-F253 HydrophobicContact CE3-CZ 4.45Å; W129-F253 AromaticContact CZ3-CE2 3.9Å; W129-F253 HydrophobicContact CZ3-CE2 3.9Å; W129-F253 AromaticContact CZ3-CZ 3.81Å; W129-F253 HydrophobicContact CZ3-CZ 3.81Å; W129-F304 AromaticContact CE3-CE2 3.85Å; W129-F304 HydrophobicContact CE3-CE2 3.85Å; W129-F304 AromaticContact CE3-CZ 3.77Å; W129-F304 HydrophobicContact CE3-CZ 3.77Å; W129-F304 AromaticContact CZ3-CE2 3.87Å; W129-F304 HydrophobicContact CZ3-CE2 3.87Å; W129-F304 HydrophobicContact CZ3-CZ 4.24Å; W129-Y329 HydrophobicContact CH2-CD2 4.35Å; W129-Y329 HydrophobicContact CH2-CG 4.34Å; W129-Y329 AromaticContact CZ2-CD1 3.82Å; W129-Y329 HydrophobicContact CZ2-CD1 3.82Å; W129-Y329 AromaticContact CZ2-CD2 3.67Å; W129-Y329 HydrophobicContact CZ2-CD2 3.67Å; W129-Y329 HydrophobicContact CZ2-CE1 4.06Å; W129-Y329 AromaticContact CZ2-CE2 3.9Å; W129-Y329 HydrophobicContact CZ2-CE2 3.9Å; W129-Y329 AromaticContact CZ2-CG 3.62Å; W129-Y329 HydrophobicContact CZ2-CG 3.62Å; W129-Y329 AromaticContact NE1-CE1 3.88Å
130	E	98.5	Very high	97.6	Very high	57 Å²	57	61.6 Å²	61.6	27%	0.266	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.4	13.6	-175.2	-66.9	-173.6	134.2	0	0	116.1	T128 E251 L275 R307	T128-E130 PolarHBondContact O-N 2.84Å; E130-E251 PolarHBondContact N-OE2 3.46Å; E130-L275 HydrophobicContact CB-CD1 4.19Å; E130-L275 HydrophobicContact CB-CD2 3.86Å; E130-L275 HydrophobicContact CG-CD2 4.05Å; E130-R307 IonicContact OE1-CZ 3.04Å; E130-R307 VanDerWaalsContact OE1-CZ 3.25Å; E130-R307 IonicContact OE1-NH1 3.99Å; E130-R307 PolarHBondContact OE1-NH1 2.84Å; E130-R307 IonicContact OE1-NH2 3.4Å; E130-R307 PolarHBondContact OE1-NH2 3Å
131	K	98.3	Very high	97.5	Very high	124 Å²	124	62.1 Å²	62.1	54%	0.539	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.1	-48.3	-173	-67.7	171	-171	-177.2	0	114.6	R126 T128 W129	R126-K131 PolarHBondContact O-NZ 3.46Å; T128-K131 WeakPolarHBondContact O-CB 3.48Å; T128-K131 PolarHBondContact O-N 2.7Å; W129-K131 WeakPolarHBondContact O-CG 3.37Å; W129-K131 PolarHBondContact O-N 2.86Å
132	K	97.9	Very high	97.5	Very high	85 Å²	85	65.8 Å²	65.8	37%	0.37	30%	0.301	S	S	.	.			trans	-155.9	154.6	-171.9	62.7	-179.7	-175.9	-173	0	111.9	E127 T128	E127-K132 VanDerWaalsContact O-CE 3.22Å; E127-K132 WeakPolarHBondContact O-CE 3.36Å; T128-K132 HydrophobicContact CG2-CG 4.3Å; T128-K132 VanDerWaalsContact CG2-O 3.29Å; T128-K132 WeakPolarHBondContact CG2-O 3.4Å; T128-K132 PolarHBondContact O-N 3.41Å; T128-K132 VanDerWaalsContact O-N 3.12Å
133	P	98.3	Very high	97.5	Very high	21 Å²	21	57.2 Å²	57.2	14%	0.136	26%	0.264	C	S	.	.			trans	-71.1	155.7	174.8	31.1	-37	0	0	0	111.8	V265 I292 L293 F304 F305 F309	P133-V265 HydrophobicContact CB-CG1 4.39Å; P133-I292 HydrophobicContact CG-CD1 3.65Å; P133-L293 HydrophobicContact CB-CD1 4.37Å; P133-L293 HydrophobicContact CG-CD1 4.5Å; P133-F304 CarbonylContact C-O 3.55Å; P133-F304 WeakPolarHBondContact CA-O 3.44Å; P133-F304 WeakPolarHBondContact CB-O 3.47Å; P133-F305 HydrophobicContact CB-CB 4.04Å; P133-F309 HydrophobicContact CG-CE1 4.39Å
134	V	97.9	Very high	97.5	Very high	25 Å²	25	52.8 Å²	52.8	15%	0.152	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	131.6	172	159.1	0	0	0	0	109.4	V119 T128 V136 L303 F304	V119-V134 HydrophobicContact CG2-CG1 4.39Å; T128-V134 HydrophobicContact CG2-CB 4.08Å; T128-V134 HydrophobicContact CG2-CG2 3.32Å; V134-V136 HydrophobicContact CG1-CG2 3.85Å; V134-L303 CarbonylContact O-C 3.57Å; V134-L303 WeakPolarHBondContact O-CA 3.17Å; V134-F304 PolarHBondContact N-O 2.84Å; V134-F304 PolarHBondContact O-N 2.85Å
135	Y	98.5	Very high	97.4	Very high	61 Å²	61	59.1 Å²	59.1	24%	0.239	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	128.1	169.4	166.5	-129.2	0	0	0	109.1	Q137 V295 L297 D301	Y135-Q137 HydrophobicContact CE1-CB 3.85Å; Y135-Q137 HydrophobicContact CE2-CB 4.2Å; Y135-Q137 WeakPolarHBondContact OH-CB 3.41Å; Y135-Q137 VanDerWaalsContact OH-CG 3.24Å; Y135-Q137 WeakPolarHBondContact OH-CG 3.43Å; Y135-Q137 PolarHBondContact OH-NE2 3.09Å; Y135-V295 HydrophobicContact CD1-CB 4.37Å; Y135-V295 HydrophobicContact CD1-CG1 3.87Å; Y135-V295 HydrophobicContact CD2-CG2 4.42Å; Y135-V295 HydrophobicContact CE1-CB 4.28Å; Y135-V295 HydrophobicContact CE1-CG1 4.12Å; Y135-V295 HydrophobicContact CG-CG1 4.4Å; Y135-V295 HydrophobicContact CG-CG2 4.38Å; Y135-L297 HydrophobicContact CD2-CD2 3.81Å; Y135-L297 HydrophobicContact CE2-CD2 3.57Å; Y135-D301 HydrophobicContact CE2-CB 3.97Å; Y135-D301 WeakPolarHBondContact CE2-OD2 3.35Å; Y135-D301 PolarHBondContact OH-OD2 3.07Å
136	V	98.3	Very high	97.3	Very high	8 Å²	8	57.7 Å²	57.7	5%	0.048	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	106	174.4	-176.2	0	0	0	0	108.4	V119 V134 R138 D301 L302	V119-V136 HydrophobicContact CG2-CG2 3.94Å; V134-V136 HydrophobicContact CG1-CG2 3.85Å; V136-R138 HydrophobicContact CG1-CG 4.02Å; V136-D301 WeakPolarHBondContact O-CA 3.49Å; V136-L302 HydrophobicContact CB-CB 4.19Å; V136-L302 HydrophobicContact CG2-CD2 4.45Å; V136-L302 PolarHBondContact N-O 2.71Å; V136-L302 PolarHBondContact O-N 2.98Å; V136-L302 VanDerWaalsContact O-N 3.1Å
137	Q	97.5	Very high	97.3	Very high	104 Å²	104	51 Å²	51	49%	0.486	25%	0.253	S	S	.	.			trans	-85.2	119.2	172	-169.9	172.5	45.6	0	0	109.8	Y135 K139 D301	Y135-Q137 HydrophobicContact CE1-CB 3.85Å; Y135-Q137 HydrophobicContact CE2-CB 4.2Å; Y135-Q137 WeakPolarHBondContact OH-CB 3.41Å; Y135-Q137 VanDerWaalsContact OH-CG 3.24Å; Y135-Q137 WeakPolarHBondContact OH-CG 3.43Å; Y135-Q137 PolarHBondContact OH-NE2 3.09Å; Q137-K139 HydrophobicContact CG-CG 4.21Å; Q137-D301 WeakPolarHBondContact CA-OD1 3.41Å
138	R	94.9	Very high	97.4	Very high	3 Å²	3	48.2 Å²	48.2	1%	0.011	24%	0.24	C	C	.	.			trans	-103.1	-27.4	-175.5	-67.1	-155.5	178.2	86.3	-3.5	114.9	L115 N117 V136 N140 Y144 G300 D301	L115-R138 PolarHBondContact O-NH2 3.29Å; N117-R138 PolarHBondContact O-NE 2.8Å; N117-R138 PolarHBondContact O-NH2 3.07Å; N117-R138 VanDerWaalsContact O-NH2 3.08Å; V136-R138 HydrophobicContact CG1-CG 4.02Å; R138-N140 HydrophobicContact CB-CB 4.4Å; R138-N140 PolarHBondContact O-N 3.38Å; R138-Y144 VanDerWaalsContact NH1-CZ 3.26Å; R138-Y144 PolarHBondContact NH1-OH 3.45Å; R138-G300 VanDerWaalsContact CD-O 3.3Å; R138-G300 WeakPolarHBondContact CD-O 3.5Å; R138-G300 WeakPolarHBondContact CG-O 3.33Å; R138-G300 PolarHBondContact NH1-O 3.5Å; R138-D301 PolarHBondContact N-OD1 2.73Å
139	K	94.6	Very high	97.4	Very high	105 Å²	105	50.1 Å²	50.1	46%	0.457	25%	0.253	S	S	.	.			trans	51.5	34.3	-171.9	-51.7	-174.3	178.5	-165.8	0	112.5	Q83 Q137	Q83-K139 VanDerWaalsContact CD-NZ 3.31Å; Q137-K139 HydrophobicContact CG-CG 4.21Å
140	N	95.6	Very high	97.4	Very high	32 Å²	32	50.9 Å²	50.9	17%	0.171	26%	0.26	C	S	.	.			trans	-133.2	92.8	177.6	178.8	-2.3	0	0	0	107.9	R138 D142 Y143 G300	R138-N140 HydrophobicContact CB-CB 4.4Å; R138-N140 PolarHBondContact O-N 3.38Å; N140-D142 PolarHBondContact O-N 3.27Å; N140-D142 PolarHBondContact OD1-N 3.02Å; N140-Y143 WeakPolarHBondContact O-CB 3.21Å; N140-Y143 PolarHBondContact O-N 3.19Å; N140-Y143 PolarHBondContact OD1-N 2.89Å; N140-G300 WeakPolarHBondContact O-CA 3.45Å
141	P	96.1	Very high	97.4	Very high	84 Å²	84	51.6 Å²	51.6	55%	0.545	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-23.8	-176.4	26.3	-34.3	0	0	0	113.3	Y143 A299	P141-Y143 VanDerWaalsContact C-N 3.34Å; P141-A299 WeakPolarHBondContact CA-O 3.32Å; P141-A299 HydrophobicContact CB-CB 4.03Å
142	D	96.1	Very high	97.4	Very high	91 Å²	91	47.9 Å²	47.9	49%	0.487	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	0.1	-178.8	-69.9	-47.4	0	0	0	113.3	N140 Y144 K145	N140-D142 PolarHBondContact O-N 3.27Å; N140-D142 PolarHBondContact OD1-N 3.02Å; D142-Y144 VanDerWaalsContact C-N 3.26Å; D142-Y144 PolarHBondContact O-N 3.26Å; D142-K145 HydrophobicContact CB-CB 4.38Å; D142-K145 HydrophobicContact CB-CD 4.37Å; D142-K145 WeakPolarHBondContact O-CB 3.02Å; D142-K145 PolarHBondContact O-N 2.77Å; D142-K145 WeakPolarHBondContact OD1-CD 3.43Å; D142-K145 IonicContact OD1-NZ 2.99Å
143	Y	97.4	Very high	97.5	Very high	2 Å²	2	43.8 Å²	43.8	1%	0.008	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	-42.5	-175.4	-164.2	-83.1	0	0	0	112.8	A88 W114 N117 N140 P141	A88-Y143 HydrophobicContact CB-CD2 3.96Å; A88-Y143 HydrophobicContact CB-CE2 3.22Å; W114-Y143 AromaticContact CD2-CE1 3.89Å; W114-Y143 HydrophobicContact CD2-CE1 3.89Å; W114-Y143 AromaticContact CE2-CE1 3.52Å; W114-Y143 AromaticContact CE2-CZ 3.79Å; W114-Y143 HydrophobicContact CE3-CE1 4.07Å; W114-Y143 AromaticContact CH2-CD1 3.71Å; W114-Y143 HydrophobicContact CH2-CD1 3.71Å; W114-Y143 AromaticContact CH2-CE1 3.56Å; W114-Y143 HydrophobicContact CH2-CE1 3.56Å; W114-Y143 WeakPolarHBondContact CH2-O 3.48Å; W114-Y143 AromaticContact CZ2-CD1 3.62Å; W114-Y143 HydrophobicContact CZ2-CD1 3.62Å; W114-Y143 AromaticContact CZ2-CE1 3.36Å; W114-Y143 HydrophobicContact CZ2-CE1 3.36Å; W114-Y143 HydrophobicContact CZ2-CG 4.45Å; W114-Y143 WeakPolarHBondContact CZ2-O 2.85Å; W114-Y143 HydrophobicContact CZ3-CD1 4.41Å; W114-Y143 AromaticContact CZ3-CE1 3.91Å; W114-Y143 HydrophobicContact CZ3-CE1 3.91Å; W114-Y143 AromaticContact NE1-CZ 3.97Å; W114-Y143 PolarHBondContact O-OH 3.16Å; N117-Y143 WeakPolarHBondContact CB-OH 3.38Å; N140-Y143 WeakPolarHBondContact O-CB 3.21Å; N140-Y143 PolarHBondContact O-N 3.19Å; N140-Y143 PolarHBondContact OD1-N 2.89Å; P141-Y143 VanDerWaalsContact C-N 3.34Å
144	Y	98.1	Very high	97.5	Very high	5 Å²	5	44.7 Å²	44.7	2%	0.02	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.4	11.7	-179.1	-59.2	-60.6	0	0	0	113.6	W114 L115 R138 D142 G146 L147 I255 L257 G300 D301	W114-Y144 AromaticContact CH2-CD1 3.72Å; W114-Y144 HydrophobicContact CH2-CD1 3.72Å; W114-Y144 AromaticContact CH2-CE1 4Å; W114-Y144 HydrophobicContact CH2-CE1 4Å; W114-Y144 HydrophobicContact CZ3-CD1 4.03Å; W114-Y144 AromaticContact CZ3-CE1 3.95Å; W114-Y144 HydrophobicContact CZ3-CE1 3.95Å; L115-Y144 HydrophobicContact CD1-CE1 4.09Å; R138-Y144 VanDerWaalsContact NH1-CZ 3.26Å; R138-Y144 PolarHBondContact NH1-OH 3.45Å; D142-Y144 VanDerWaalsContact C-N 3.26Å; D142-Y144 PolarHBondContact O-N 3.26Å; Y144-G146 PolarHBondContact O-N 2.92Å; Y144-L147 VanDerWaalsContact O-CB 3.25Å; Y144-L147 WeakPolarHBondContact O-CB 3.37Å; Y144-L147 PolarHBondContact O-N 3.44Å; Y144-I255 HydrophobicContact CD1-CG2 3.73Å; Y144-I255 HydrophobicContact CD2-CG2 3.49Å; Y144-I255 VanDerWaalsContact CD2-CG2 3.49Å; Y144-I255 HydrophobicContact CE1-CG2 3.74Å; Y144-I255 HydrophobicContact CE2-CG2 3.5Å; Y144-I255 HydrophobicContact CG-CG2 3.59Å; Y144-L257 HydrophobicContact CG-CD2 4.41Å; Y144-G300 VanDerWaalsContact CD2-CA 3.47Å; Y144-G300 WeakPolarHBondContact CE2-O 3.47Å; Y144-D301 WeakPolarHBondContact CE2-O 3.45Å
145	K	96.5	Very high	97.5	Very high	132 Å²	132	46.7 Å²	46.7	57%	0.574	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	132.4	177.5	-174.6	171.6	-176.8	172.2	0	109.7	D142	D142-K145 HydrophobicContact CB-CB 4.38Å; D142-K145 HydrophobicContact CB-CD 4.37Å; D142-K145 WeakPolarHBondContact O-CB 3.02Å; D142-K145 PolarHBondContact O-N 2.77Å; D142-K145 WeakPolarHBondContact OD1-CD 3.43Å; D142-K145 IonicContact OD1-NZ 2.99Å
146	G	96.4	Very high	97.6	Very high	35 Å²	35	43.8 Å²	43.8	36%	0.361	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	96.9	-20.3	-174.5	0	0	0	0	0	114.4	Y144 T213	Y144-G146 PolarHBondContact O-N 2.92Å; G146-T213 WeakPolarHBondContact O-CG2 3.31Å
147	L	98.6	Very high	97.6	Very high	6 Å²	6	43.5 Å²	43.5	3%	0.031	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-58.8	-178.5	-177.1	51.7	0	0	0	112.2	L91 Y144 T213 V214 V217 I255 L257 I324	L91-L147 HydrophobicContact CD2-CB 3.6Å; L91-L147 HydrophobicContact CD2-CD1 4.05Å; L91-L147 HydrophobicContact CD2-CG 4.32Å; Y144-L147 VanDerWaalsContact O-CB 3.25Å; Y144-L147 WeakPolarHBondContact O-CB 3.37Å; Y144-L147 PolarHBondContact O-N 3.44Å; L147-T213 HydrophobicContact CD1-CG2 4.43Å; L147-V214 HydrophobicContact CD1-CG2 4.23Å; L147-V214 WeakPolarHBondContact O-CG2 3.22Å; L147-V217 HydrophobicContact CD1-CB 4.31Å; L147-V217 HydrophobicContact CD1-CG1 4.47Å; L147-V217 HydrophobicContact CD1-CG2 3.99Å; L147-I255 HydrophobicContact CD2-CD1 4.43Å; L147-I255 HydrophobicContact CD2-CG2 4.15Å; L147-L257 HydrophobicContact CB-CD2 4.29Å; L147-L257 HydrophobicContact CD2-CD2 4.1Å; L147-L257 HydrophobicContact CG-CD2 4.44Å; L147-I324 HydrophobicContact CD2-CG2 3.88Å
148	F	98.8	Very high	97.6	Very high	14 Å²	14	46 Å²	46	6%	0.061	24%	0.243	C	C	.	.			trans	-163.6	154.3	177.3	-159.4	-92	0	0	0	109.2	E152 F153 I156 L204 P207 V214 V233 L257 L322	F148-E152 HydrophobicContact CD2-CG 4.06Å; F148-E152 HydrophobicContact CE2-CG 3.8Å; F148-E152 HydrophobicContact CZ-CG 4.2Å; F148-F153 HydrophobicContact CE1-CB 3.98Å; F148-F153 AromaticContact CE1-CD2 3.87Å; F148-F153 HydrophobicContact CE1-CD2 3.87Å; F148-F153 HydrophobicContact CE1-CG 4.27Å; F148-F153 HydrophobicContact CZ-CB 4.4Å; F148-F153 HydrophobicContact CZ-CD2 4.44Å; F148-I156 HydrophobicContact CE2-CD1 3.7Å; F148-I156 HydrophobicContact CZ-CD1 3.71Å; F148-L204 HydrophobicContact CE2-CD2 4.48Å; F148-L204 HydrophobicContact CZ-CD2 3.92Å; F148-P207 HydrophobicContact CE2-CB 4.29Å; F148-V214 HydrophobicContact CB-CG2 4.25Å; F148-V214 HydrophobicContact CD2-CG2 3.78Å; F148-V214 HydrophobicContact CG-CG2 4.43Å; F148-V233 HydrophobicContact CD1-CG1 3.92Å; F148-V233 HydrophobicContact CD1-CG2 3.96Å; F148-V233 HydrophobicContact CE1-CB 4.36Å; F148-V233 HydrophobicContact CE1-CG1 3.83Å; F148-V233 HydrophobicContact CE1-CG2 4.07Å; F148-V233 HydrophobicContact CG-CG2 4.23Å; F148-V233 HydrophobicContact CZ-CG2 4.4Å; F148-L257 HydrophobicContact CB-CD1 3.84Å; F148-L322 HydrophobicContact CD1-CD2 4.41Å
149	S	98.8	Very high	97.8	Very high	40 Å²	40	53.1 Å²	53.1	28%	0.28	27%	0.274	S	S	.	.			trans	-148.1	165.6	-179.9	64.9	0	0	0	0	111.7	A151 E152 F153 E258	S149-A151 PolarHBondContact O-N 3.26Å; S149-E152 PolarHBondContact O-N 3.48Å; S149-E152 PolarHBondContact OG-N 3.27Å; S149-E152 VanDerWaalsContact OG-N 3.11Å; S149-F153 PolarHBondContact O-N 2.93Å; S149-E258 VanDerWaalsContact CA-OE1 3.27Å; S149-E258 WeakPolarHBondContact CA-OE1 3.43Å; S149-E258 WeakPolarHBondContact CB-OE1 3.16Å
150	T	98.7	Very high	97.9	Very high	34 Å²	34	51.2 Å²	51.2	21%	0.209	27%	0.266	C	S	.	.	H	α-helix	trans	-63.2	-32.1	173	-60.4	0	0	0	0	111	F153 D154 W193 L235 E258	T150-F153 VanDerWaalsContact O-CB 3.3Å; T150-F153 WeakPolarHBondContact O-CB 3.38Å; T150-F153 PolarHBondContact O-N 3.33Å; T150-D154 PolarHBondContact O-N 3.26Å; T150-W193 HydrophobicContact CG2-CH2 4.28Å; T150-L235 HydrophobicContact CG2-CD2 4.04Å; T150-E258 WeakPolarHBondContact CB-OE2 3.31Å; T150-E258 PolarHBondContact N-OE1 3.37Å; T150-E258 VanDerWaalsContact OG1-CD 3.32Å; T150-E258 PolarHBondContact OG1-OE1 2.84Å; T150-E258 PolarHBondContact OG1-OE2 2.79Å
151	A	98.7	Very high	98	Very high	73 Å²	73	54.5 Å²	54.5	60%	0.603	28%	0.284	S	S	*	.	H	α-helix	trans	-64.9	-42.2	173.4	0	0	0	0	0	112.2	S149 F153 D154 R155	S149-A151 PolarHBondContact O-N 3.26Å; A151-F153 VanDerWaalsContact C-N 3.32Å; A151-D154 PolarHBondContact O-N 2.86Å; A151-R155 PolarHBondContact O-N 2.92Å
152	E	98.6	Very high	98.1	Very high	45 Å²	45	50.5 Å²	50.5	21%	0.21	26%	0.258	C	S	.	.	H	α-helix	trans	-65.6	-37.8	173.3	-179.6	63.2	-175.5	0	0	111	F148 S149 R155 I156	F148-E152 HydrophobicContact CD2-CG 4.06Å; F148-E152 HydrophobicContact CE2-CG 3.8Å; F148-E152 HydrophobicContact CZ-CG 4.2Å; S149-E152 PolarHBondContact O-N 3.48Å; S149-E152 PolarHBondContact OG-N 3.27Å; S149-E152 VanDerWaalsContact OG-N 3.11Å; E152-R155 WeakPolarHBondContact O-CB 3.37Å; E152-R155 PolarHBondContact O-N 2.99Å; E152-R155 IonicContact OE1-CZ 3.46Å; E152-R155 IonicContact OE1-NE 2.68Å; E152-R155 PolarHBondContact OE1-NE 3.19Å; E152-R155 IonicContact OE1-NH2 3.78Å; E152-R155 PolarHBondContact OE1-NH2 3.02Å; E152-R155 IonicContact OE2-CZ 3.69Å; E152-R155 IonicContact OE2-NE 3.2Å; E152-R155 PolarHBondContact OE2-NE 3.34Å; E152-R155 IonicContact OE2-NH2 2.96Å; E152-I156 HydrophobicContact CG-CD1 4Å; E152-I156 WeakPolarHBondContact O-CD1 3.47Å; E152-I156 VanDerWaalsContact O-CG1 3.23Å; E152-I156 WeakPolarHBondContact O-CG1 3.07Å; E152-I156 PolarHBondContact O-N 2.78Å
153	F	98.7	Very high	98.3	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-57.2	-52.1	172.8	-153.7	-54	0	0	0	111.3	F148 S149 T150 A151 R155 I156 L157 L168 W193 V202 L204 V233 L235 L322	F148-F153 HydrophobicContact CE1-CB 3.98Å; F148-F153 AromaticContact CE1-CD2 3.87Å; F148-F153 HydrophobicContact CE1-CD2 3.87Å; F148-F153 HydrophobicContact CE1-CG 4.27Å; F148-F153 HydrophobicContact CZ-CB 4.4Å; F148-F153 HydrophobicContact CZ-CD2 4.44Å; S149-F153 PolarHBondContact O-N 2.93Å; T150-F153 VanDerWaalsContact O-CB 3.3Å; T150-F153 WeakPolarHBondContact O-CB 3.38Å; T150-F153 PolarHBondContact O-N 3.33Å; A151-F153 VanDerWaalsContact C-N 3.32Å; F153-R155 VanDerWaalsContact C-N 3.35Å; F153-R155 PolarHBondContact O-N 2.81Å; F153-I156 PolarHBondContact O-N 3.34Å; F153-L157 HydrophobicContact CD1-CD1 3.81Å; F153-L157 HydrophobicContact CD1-CG 3.96Å; F153-L157 HydrophobicContact CE1-CD1 3.93Å; F153-L157 HydrophobicContact CE1-CD2 4.2Å; F153-L157 HydrophobicContact CE1-CG 4.03Å; F153-L157 WeakPolarHBondContact O-CG 3.26Å; F153-L157 PolarHBondContact O-N 2.87Å; F153-L168 HydrophobicContact CE1-CD1 3.82Å; F153-L168 HydrophobicContact CZ-CD1 4.01Å; F153-W193 HydrophobicContact CD1-CH2 4.44Å; F153-V202 HydrophobicContact CE1-CG1 3.89Å; F153-V202 HydrophobicContact CE2-CG1 4.46Å; F153-V202 HydrophobicContact CZ-CB 4.31Å; F153-V202 HydrophobicContact CZ-CG1 3.52Å; F153-L204 HydrophobicContact CE2-CB 3.95Å; F153-L204 HydrophobicContact CZ-CB 3.89Å; F153-V233 HydrophobicContact CD2-CG1 4.06Å; F153-V233 HydrophobicContact CE2-CG1 4.06Å; F153-L235 HydrophobicContact CE2-CB 4.43Å; F153-L322 HydrophobicContact CD2-CD1 4.45Å
154	D	98.8	Very high	98.3	Very high	40 Å²	40	49.3 Å²	49.3	21%	0.214	25%	0.249	C	C	.	.	H	α-helix	trans	-61	-41.9	177.7	-179	72.6	0	0	0	111.9	T150 A151 I156 L157 R158 W193	T150-D154 PolarHBondContact O-N 3.26Å; A151-D154 PolarHBondContact O-N 2.86Å; D154-I156 VanDerWaalsContact C-N 3.3Å; D154-I156 PolarHBondContact O-N 2.9Å; D154-L157 PolarHBondContact O-N 3.37Å; D154-R158 VanDerWaalsContact CG-NE 3.27Å; D154-R158 WeakPolarHBondContact O-CG 3.48Å; D154-R158 PolarHBondContact O-N 3.33Å; D154-R158 VanDerWaalsContact O-N 3.07Å; D154-R158 IonicContact OD1-CZ 2.62Å; D154-R158 IonicContact OD1-NE 2.95Å; D154-R158 PolarHBondContact OD1-NE 3.41Å; D154-R158 VanDerWaalsContact OD1-NE 3.09Å; D154-R158 IonicContact OD1-NH2 3.12Å; D154-R158 PolarHBondContact OD1-NH2 3.5Å; D154-R158 WeakPolarHBondContact OD2-CD 3.48Å; D154-R158 IonicContact OD2-CZ 3.27Å; D154-R158 IonicContact OD2-NE 3.06Å; D154-R158 PolarHBondContact OD2-NE 3.11Å; D154-R158 IonicContact OD2-NH2 3.23Å; D154-W193 HydrophobicContact CB-CZ2 3.79Å; D154-W193 PolarHBondContact OD1-NE1 3.03Å
155	R	98.7	Very high	98.3	Very high	66 Å²	66	51.3 Å²	51.3	25%	0.249	27%	0.271	C	S	.	.	H	α-helix	trans	-55.7	-47.1	174.2	-173.7	-161.6	70.1	75.8	-5.8	110.9	A151 E152 F153 R158 K159 E160 F210	A151-R155 PolarHBondContact O-N 2.92Å; E152-R155 WeakPolarHBondContact O-CB 3.37Å; E152-R155 PolarHBondContact O-N 2.99Å; E152-R155 IonicContact OE1-CZ 3.46Å; E152-R155 IonicContact OE1-NE 2.68Å; E152-R155 PolarHBondContact OE1-NE 3.19Å; E152-R155 IonicContact OE1-NH2 3.78Å; E152-R155 PolarHBondContact OE1-NH2 3.02Å; E152-R155 IonicContact OE2-CZ 3.69Å; E152-R155 IonicContact OE2-NE 3.2Å; E152-R155 PolarHBondContact OE2-NE 3.34Å; E152-R155 IonicContact OE2-NH2 2.96Å; F153-R155 VanDerWaalsContact C-N 3.35Å; F153-R155 PolarHBondContact O-N 2.81Å; R155-R158 PolarHBondContact O-N 3Å; R155-K159 HydrophobicContact CG-CD 3.82Å; R155-K159 HydrophobicContact CG-CG 4.28Å; R155-K159 WeakPolarHBondContact O-CB 3.37Å; R155-K159 WeakPolarHBondContact O-CG 3.17Å; R155-K159 PolarHBondContact O-N 3.14Å; R155-E160 IonicContact NH1-OE1 3.22Å; R155-E160 PolarHBondContact NH1-OE1 3.47Å; R155-F210 PolarHBondContact NH2-O 2.89Å
156	I	98.8	Very high	98.3	Very high	1 Å²	1	49.8 Å²	49.8	1%	0.005	27%	0.272	C	S	.	.	H	α-helix	trans	-61.6	-47.2	-179.3	-71.2	165	0	0	0	110.5	F148 E152 F153 D154 R158 K159 E160 V162 L204 F210	F148-I156 HydrophobicContact CE2-CD1 3.7Å; F148-I156 HydrophobicContact CZ-CD1 3.71Å; E152-I156 HydrophobicContact CG-CD1 4Å; E152-I156 WeakPolarHBondContact O-CD1 3.47Å; E152-I156 VanDerWaalsContact O-CG1 3.23Å; E152-I156 WeakPolarHBondContact O-CG1 3.07Å; E152-I156 PolarHBondContact O-N 2.78Å; F153-I156 PolarHBondContact O-N 3.34Å; D154-I156 VanDerWaalsContact C-N 3.3Å; D154-I156 PolarHBondContact O-N 2.9Å; I156-R158 VanDerWaalsContact C-N 3.25Å; I156-R158 PolarHBondContact O-N 2.76Å; I156-K159 PolarHBondContact O-N 3.28Å; I156-E160 HydrophobicContact CB-CG 4.39Å; I156-E160 HydrophobicContact CG1-CG 4.47Å; I156-E160 HydrophobicContact CG2-CB 4.25Å; I156-E160 HydrophobicContact CG2-CG 4.12Å; I156-E160 WeakPolarHBondContact O-CA 3.27Å; I156-E160 VanDerWaalsContact O-CB 3.27Å; I156-E160 WeakPolarHBondContact O-CB 3.49Å; I156-E160 PolarHBondContact O-N 2.98Å; I156-V162 HydrophobicContact CG2-CG2 3.63Å; I156-L204 HydrophobicContact CD1-CD2 4.49Å; I156-F210 HydrophobicContact CD1-CB 3.66Å; I156-F210 HydrophobicContact CG1-CB 3.83Å; I156-F210 HydrophobicContact CG2-CB 3.93Å; I156-F210 HydrophobicContact CG2-CD1 4.27Å; I156-F210 HydrophobicContact CG2-CD2 4.25Å; I156-F210 HydrophobicContact CG2-CG 3.89Å
157	L	98.6	Very high	98.4	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-59.5	-34.4	177.5	-69	174.6	0	0	0	113.3	F153 D154 V162 L168 A187 A189 V192 W193	F153-L157 HydrophobicContact CD1-CD1 3.81Å; F153-L157 HydrophobicContact CD1-CG 3.96Å; F153-L157 HydrophobicContact CE1-CD1 3.93Å; F153-L157 HydrophobicContact CE1-CD2 4.2Å; F153-L157 HydrophobicContact CE1-CG 4.03Å; F153-L157 WeakPolarHBondContact O-CG 3.26Å; F153-L157 PolarHBondContact O-N 2.87Å; D154-L157 PolarHBondContact O-N 3.37Å; L157-V162 HydrophobicContact CD2-CG1 4.41Å; L157-V162 HydrophobicContact CD2-CG2 4.5Å; L157-L168 HydrophobicContact CD2-CD1 3.65Å; L157-A187 HydrophobicContact CD2-CB 4.44Å; L157-A189 HydrophobicContact CB-CB 3.92Å; L157-V192 HydrophobicContact CD1-CB 4Å; L157-V192 HydrophobicContact CD1-CG1 3.75Å; L157-V192 HydrophobicContact CD1-CG2 4.39Å; L157-V192 HydrophobicContact CD2-CG2 4.04Å; L157-W193 HydrophobicContact CD1-CH2 4.35Å; L157-W193 HydrophobicContact CD1-CZ2 3.77Å
158	R	98.4	Very high	98.4	Very high	157 Å²	157	48.6 Å²	48.6	59%	0.592	26%	0.258	S	S	*	.	H	α-helix	trans	-82.5	-42.8	-178.6	-68.9	179.2	-168.1	-82.5	-10.1	113.2	D154 R155 I156 A189	D154-R158 VanDerWaalsContact CG-NE 3.27Å; D154-R158 WeakPolarHBondContact O-CG 3.48Å; D154-R158 PolarHBondContact O-N 3.33Å; D154-R158 VanDerWaalsContact O-N 3.07Å; D154-R158 IonicContact OD1-CZ 2.62Å; D154-R158 IonicContact OD1-NE 2.95Å; D154-R158 PolarHBondContact OD1-NE 3.41Å; D154-R158 VanDerWaalsContact OD1-NE 3.09Å; D154-R158 IonicContact OD1-NH2 3.12Å; D154-R158 PolarHBondContact OD1-NH2 3.5Å; D154-R158 WeakPolarHBondContact OD2-CD 3.48Å; D154-R158 IonicContact OD2-CZ 3.27Å; D154-R158 IonicContact OD2-NE 3.06Å; D154-R158 PolarHBondContact OD2-NE 3.11Å; D154-R158 IonicContact OD2-NH2 3.23Å; R155-R158 PolarHBondContact O-N 3Å; I156-R158 VanDerWaalsContact C-N 3.25Å; I156-R158 PolarHBondContact O-N 2.76Å; R158-A189 HydrophobicContact CG-CB 3.87Å
159	K	98.3	Very high	98.4	Very high	153 Å²	153	48.6 Å²	48.6	67%	0.665	26%	0.258	S	S	*	.	H	α-helix	trans	-97.7	-28.7	-168.1	-62.5	-168	-179.8	-177.6	0	113.4	R155 I156	R155-K159 HydrophobicContact CG-CD 3.82Å; R155-K159 HydrophobicContact CG-CG 4.28Å; R155-K159 WeakPolarHBondContact O-CB 3.37Å; R155-K159 WeakPolarHBondContact O-CG 3.17Å; R155-K159 PolarHBondContact O-N 3.14Å; I156-K159 PolarHBondContact O-N 3.28Å
160	E	98.2	Very high	98.4	Very high	64 Å²	64	46.7 Å²	46.7	30%	0.299	25%	0.245	S	C	.	.	S	Bend	trans	-100.3	164.7	-175.4	-48.6	-60.6	160.8	0	0	111.7	R155 I156 V162 R186 F210	R155-E160 IonicContact NH1-OE1 3.22Å; R155-E160 PolarHBondContact NH1-OE1 3.47Å; I156-E160 HydrophobicContact CB-CG 4.39Å; I156-E160 HydrophobicContact CG1-CG 4.47Å; I156-E160 HydrophobicContact CG2-CB 4.25Å; I156-E160 HydrophobicContact CG2-CG 4.12Å; I156-E160 WeakPolarHBondContact O-CA 3.27Å; I156-E160 VanDerWaalsContact O-CB 3.27Å; I156-E160 WeakPolarHBondContact O-CB 3.49Å; I156-E160 PolarHBondContact O-N 2.98Å; E160-V162 HydrophobicContact CB-CG2 4.27Å; E160-V162 PolarHBondContact O-N 3.49Å; E160-R186 PolarHBondContact O-NH2 3.42Å; E160-F210 HydrophobicContact CB-CD1 3.8Å; E160-F210 HydrophobicContact CB-CE1 4.03Å; E160-F210 HydrophobicContact CG-CD1 3.84Å
161	N	97.5	Very high	98.4	Very high	101 Å²	101	45 Å²	45	54%	0.54	24%	0.235	S	C	.	.			trans	-90.2	72.5	175.1	-171.5	34.2	0	0	0	111.5	Q163	N161-Q163 PolarHBondContact OD1-NE2 3.27Å
162	V	98.4	Very high	98.4	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.21	C	C	.	.			trans	-80	128.1	178.9	-172.5	0	0	0	0	110.5	I156 L157 E160 N167 L168 R186 A187 L204	I156-V162 HydrophobicContact CG2-CG2 3.63Å; L157-V162 HydrophobicContact CD2-CG1 4.41Å; L157-V162 HydrophobicContact CD2-CG2 4.5Å; E160-V162 HydrophobicContact CB-CG2 4.27Å; E160-V162 PolarHBondContact O-N 3.49Å; V162-N167 HydrophobicContact CG1-CB 3.76Å; V162-L168 HydrophobicContact CG1-CB 3.72Å; V162-L168 HydrophobicContact CG1-CD1 4.1Å; V162-R186 CarbonylContact O-C 3.58Å; V162-R186 WeakPolarHBondContact O-CA 3.31Å; V162-R186 WeakPolarHBondContact O-CG 3.38Å; V162-A187 HydrophobicContact CB-CB 4.28Å; V162-A187 HydrophobicContact CG1-CB 4.01Å; V162-A187 PolarHBondContact O-N 3.31Å; V162-L204 HydrophobicContact CG1-CD1 4.5Å
163	Q	98.5	Very high	98.4	Very high	50 Å²	50	41 Å²	41	23%	0.234	20%	0.204	C	C	.	.	B	Isolated β-bridge	trans	-111.9	138.3	179.5	-60.3	-63	-50.5	0	0	111.7	N161 V166 N167 L168 G185	N161-Q163 PolarHBondContact OD1-NE2 3.27Å; Q163-V166 HydrophobicContact CB-CB 4.02Å; Q163-V166 HydrophobicContact CB-CG2 4.18Å; Q163-V166 PolarHBondContact O-N 2.84Å; Q163-N167 PolarHBondContact N-OD1 3.4Å; Q163-N167 PolarHBondContact O-N 3.07Å; Q163-L168 PolarHBondContact O-N 2.9Å; Q163-L168 VanDerWaalsContact O-N 3.13Å; Q163-G185 PolarHBondContact OE1-O 2.86Å
164	Y	98.6	Very high	98.3	Very high	19 Å²	19	45.2 Å²	45.2	8%	0.075	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-63.3	139.9	172.3	-71.8	-67.1	0	0	0	111	V166 L168 I170 P183 G185 A187 V192	Y164-V166 PolarHBondContact O-N 3.05Å; Y164-L168 CarbonylContact C-O 3.59Å; Y164-L168 VanDerWaalsContact CA-O 3.29Å; Y164-L168 WeakPolarHBondContact CA-O 3.49Å; Y164-L168 HydrophobicContact CD1-CD2 3.67Å; Y164-L168 HydrophobicContact CE1-CD2 3.51Å; Y164-I170 HydrophobicContact CD1-CG1 4.32Å; Y164-I170 HydrophobicContact CE1-CD1 4.26Å; Y164-I170 HydrophobicContact CE1-CG1 3.69Å; Y164-P183 WeakPolarHBondContact CB-O 3.18Å; Y164-P183 HydrophobicContact CD2-CB 4.13Å; Y164-P183 HydrophobicContact CD2-CG 4.19Å; Y164-P183 WeakPolarHBondContact CD2-O 3.25Å; Y164-P183 HydrophobicContact CE2-CB 4.05Å; Y164-P183 HydrophobicContact CE2-CG 3.76Å; Y164-G185 WeakPolarHBondContact CD2-O 3.46Å; Y164-G185 PolarHBondContact N-O 3.36Å; Y164-A187 HydrophobicContact CD1-CB 3.98Å; Y164-A187 HydrophobicContact CD2-CB 4.06Å; Y164-A187 HydrophobicContact CE1-CB 3.74Å; Y164-A187 VanDerWaalsContact CE2-CA 3.48Å; Y164-A187 HydrophobicContact CE2-CB 3.83Å; Y164-A187 HydrophobicContact CG-CB 4.13Å; Y164-V192 HydrophobicContact CE1-CG2 4.22Å; Y164-V192 WeakPolarHBondContact OH-CG2 3.16Å
165	G	97	Very high	98.1	Very high	46 Å²	46	51.3 Å²	51.3	47%	0.474	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.6	-14.5	-179.3	0	0	0	0	0	115.6	L168 N182	G165-L168 PolarHBondContact N-O 2.97Å; G165-N182 PolarHBondContact N-ND2 3.39Å
166	V	97.4	Very high	97.9	Very high	101 Å²	101	49.9 Å²	49.9	61%	0.612	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.3	-48.8	173.8	-178.1	0	0	0	0	110.6	Q163 Y164	Q163-V166 HydrophobicContact CB-CB 4.02Å; Q163-V166 HydrophobicContact CB-CG2 4.18Å; Q163-V166 PolarHBondContact O-N 2.84Å; Y164-V166 PolarHBondContact O-N 3.05Å
167	N	98.5	Very high	97.8	Very high	15 Å²	15	56 Å²	56	8%	0.08	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.2	-30.5	-178	-52.8	117.7	0	0	0	112	V162 Q163 L204 L205 N206 F210	V162-N167 HydrophobicContact CG1-CB 3.76Å; Q163-N167 PolarHBondContact N-OD1 3.4Å; Q163-N167 PolarHBondContact O-N 3.07Å; N167-L204 CarbonylContact O-C 3.58Å; N167-L204 WeakPolarHBondContact O-CA 3.43Å; N167-L204 WeakPolarHBondContact O-CD1 3.46Å; N167-L205 WeakPolarHBondContact O-CB 3.47Å; N167-L205 PolarHBondContact O-N 2.65Å; N167-N206 PolarHBondContact ND2-ND2 3.08Å; N167-N206 PolarHBondContact ND2-OD1 3.15Å; N167-F210 HydrophobicContact CB-CE2 4.15Å; N167-F210 HydrophobicContact CB-CZ 4.23Å
168	L	98.8	Very high	97.7	Very high	0 Å²	0	59.2 Å²	59.2	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	137.3	-169.9	-173.1	148.7	0	0	0	112.2	F153 L157 V162 Q163 Y164 G165 I170 A187 V192 V202 R203	F153-L168 HydrophobicContact CE1-CD1 3.82Å; F153-L168 HydrophobicContact CZ-CD1 4.01Å; L157-L168 HydrophobicContact CD2-CD1 3.65Å; V162-L168 HydrophobicContact CG1-CB 3.72Å; V162-L168 HydrophobicContact CG1-CD1 4.1Å; Q163-L168 PolarHBondContact O-N 2.9Å; Q163-L168 VanDerWaalsContact O-N 3.13Å; Y164-L168 CarbonylContact C-O 3.59Å; Y164-L168 VanDerWaalsContact CA-O 3.29Å; Y164-L168 WeakPolarHBondContact CA-O 3.49Å; Y164-L168 HydrophobicContact CD1-CD2 3.67Å; Y164-L168 HydrophobicContact CE1-CD2 3.51Å; G165-L168 PolarHBondContact N-O 2.97Å; L168-I170 HydrophobicContact CD2-CD1 3.69Å; L168-I170 HydrophobicContact CD2-CG1 4.08Å; L168-A187 HydrophobicContact CB-CB 4.44Å; L168-A187 HydrophobicContact CD1-CB 4.4Å; L168-A187 HydrophobicContact CD2-CB 4.21Å; L168-V192 HydrophobicContact CD2-CG2 4.33Å; L168-V202 HydrophobicContact CD1-CG1 3.69Å; L168-V202 HydrophobicContact CD2-CG1 3.97Å; L168-V202 HydrophobicContact CG-CG1 3.91Å; L168-R203 CarbonylContact C-O 3.53Å; L168-R203 VanDerWaalsContact CA-O 3.25Å; L168-R203 WeakPolarHBondContact CA-O 3.3Å
169	D	98.8	Very high	97.7	Very high	14 Å²	14	55.2 Å²	55.2	8%	0.075	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	144.8	171.4	-64.2	-51.2	0	0	0	111.8	T171 N182 R203	D169-T171 HydrophobicContact CB-CG2 4.24Å; D169-N182 VanDerWaalsContact CA-OD1 3.31Å; D169-N182 WeakPolarHBondContact CA-OD1 3.17Å; D169-N182 PolarHBondContact OD1-ND2 3.11Å; D169-R203 HydrophobicContact CB-CB 4.36Å; D169-R203 PolarHBondContact N-O 3.33Å; D169-R203 PolarHBondContact O-N 3.16Å; D169-R203 IonicContact OD2-CZ 3.98Å; D169-R203 IonicContact OD2-NE 3.65Å; D169-R203 PolarHBondContact OD2-NE 2.79Å; D169-R203 IonicContact OD2-NH2 2.65Å; D169-R203 PolarHBondContact OD2-NH2 3.48Å
170	I	98.8	Very high	97.7	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	124.4	168.7	-54.9	-62.7	0	0	0	108	Y164 L168 T180 H181 N182 V192 F195 C200 S201 V202	Y164-I170 HydrophobicContact CD1-CG1 4.32Å; Y164-I170 HydrophobicContact CE1-CD1 4.26Å; Y164-I170 HydrophobicContact CE1-CG1 3.69Å; L168-I170 HydrophobicContact CD2-CD1 3.69Å; L168-I170 HydrophobicContact CD2-CG1 4.08Å; I170-T180 WeakPolarHBondContact O-CA 3.5Å; I170-H181 HydrophobicContact CB-CB 4.19Å; I170-H181 HydrophobicContact CG2-CB 3.87Å; I170-H181 PolarHBondContact O-N 2.69Å; I170-N182 PolarHBondContact N-OD1 3.45Å; I170-V192 HydrophobicContact CD1-CG1 4.26Å; I170-F195 HydrophobicContact CD1-CB 4.29Å; I170-F195 HydrophobicContact CD1-CD2 4.43Å; I170-F195 HydrophobicContact CG1-CD2 4.04Å; I170-F195 HydrophobicContact CG1-CG 4.35Å; I170-F195 HydrophobicContact CG2-CB 3.77Å; I170-F195 HydrophobicContact CG2-CD1 3.93Å; I170-F195 HydrophobicContact CG2-CD2 4.26Å; I170-F195 HydrophobicContact CG2-CG 3.75Å; I170-C200 HydrophobicContact CG2-CB 3.44Å; I170-C200 VanDerWaalsContact CG2-CB 3.44Å; I170-S201 WeakPolarHBondContact CA-O 3.29Å; I170-V202 HydrophobicContact CD1-CB 4.3Å; I170-V202 HydrophobicContact CD1-CG1 3.97Å; I170-V202 HydrophobicContact CD1-CG2 3.89Å
171	T	98.5	Very high	97.7	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	152.4	-176.4	73.7	0	0	0	0	112.8	D169 E179 C200 S201 G242 F243	D169-T171 HydrophobicContact CB-CG2 4.24Å; T171-E179 VanDerWaalsContact CA-O 3.27Å; T171-E179 WeakPolarHBondContact CA-O 3.5Å; T171-E179 WeakPolarHBondContact CB-O 3.41Å; T171-C200 CarbonylContact O-C 3.57Å; T171-C200 WeakPolarHBondContact O-CA 3.43Å; T171-S201 PolarHBondContact N-O 3.25Å; T171-S201 PolarHBondContact O-N 3.04Å; T171-G242 WeakPolarHBondContact CB-O 3.32Å; T171-G242 PolarHBondContact OG1-O 2.97Å; T171-F243 HydrophobicContact CG2-CE1 3.94Å; T171-F243 HydrophobicContact CG2-CZ 3.86Å; T171-F243 WeakPolarHBondContact OG1-CE2 3.46Å; T171-F243 VanDerWaalsContact OG1-CZ 3.29Å; T171-F243 WeakPolarHBondContact OG1-CZ 3.25Å
172	S	98.4	Very high	97.7	Very high	12 Å²	12	47.9 Å²	47.9	8%	0.084	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	154.8	168.9	68	0	0	0	0	110.6	R178 E179 H181 G242	S172-R178 CarbonylContact O-C 3.56Å; S172-R178 WeakPolarHBondContact O-CA 3.27Å; S172-E179 PolarHBondContact N-O 2.92Å; S172-E179 VanDerWaalsContact N-O 3.14Å; S172-E179 PolarHBondContact O-N 2.94Å; S172-H181 PolarHBondContact OG-NE2 3.29Å; S172-G242 CarbonylContact C-O 3.55Å
173	Y	98.4	Very high	97.7	Very high	21 Å²	21	49.8 Å²	49.8	8%	0.082	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	105.4	170	-179.8	-106.6	0	0	0	109.6	G176 K177 R178 Q241 A244	Y173-G176 VanDerWaalsContact CE2-O 3.27Å; Y173-G176 WeakPolarHBondContact CE2-O 3.35Å; Y173-G176 WeakPolarHBondContact OH-CA 3.36Å; Y173-K177 WeakPolarHBondContact CA-O 3.3Å; Y173-R178 HydrophobicContact CD2-CB 3.96Å; Y173-Q241 WeakPolarHBondContact CB-O 3.41Å; Y173-Q241 HydrophobicContact CD1-CB 4.15Å; Y173-Q241 HydrophobicContact CD1-CG 3.72Å; Y173-Q241 HydrophobicContact CG-CG 4.27Å; Y173-Q241 PolarHBondContact N-O 3.31Å; Y173-A244 HydrophobicContact CD2-CB 3.68Å; Y173-A244 HydrophobicContact CE2-CB 3.46Å; Y173-A244 VanDerWaalsContact CE2-CB 3.46Å
174	V	96.6	Very high	97.6	Very high	88 Å²	88	53.6 Å²	53.6	53%	0.533	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	135	-175.3	-177	0	0	0	0	108.5	G176 K177	V174-G176 PolarHBondContact O-N 3.33Å; V174-K177 PolarHBondContact N-O 3.47Å; V174-K177 PolarHBondContact O-N 3.39Å
175	N	94.9	Very high	97.5	Very high	168 Å²	168	54.5 Å²	54.5	90%	0.898	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.4	40.7	177.6	-59.6	-31	0	0	0	113.9	K177	N175-K177 VanDerWaalsContact C-N 3.28Å; N175-K177 PolarHBondContact O-N 2.92Å
176	G	94.4	Very high	97.6	Very high	37 Å²	37	57.3 Å²	57.3	38%	0.381	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.1	-1.4	179.2	0	0	0	0	0	115.1	Y173 V174	Y173-G176 VanDerWaalsContact CE2-O 3.27Å; Y173-G176 WeakPolarHBondContact CE2-O 3.35Å; Y173-G176 WeakPolarHBondContact OH-CA 3.36Å; V174-G176 PolarHBondContact O-N 3.33Å
177	K	96.5	Very high	97.6	Very high	128 Å²	128	52.5 Å²	52.5	56%	0.557	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.2	127.4	-176.1	-169.1	-174.2	179.6	-159.6	0	111.6	Y173 V174 N175 E179	Y173-K177 WeakPolarHBondContact CA-O 3.3Å; V174-K177 PolarHBondContact N-O 3.47Å; V174-K177 PolarHBondContact O-N 3.39Å; N175-K177 VanDerWaalsContact C-N 3.28Å; N175-K177 PolarHBondContact O-N 2.92Å; K177-E179 HydrophobicContact CD-CG 4.27Å; K177-E179 VanDerWaalsContact CE-OE1 3.24Å; K177-E179 WeakPolarHBondContact CE-OE1 3.27Å; K177-E179 HydrophobicContact CG-CG 4.29Å; K177-E179 IonicContact NZ-OE1 2.91Å; K177-E179 PolarHBondContact NZ-OE1 3.33Å
178	R	97.5	Very high	97.6	Very high	70 Å²	70	55.6 Å²	55.6	26%	0.264	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	131.6	172.9	-177.9	-89.2	-177.1	-156.4	-4.7	110.4	S172 Y173 T180 A244	S172-R178 CarbonylContact O-C 3.56Å; S172-R178 WeakPolarHBondContact O-CA 3.27Å; Y173-R178 HydrophobicContact CD2-CB 3.96Å; R178-T180 PolarHBondContact NH1-OG1 3.27Å; R178-T180 PolarHBondContact NH2-OG1 2.91Å; R178-A244 HydrophobicContact CB-CB 3.99Å
179	E	98.1	Very high	97.6	Very high	73 Å²	73	55.9 Å²	55.9	34%	0.341	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	149.3	178.9	-63.1	-173	152.4	0	0	111.6	T171 S172 K177 H181	T171-E179 VanDerWaalsContact CA-O 3.27Å; T171-E179 WeakPolarHBondContact CA-O 3.5Å; T171-E179 WeakPolarHBondContact CB-O 3.41Å; S172-E179 PolarHBondContact N-O 2.92Å; S172-E179 VanDerWaalsContact N-O 3.14Å; S172-E179 PolarHBondContact O-N 2.94Å; K177-E179 HydrophobicContact CD-CG 4.27Å; K177-E179 VanDerWaalsContact CE-OE1 3.24Å; K177-E179 WeakPolarHBondContact CE-OE1 3.27Å; K177-E179 HydrophobicContact CG-CG 4.29Å; K177-E179 IonicContact NZ-OE1 2.91Å; K177-E179 PolarHBondContact NZ-OE1 3.33Å; E179-H181 IonicContact OE2-CE1 3.58Å; E179-H181 PolarHBondContact OE2-CE1 3.19Å
180	T	98.2	Very high	97.6	Very high	63 Å²	63	63.7 Å²	63.7	39%	0.387	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	132.8	167.5	-75.2	0	0	0	0	107.7	I170 R178 N182	I170-T180 WeakPolarHBondContact O-CA 3.5Å; R178-T180 PolarHBondContact NH1-OG1 3.27Å; R178-T180 PolarHBondContact NH2-OG1 2.91Å; T180-N182 HydrophobicContact CG2-CB 3.77Å; T180-N182 WeakPolarHBondContact CG2-OD1 3.48Å
181	H	98.3	Very high	97.6	Very high	55 Å²	55	66.1 Å²	66.1	26%	0.255	36%	0.356	S	S	.	.			trans	-113.1	15.6	-177	-55.6	-68.3	0	0	0	113.6	I170 S172 E179 P183 F195	I170-H181 HydrophobicContact CB-CB 4.19Å; I170-H181 HydrophobicContact CG2-CB 3.87Å; I170-H181 PolarHBondContact O-N 2.69Å; S172-H181 PolarHBondContact OG-NE2 3.29Å; E179-H181 IonicContact OE2-CE1 3.58Å; E179-H181 PolarHBondContact OE2-CE1 3.19Å; H181-P183 WeakPolarHBondContact O-CD 3.38Å; H181-P183 VanDerWaalsContact O-N 3.15Å; H181-F195 HydrophobicContact CB-CD1 4.34Å; H181-F195 HydrophobicContact CB-CE1 3.86Å; H181-F195 HydrophobicContact CB-CZ 4.33Å
182	N	98.2	Very high	97.6	Very high	46 Å²	46	66.1 Å²	66.1	25%	0.246	36%	0.356	C	S	.	.			trans	-55.7	115	-176.6	-68.5	3.7	0	0	0	112.2	G165 D169 I170 T180	G165-N182 PolarHBondContact N-ND2 3.39Å; D169-N182 VanDerWaalsContact CA-OD1 3.31Å; D169-N182 WeakPolarHBondContact CA-OD1 3.17Å; D169-N182 PolarHBondContact OD1-ND2 3.11Å; I170-N182 PolarHBondContact N-OD1 3.45Å; T180-N182 HydrophobicContact CG2-CB 3.77Å; T180-N182 WeakPolarHBondContact CG2-OD1 3.48Å
183	P	97.2	Very high	97.6	Very high	39 Å²	39	68.1 Å²	68.1	25%	0.253	36%	0.362	S	S	.	.			trans	-67	160.8	162.3	-15.1	31.4	0	0	0	110.6	Y164 H181 F195	Y164-P183 WeakPolarHBondContact CB-O 3.18Å; Y164-P183 HydrophobicContact CD2-CB 4.13Å; Y164-P183 HydrophobicContact CD2-CG 4.19Å; Y164-P183 WeakPolarHBondContact CD2-O 3.25Å; Y164-P183 HydrophobicContact CE2-CB 4.05Å; Y164-P183 HydrophobicContact CE2-CG 3.76Å; H181-P183 WeakPolarHBondContact O-CD 3.38Å; H181-P183 VanDerWaalsContact O-N 3.15Å; P183-F195 HydrophobicContact CG-CE2 3.72Å; P183-F195 HydrophobicContact CG-CZ 4.01Å
184	P	96.8	Very high	97.6	Very high	131 Å²	131	71.9 Å²	71.9	85%	0.851	38%	0.384	S	S	*	.	S	Bend	trans	-69.7	145.4	167.7	29.9	-33.8	0	0	0	111.3
185	G	97.2	Very high	97.7	Very high	38 Å²	38	69.8 Å²	69.8	39%	0.392	37%	0.367	S	S	.	.	S	Bend	trans	88.8	-148.6	169.3	0	0	0	0	0	115.4	Q163 Y164	Q163-G185 PolarHBondContact OE1-O 2.86Å; Y164-G185 WeakPolarHBondContact CD2-O 3.46Å; Y164-G185 PolarHBondContact N-O 3.36Å
186	R	98.1	Very high	97.9	Very high	104 Å²	104	63.1 Å²	63.1	39%	0.392	33%	0.33	S	S	.	.	B	Isolated β-bridge	trans	-73.3	132.8	-169.5	-170	176.8	177.8	-168	0.6	112.1	E160 V162 L188	E160-R186 PolarHBondContact O-NH2 3.42Å; V162-R186 CarbonylContact O-C 3.58Å; V162-R186 WeakPolarHBondContact O-CA 3.31Å; V162-R186 WeakPolarHBondContact O-CG 3.38Å; R186-L188 HydrophobicContact CG-CD2 4.15Å; R186-L188 HydrophobicContact CG-CG 4.37Å; R186-L188 PolarHBondContact O-N 3.45Å
187	A	98.5	Very high	98.1	Very high	0 Å²	0	68.9 Å²	68.9	0%	0	35%	0.347	C	S	.	.			trans	-83.4	95.3	171.2	0	0	0	0	0	110.3	L157 V162 Y164 L168 V192	L157-A187 HydrophobicContact CD2-CB 4.44Å; V162-A187 HydrophobicContact CB-CB 4.28Å; V162-A187 HydrophobicContact CG1-CB 4.01Å; V162-A187 PolarHBondContact O-N 3.31Å; Y164-A187 HydrophobicContact CD1-CB 3.98Å; Y164-A187 HydrophobicContact CD2-CB 4.06Å; Y164-A187 HydrophobicContact CE1-CB 3.74Å; Y164-A187 VanDerWaalsContact CE2-CA 3.48Å; Y164-A187 HydrophobicContact CE2-CB 3.83Å; Y164-A187 HydrophobicContact CG-CB 4.13Å; L168-A187 HydrophobicContact CB-CB 4.44Å; L168-A187 HydrophobicContact CD1-CB 4.4Å; L168-A187 HydrophobicContact CD2-CB 4.21Å; A187-V192 HydrophobicContact CB-CG2 3.97Å
188	L	98.4	Very high	98.1	Very high	80 Å²	80	66.9 Å²	66.9	42%	0.419	35%	0.349	S	S	.	.			trans	-88.7	142.9	175.9	-66.3	173	0	0	0	110.9	R186 F190 T191 V192	R186-L188 HydrophobicContact CG-CD2 4.15Å; R186-L188 HydrophobicContact CG-CG 4.37Å; R186-L188 PolarHBondContact O-N 3.45Å; L188-F190 PolarHBondContact O-N 3.19Å; L188-F190 VanDerWaalsContact O-N 3.15Å; L188-T191 PolarHBondContact O-N 3.36Å; L188-T191 VanDerWaalsContact O-N 3.08Å; L188-V192 WeakPolarHBondContact O-CG2 3.39Å; L188-V192 PolarHBondContact O-N 2.87Å
189	A	98.5	Very high	98.2	Very high	6 Å²	6	64.5 Å²	64.5	5%	0.05	35%	0.346	C	S	.	.	H	α-helix	trans	-49.1	-43.7	180	0	0	0	0	0	113.1	L157 R158 T191 V192 W193	L157-A189 HydrophobicContact CB-CB 3.92Å; R158-A189 HydrophobicContact CG-CB 3.87Å; A189-T191 PolarHBondContact O-N 3.34Å; A189-V192 PolarHBondContact O-N 3.39Å; A189-W193 WeakPolarHBondContact O-CB 3.32Å; A189-W193 VanDerWaalsContact O-CG 3.25Å; A189-W193 PolarHBondContact O-N 2.93Å
190	F	98	Very high	98.2	Very high	179 Å²	179	61.5 Å²	61.5	79%	0.785	33%	0.333	S	S	*	.	H	α-helix	trans	-52.9	-49.9	178.7	179	-96.4	0	0	0	112.8	L188 D194	L188-F190 PolarHBondContact O-N 3.19Å; L188-F190 VanDerWaalsContact O-N 3.15Å; F190-D194 PolarHBondContact O-N 3.14Å
191	T	98.3	Very high	98.2	Very high	51 Å²	51	58.6 Å²	58.6	31%	0.313	32%	0.315	S	S	.	.	H	α-helix	trans	-77.5	-37.4	-177.9	-50.2	0	0	0	0	112.2	L188 A189 W193 D194 F195	L188-T191 PolarHBondContact O-N 3.36Å; L188-T191 VanDerWaalsContact O-N 3.08Å; A189-T191 PolarHBondContact O-N 3.34Å; T191-W193 VanDerWaalsContact C-N 3.34Å; T191-W193 PolarHBondContact O-N 3.37Å; T191-D194 PolarHBondContact O-N 3.03Å; T191-F195 HydrophobicContact CG2-CD2 4.11Å; T191-F195 HydrophobicContact CG2-CE2 3.81Å; T191-F195 VanDerWaalsContact O-CD2 3.26Å; T191-F195 WeakPolarHBondContact O-CD2 3.48Å; T191-F195 PolarHBondContact O-N 2.85Å; T191-F195 VanDerWaalsContact O-N 3.15Å
192	V	98.8	Very high	98.3	Very high	0 Å²	0	56 Å²	56	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-64	-41.5	178.8	172.8	0	0	0	0	111	L157 Y164 L168 I170 A187 L188 A189 F195 Y196 V202	L157-V192 HydrophobicContact CD1-CB 4Å; L157-V192 HydrophobicContact CD1-CG1 3.75Å; L157-V192 HydrophobicContact CD1-CG2 4.39Å; L157-V192 HydrophobicContact CD2-CG2 4.04Å; Y164-V192 HydrophobicContact CE1-CG2 4.22Å; Y164-V192 WeakPolarHBondContact OH-CG2 3.16Å; L168-V192 HydrophobicContact CD2-CG2 4.33Å; I170-V192 HydrophobicContact CD1-CG1 4.26Å; A187-V192 HydrophobicContact CB-CG2 3.97Å; L188-V192 WeakPolarHBondContact O-CG2 3.39Å; L188-V192 PolarHBondContact O-N 2.87Å; A189-V192 PolarHBondContact O-N 3.39Å; V192-F195 PolarHBondContact O-N 3.27Å; V192-Y196 PolarHBondContact O-N 2.85Å; V192-V202 HydrophobicContact CG1-CG1 3.77Å; V192-V202 HydrophobicContact CG1-CG2 3.93Å
193	W	98.7	Very high	98.3	Very high	53 Å²	53	56.3 Å²	56.3	20%	0.201	30%	0.301	C	S	.	.	H	α-helix	trans	-70.3	-32.9	178.4	-63	135.5	0	0	0	112.9	T150 F153 D154 L157 A189 T191 Y196 E197 L235	T150-W193 HydrophobicContact CG2-CH2 4.28Å; F153-W193 HydrophobicContact CD1-CH2 4.44Å; D154-W193 HydrophobicContact CB-CZ2 3.79Å; D154-W193 PolarHBondContact OD1-NE1 3.03Å; L157-W193 HydrophobicContact CD1-CH2 4.35Å; L157-W193 HydrophobicContact CD1-CZ2 3.77Å; A189-W193 WeakPolarHBondContact O-CB 3.32Å; A189-W193 VanDerWaalsContact O-CG 3.25Å; A189-W193 PolarHBondContact O-N 2.93Å; T191-W193 VanDerWaalsContact C-N 3.34Å; T191-W193 PolarHBondContact O-N 3.37Å; W193-Y196 HydrophobicContact CE3-CD1 4.49Å; W193-Y196 HydrophobicContact CE3-CG 4.24Å; W193-Y196 HydrophobicContact CZ3-CG 4.43Å; W193-Y196 WeakPolarHBondContact O-CB 3.47Å; W193-Y196 PolarHBondContact O-N 3.26Å; W193-E197 WeakPolarHBondContact O-CG 3.47Å; W193-E197 PolarHBondContact O-N 3.48Å; W193-L235 HydrophobicContact CH2-CD2 3.72Å; W193-L235 HydrophobicContact CZ3-CD2 3.55Å
194	D	98.6	Very high	98.4	Very high	101 Å²	101	54.5 Å²	54.5	54%	0.54	29%	0.289	S	S	.	.	H	α-helix	trans	-61.8	-42.2	171.6	-173.2	60.4	0	0	0	112.2	F190 T191 Y196 E197 S198	F190-D194 PolarHBondContact O-N 3.14Å; T191-D194 PolarHBondContact O-N 3.03Å; D194-Y196 PolarHBondContact O-N 2.98Å; D194-E197 PolarHBondContact O-N 3.2Å; D194-S198 WeakPolarHBondContact O-CB 3.49Å; D194-S198 PolarHBondContact O-N 2.85Å; D194-S198 PolarHBondContact O-OG 3.45Å
195	F	98.7	Very high	98.4	Very high	43 Å²	43	50.2 Å²	50.2	19%	0.189	26%	0.259	C	S	.	.	H	α-helix	trans	-62.9	-41.1	172.2	-81.1	-61.5	0	0	0	112.8	I170 H181 P183 T191 V192 S198 G199 C200	I170-F195 HydrophobicContact CD1-CB 4.29Å; I170-F195 HydrophobicContact CD1-CD2 4.43Å; I170-F195 HydrophobicContact CG1-CD2 4.04Å; I170-F195 HydrophobicContact CG1-CG 4.35Å; I170-F195 HydrophobicContact CG2-CB 3.77Å; I170-F195 HydrophobicContact CG2-CD1 3.93Å; I170-F195 HydrophobicContact CG2-CD2 4.26Å; I170-F195 HydrophobicContact CG2-CG 3.75Å; H181-F195 HydrophobicContact CB-CD1 4.34Å; H181-F195 HydrophobicContact CB-CE1 3.86Å; H181-F195 HydrophobicContact CB-CZ 4.33Å; P183-F195 HydrophobicContact CG-CE2 3.72Å; P183-F195 HydrophobicContact CG-CZ 4.01Å; T191-F195 HydrophobicContact CG2-CD2 4.11Å; T191-F195 HydrophobicContact CG2-CE2 3.81Å; T191-F195 VanDerWaalsContact O-CD2 3.26Å; T191-F195 WeakPolarHBondContact O-CD2 3.48Å; T191-F195 PolarHBondContact O-N 2.85Å; T191-F195 VanDerWaalsContact O-N 3.15Å; V192-F195 PolarHBondContact O-N 3.27Å; F195-S198 CarbonylContact O-C 3.6Å; F195-S198 WeakPolarHBondContact O-CB 3.24Å; F195-S198 PolarHBondContact O-N 2.98Å; F195-G199 PolarHBondContact O-N 2.95Å; F195-C200 HydrophobicContact CB-CB 4.22Å; F195-C200 VanDerWaalsContact O-CB 3.23Å; F195-C200 WeakPolarHBondContact O-CB 3.3Å; F195-C200 PolarHBondContact O-N 3.05Å
196	Y	98.8	Very high	98.5	Very high	29 Å²	29	49.4 Å²	49.4	11%	0.114	25%	0.245	C	C	.	.	H	α-helix	trans	-62.3	-48.2	178	178.5	-92.5	0	0	0	111.6	V192 W193 D194 S198 G199 V202 L235 P237 H320	V192-Y196 PolarHBondContact O-N 2.85Å; W193-Y196 HydrophobicContact CE3-CD1 4.49Å; W193-Y196 HydrophobicContact CE3-CG 4.24Å; W193-Y196 HydrophobicContact CZ3-CG 4.43Å; W193-Y196 WeakPolarHBondContact O-CB 3.47Å; W193-Y196 PolarHBondContact O-N 3.26Å; D194-Y196 PolarHBondContact O-N 2.98Å; Y196-S198 PolarHBondContact O-N 2.77Å; Y196-G199 PolarHBondContact O-N 3.07Å; Y196-V202 HydrophobicContact CD2-CG2 4.31Å; Y196-L235 HydrophobicContact CD2-CD2 4.42Å; Y196-L235 HydrophobicContact CD2-CG 4.1Å; Y196-L235 HydrophobicContact CE2-CD1 3.93Å; Y196-L235 HydrophobicContact CE2-CD2 4.22Å; Y196-L235 HydrophobicContact CE2-CG 3.63Å; Y196-P237 HydrophobicContact CD1-CB 4.46Å; Y196-P237 HydrophobicContact CD2-CB 4.18Å; Y196-P237 HydrophobicContact CD2-CG 4.21Å; Y196-P237 HydrophobicContact CE1-CB 4.06Å; Y196-P237 HydrophobicContact CE2-CB 3.75Å; Y196-P237 HydrophobicContact CE2-CG 4.12Å; Y196-P237 WeakPolarHBondContact O-CG 3.5Å; Y196-P237 WeakPolarHBondContact OH-CA 3.23Å; Y196-H320 WeakPolarHBondContact OH-CB 3.46Å
197	E	98.3	Very high	98.5	Very high	158 Å²	158	44.4 Å²	44.4	74%	0.738	23%	0.227	S	C	*	.	H	α-helix	trans	-61.6	-30	174.6	-71.5	-61.9	137.6	0	0	112	W193 D194 G199	W193-E197 WeakPolarHBondContact O-CG 3.47Å; W193-E197 PolarHBondContact O-N 3.48Å; D194-E197 PolarHBondContact O-N 3.2Å; E197-G199 PolarHBondContact O-N 3.22Å
198	S	98.1	Very high	98.5	Very high	85 Å²	85	44.8 Å²	44.8	59%	0.594	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77	8.8	173.1	-59.5	0	0	0	0	114.1	D194 F195 Y196	D194-S198 WeakPolarHBondContact O-CB 3.49Å; D194-S198 PolarHBondContact O-N 2.85Å; D194-S198 PolarHBondContact O-OG 3.45Å; F195-S198 CarbonylContact O-C 3.6Å; F195-S198 WeakPolarHBondContact O-CB 3.24Å; F195-S198 PolarHBondContact O-N 2.98Å; Y196-S198 PolarHBondContact O-N 2.77Å
199	G	98	Very high	98.5	Very high	20 Å²	20	41.8 Å²	41.8	21%	0.206	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.9	13.2	174.8	0	0	0	0	0	115.1	F195 Y196 E197	F195-G199 PolarHBondContact O-N 2.95Å; Y196-G199 PolarHBondContact O-N 3.07Å; E197-G199 PolarHBondContact O-N 3.22Å
200	C	98.8	Very high	98.5	Very high	11 Å²	11	43 Å²	43	7%	0.074	22%	0.219	C	C	.	.			trans	-87	142.8	176.6	-59.5	0	0	0	0	111.9	I170 T171 F195 P237	I170-C200 HydrophobicContact CG2-CB 3.44Å; I170-C200 VanDerWaalsContact CG2-CB 3.44Å; T171-C200 CarbonylContact O-C 3.57Å; T171-C200 WeakPolarHBondContact O-CA 3.43Å; F195-C200 HydrophobicContact CB-CB 4.22Å; F195-C200 VanDerWaalsContact O-CB 3.23Å; F195-C200 WeakPolarHBondContact O-CB 3.3Å; F195-C200 PolarHBondContact O-N 3.05Å; C200-P237 VanDerWaalsContact O-CD 3.24Å; C200-P237 WeakPolarHBondContact O-CD 3.45Å
201	S	98.8	Very high	98.6	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.007	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	145.4	165.1	-65.9	0	0	0	0	111.1	I170 T171 L235 T236 G242	I170-S201 WeakPolarHBondContact CA-O 3.29Å; T171-S201 PolarHBondContact N-O 3.25Å; T171-S201 PolarHBondContact O-N 3.04Å; S201-L235 CarbonylContact C-O 3.58Å; S201-L235 VanDerWaalsContact CA-O 3.3Å; S201-L235 WeakPolarHBondContact CA-O 3.36Å; S201-T236 WeakPolarHBondContact OG-CB 3.36Å; S201-T236 VanDerWaalsContact OG-CG2 3.24Å; S201-T236 WeakPolarHBondContact OG-CG2 3.19Å; S201-T236 PolarHBondContact OG-OG1 3.41Å; S201-G242 WeakPolarHBondContact OG-CA 3.49Å
202	V	98.8	Very high	98.5	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	123.3	176.4	-169.4	0	0	0	0	108.2	F153 L168 I170 V192 Y196 L235	F153-V202 HydrophobicContact CE1-CG1 3.89Å; F153-V202 HydrophobicContact CE2-CG1 4.46Å; F153-V202 HydrophobicContact CZ-CB 4.31Å; F153-V202 HydrophobicContact CZ-CG1 3.52Å; L168-V202 HydrophobicContact CD1-CG1 3.69Å; L168-V202 HydrophobicContact CD2-CG1 3.97Å; L168-V202 HydrophobicContact CG-CG1 3.91Å; I170-V202 HydrophobicContact CD1-CB 4.3Å; I170-V202 HydrophobicContact CD1-CG1 3.97Å; I170-V202 HydrophobicContact CD1-CG2 3.89Å; V192-V202 HydrophobicContact CG1-CG1 3.77Å; V192-V202 HydrophobicContact CG1-CG2 3.93Å; Y196-V202 HydrophobicContact CD2-CG2 4.31Å; V202-L235 HydrophobicContact CB-CB 4.43Å; V202-L235 PolarHBondContact N-O 3.39Å; V202-L235 PolarHBondContact O-N 3.49Å
203	R	98.8	Very high	98.5	Very high	54 Å²	54	37.5 Å²	37.5	20%	0.204	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	119.9	178.9	178.1	177.6	73.6	171	5.9	110.5	L168 D169 L205 N232 V233 Y234 F243	L168-R203 CarbonylContact C-O 3.53Å; L168-R203 VanDerWaalsContact CA-O 3.25Å; L168-R203 WeakPolarHBondContact CA-O 3.3Å; D169-R203 HydrophobicContact CB-CB 4.36Å; D169-R203 PolarHBondContact N-O 3.33Å; D169-R203 PolarHBondContact O-N 3.16Å; D169-R203 IonicContact OD2-CZ 3.98Å; D169-R203 IonicContact OD2-NE 3.65Å; D169-R203 PolarHBondContact OD2-NE 2.79Å; D169-R203 IonicContact OD2-NH2 2.65Å; D169-R203 PolarHBondContact OD2-NH2 3.48Å; R203-L205 HydrophobicContact CG-CD2 4.27Å; R203-L205 VanDerWaalsContact NE-CD2 3.34Å; R203-N232 HydrophobicContact CG-CB 4.47Å; R203-V233 CarbonylContact C-O 3.59Å; R203-V233 VanDerWaalsContact CA-O 3.28Å; R203-V233 WeakPolarHBondContact CA-O 3.36Å; R203-Y234 HydrophobicContact CB-CD1 4.16Å; R203-Y234 HydrophobicContact CB-CE1 4.3Å; R203-Y234 HydrophobicContact CG-CD1 3.94Å; R203-Y234 HydrophobicContact CG-CE1 3.69Å; R203-F243 HydrophobicContact CB-CZ 4.15Å
204	L	98.9	Very high	98.6	Very high	0 Å²	0	35 Å²	35	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	119.7	170.1	-174.8	68.6	0	0	0	109.3	F148 F153 I156 V162 N167 P207 F210 N232 V233	F148-L204 HydrophobicContact CE2-CD2 4.48Å; F148-L204 HydrophobicContact CZ-CD2 3.92Å; F153-L204 HydrophobicContact CE2-CB 3.95Å; F153-L204 HydrophobicContact CZ-CB 3.89Å; I156-L204 HydrophobicContact CD1-CD2 4.49Å; V162-L204 HydrophobicContact CG1-CD1 4.5Å; N167-L204 CarbonylContact O-C 3.58Å; N167-L204 WeakPolarHBondContact O-CA 3.43Å; N167-L204 WeakPolarHBondContact O-CD1 3.46Å; L204-P207 HydrophobicContact CD2-CB 3.93Å; L204-P207 HydrophobicContact CG-CB 4.48Å; L204-F210 HydrophobicContact CD1-CD2 4.34Å; L204-F210 HydrophobicContact CD1-CE2 4.28Å; L204-N232 CarbonylContact O-C 3.49Å; L204-N232 VanDerWaalsContact O-CA 3.26Å; L204-N232 WeakPolarHBondContact O-CA 3.39Å; L204-V233 HydrophobicContact CB-CB 4.2Å; L204-V233 PolarHBondContact N-O 2.96Å; L204-V233 PolarHBondContact O-N 3.38Å
205	L	98.6	Very high	98.6	Very high	42 Å²	42	32.7 Å²	32.7	22%	0.22	18%	0.178	C	C	.	.	S	Bend	trans	-80.2	-29.1	-168.9	-67.1	173.1	0	0	0	114.1	N167 R203 N232	N167-L205 WeakPolarHBondContact O-CB 3.47Å; N167-L205 PolarHBondContact O-N 2.65Å; R203-L205 HydrophobicContact CG-CD2 4.27Å; R203-L205 VanDerWaalsContact NE-CD2 3.34Å; L205-N232 WeakPolarHBondContact CA-ND2 3.48Å; L205-N232 PolarHBondContact O-ND2 2.63Å
206	N	98.2	Very high	98.6	Very high	20 Å²	20	32.2 Å²	32.2	11%	0.107	18%	0.178	C	C	.	.			trans	-142.9	61.8	-174.5	62.2	-36.2	0	0	0	111.4	N167 Q208 A209	N167-N206 PolarHBondContact ND2-ND2 3.08Å; N167-N206 PolarHBondContact ND2-OD1 3.15Å; N206-Q208 PolarHBondContact O-N 3.35Å; N206-Q208 VanDerWaalsContact O-N 3.11Å; N206-A209 WeakPolarHBondContact ND2-CB 3.49Å; N206-A209 WeakPolarHBondContact O-CB 3.22Å; N206-A209 PolarHBondContact O-N 3.02Å
207	P	98.7	Very high	98.6	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-54.6	-31.4	-176.8	26.3	-37.3	0	0	0	113.4	F148 L204 A209 F210 S211 V214 A231 V233 I324	F148-P207 HydrophobicContact CE2-CB 4.29Å; L204-P207 HydrophobicContact CD2-CB 3.93Å; L204-P207 HydrophobicContact CG-CB 4.48Å; P207-A209 PolarHBondContact O-N 3.36Å; P207-F210 PolarHBondContact O-N 2.87Å; P207-S211 PolarHBondContact O-N 3.05Å; P207-V214 HydrophobicContact CB-CG1 4.18Å; P207-V214 HydrophobicContact CG-CG1 3.99Å; P207-A231 WeakPolarHBondContact CD-O 3.39Å; P207-A231 HydrophobicContact CG-CB 3.85Å; P207-V233 HydrophobicContact CB-CG2 3.8Å; P207-V233 HydrophobicContact CG-CG2 3.97Å; P207-I324 HydrophobicContact CG-CD1 4.35Å
208	Q	98.7	Very high	98.6	Very high	8 Å²	8	23.7 Å²	23.7	4%	0.037	14%	0.139	C	C	.	.	G	3₁₀ helix	trans	-63.7	-19.1	177.8	74.7	-76.8	8.1	0	0	114	N206 F210 V214 W215 L218 L416 R481	N206-Q208 PolarHBondContact O-N 3.35Å; N206-Q208 VanDerWaalsContact O-N 3.11Å; Q208-F210 PolarHBondContact O-N 3.33Å; Q208-V214 HydrophobicContact CB-CG1 4.06Å; Q208-W215 HydrophobicContact CB-CB 4.27Å; Q208-L218 HydrophobicContact CB-CD1 3.84Å; Q208-L218 HydrophobicContact CG-CD1 4.16Å; Q208-L416 HydrophobicContact CB-CD1 4.45Å; Q208-L416 HydrophobicContact CG-CD1 4.08Å; Q208-L416 HydrophobicContact CG-CD2 3.76Å; Q208-R481 PolarHBondContact O-NE 2.97Å; Q208-R481 PolarHBondContact O-NH2 3.2Å
209	A	98.4	Very high	98.6	Very high	17 Å²	17	20.2 Å²	20.2	14%	0.14	12%	0.115	C	C	.	.	G	3₁₀ helix	trans	-72.3	-21	172.8	0	0	0	0	0	112.5	N206 P207 R481 V482	N206-A209 WeakPolarHBondContact ND2-CB 3.49Å; N206-A209 WeakPolarHBondContact O-CB 3.22Å; N206-A209 PolarHBondContact O-N 3.02Å; P207-A209 PolarHBondContact O-N 3.36Å; A209-R481 PolarHBondContact O-NH2 2.99Å; A209-R481 VanDerWaalsContact O-NH2 3.16Å; A209-V482 HydrophobicContact CB-CG2 3.91Å
210	F	98.4	Very high	98.6	Very high	31 Å²	31	19.7 Å²	19.7	14%	0.136	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.5	-26.6	-171.8	-52.7	-71.9	0	0	0	113.8	R155 I156 E160 N167 L204 P207 Q208	R155-F210 PolarHBondContact NH2-O 2.89Å; I156-F210 HydrophobicContact CD1-CB 3.66Å; I156-F210 HydrophobicContact CG1-CB 3.83Å; I156-F210 HydrophobicContact CG2-CB 3.93Å; I156-F210 HydrophobicContact CG2-CD1 4.27Å; I156-F210 HydrophobicContact CG2-CD2 4.25Å; I156-F210 HydrophobicContact CG2-CG 3.89Å; E160-F210 HydrophobicContact CB-CD1 3.8Å; E160-F210 HydrophobicContact CB-CE1 4.03Å; E160-F210 HydrophobicContact CG-CD1 3.84Å; N167-F210 HydrophobicContact CB-CE2 4.15Å; N167-F210 HydrophobicContact CB-CZ 4.23Å; L204-F210 HydrophobicContact CD1-CD2 4.34Å; L204-F210 HydrophobicContact CD1-CE2 4.28Å; P207-F210 PolarHBondContact O-N 2.87Å; Q208-F210 PolarHBondContact O-N 3.33Å
211	S	98.6	Very high	98.6	Very high	4 Å²	4	19.2 Å²	19.2	3%	0.028	10%	0.104	C	C	.	.			trans	-107.6	125.4	176.5	172	0	0	0	0	111.4	P207 V214 W215 R481	P207-S211 PolarHBondContact O-N 3.05Å; S211-V214 PolarHBondContact OG-N 3.24Å; S211-W215 WeakPolarHBondContact O-CB 3.19Å; S211-W215 PolarHBondContact O-N 3.43Å; S211-W215 VanDerWaalsContact O-N 3.11Å; S211-R481 PolarHBondContact O-NH2 3.21Å
212	S	98.1	Very high	98.5	Very high	77 Å²	77	19.8 Å²	19.8	54%	0.538	11%	0.107	S	C	.	.	H	α-helix	trans	-70.1	-36.3	175.7	51.1	0	0	0	0	112.3	W215 N216	S212-W215 PolarHBondContact O-N 3.3Å; S212-N216 WeakPolarHBondContact O-CB 3.44Å; S212-N216 PolarHBondContact O-N 3.33Å
213	T	98.6	Very high	98.4	Very high	34 Å²	34	21.2 Å²	21.2	21%	0.209	11%	0.113	C	C	.	.	H	α-helix	trans	-66.3	-44.5	177.4	-49.3	0	0	0	0	111.5	L91 L95 G146 L147 W215 N216 V217	L91-T213 HydrophobicContact CD2-CG2 4.17Å; L95-T213 HydrophobicContact CD1-CG2 3.98Å; G146-T213 WeakPolarHBondContact O-CG2 3.31Å; L147-T213 HydrophobicContact CD1-CG2 4.43Å; T213-W215 VanDerWaalsContact C-N 3.34Å; T213-W215 PolarHBondContact O-N 3.34Å; T213-N216 PolarHBondContact O-N 3.25Å; T213-V217 WeakPolarHBondContact O-CG2 3.14Å; T213-V217 PolarHBondContact O-N 2.86Å
214	V	98.9	Very high	98.3	Very high	1 Å²	1	21 Å²	21	1%	0.006	11%	0.114	C	C	.	.	H	α-helix	trans	-63.1	-43.6	175.5	178.9	0	0	0	0	110.4	L147 F148 P207 Q208 S211 N216 V217 L218 I324	L147-V214 HydrophobicContact CD1-CG2 4.23Å; L147-V214 WeakPolarHBondContact O-CG2 3.22Å; F148-V214 HydrophobicContact CB-CG2 4.25Å; F148-V214 HydrophobicContact CD2-CG2 3.78Å; F148-V214 HydrophobicContact CG-CG2 4.43Å; P207-V214 HydrophobicContact CB-CG1 4.18Å; P207-V214 HydrophobicContact CG-CG1 3.99Å; Q208-V214 HydrophobicContact CB-CG1 4.06Å; S211-V214 PolarHBondContact OG-N 3.24Å; V214-N216 PolarHBondContact O-N 2.82Å; V214-V217 PolarHBondContact O-N 3.21Å; V214-L218 HydrophobicContact CG1-CD1 3.92Å; V214-L218 HydrophobicContact CG1-CG 4.15Å; V214-L218 WeakPolarHBondContact O-CB 3.5Å; V214-L218 VanDerWaalsContact O-CG 3.29Å; V214-L218 WeakPolarHBondContact O-CG 3.46Å; V214-L218 PolarHBondContact O-N 3.13Å; V214-I324 HydrophobicContact CG1-CD1 3.92Å; V214-I324 HydrophobicContact CG2-CD1 4.02Å
215	W	98.8	Very high	98.2	Very high	52 Å²	52	21.5 Å²	21.5	20%	0.197	12%	0.116	C	C	.	.	H	α-helix	trans	-56.4	-48.3	173.7	170.8	30.4	0	0	0	112.2	Q208 S211 S212 T213 V217 L218 S219 P417 V419 R481	Q208-W215 HydrophobicContact CB-CB 4.27Å; S211-W215 WeakPolarHBondContact O-CB 3.19Å; S211-W215 PolarHBondContact O-N 3.43Å; S211-W215 VanDerWaalsContact O-N 3.11Å; S212-W215 PolarHBondContact O-N 3.3Å; T213-W215 VanDerWaalsContact C-N 3.34Å; T213-W215 PolarHBondContact O-N 3.34Å; W215-V217 PolarHBondContact O-N 3.18Å; W215-L218 PolarHBondContact O-N 2.8Å; W215-S219 VanDerWaalsContact O-CB 3.29Å; W215-S219 WeakPolarHBondContact O-CB 3.46Å; W215-S219 PolarHBondContact O-N 3.04Å; W215-S219 PolarHBondContact O-OG 3.45Å; W215-P417 HydrophobicContact CZ2-CB 4.39Å; W215-P417 HydrophobicContact CZ2-CG 3.83Å; W215-P417 PolarHBondContact NE1-O 3.44Å; W215-V419 HydrophobicContact CD2-CG2 3.42Å; W215-V419 VanDerWaalsContact CD2-CG2 3.42Å; W215-V419 HydrophobicContact CE3-CG2 3.72Å; W215-V419 HydrophobicContact CG-CG2 3.91Å; W215-V419 HydrophobicContact CH2-CG2 3.95Å; W215-V419 HydrophobicContact CZ2-CG2 3.65Å; W215-V419 HydrophobicContact CZ3-CG2 3.98Å; W215-R481 HydrophobicContact CD2-CG 3.94Å; W215-R481 HydrophobicContact CE3-CG 4.46Å; W215-R481 HydrophobicContact CG-CG 4.14Å; W215-R481 HydrophobicContact CZ2-CG 4.45Å
216	N	98.7	Very high	97.9	Very high	32 Å²	32	25 Å²	25	17%	0.171	14%	0.135	C	C	.	.	H	α-helix	trans	-57.8	-52.7	178.9	-170	10.5	0	0	0	111.4	S212 T213 V214 L218 S219 I220 V419	S212-N216 WeakPolarHBondContact O-CB 3.44Å; S212-N216 PolarHBondContact O-N 3.33Å; T213-N216 PolarHBondContact O-N 3.25Å; V214-N216 PolarHBondContact O-N 2.82Å; N216-L218 PolarHBondContact O-N 2.96Å; N216-S219 PolarHBondContact O-N 3.19Å; N216-S219 PolarHBondContact O-OG 3.39Å; N216-I220 WeakPolarHBondContact O-CG1 3.46Å; N216-I220 PolarHBondContact O-N 2.96Å; N216-I220 VanDerWaalsContact OD1-CD1 3.31Å; N216-I220 WeakPolarHBondContact OD1-CD1 3.47Å; N216-V419 HydrophobicContact CB-CB 4.18Å; N216-V419 HydrophobicContact CB-CG1 4.28Å; N216-V419 HydrophobicContact CB-CG2 3.87Å
217	V	98.8	Very high	97.8	Very high	8 Å²	8	24.5 Å²	24.5	5%	0.048	13%	0.133	C	C	.	.	H	α-helix	trans	-58.2	-47.2	179.7	167.1	0	0	0	0	111.8	L91 L95 L111 L147 T213 V214 W215 I220 L221 I326	L91-V217 HydrophobicContact CD1-CG2 4.32Å; L91-V217 HydrophobicContact CD2-CG2 4.49Å; L95-V217 HydrophobicContact CD2-CG2 4.35Å; L111-V217 HydrophobicContact CD2-CG1 4.24Å; L147-V217 HydrophobicContact CD1-CB 4.31Å; L147-V217 HydrophobicContact CD1-CG1 4.47Å; L147-V217 HydrophobicContact CD1-CG2 3.99Å; T213-V217 WeakPolarHBondContact O-CG2 3.14Å; T213-V217 PolarHBondContact O-N 2.86Å; V214-V217 PolarHBondContact O-N 3.21Å; W215-V217 PolarHBondContact O-N 3.18Å; V217-I220 PolarHBondContact O-N 2.6Å; V217-L221 HydrophobicContact CG1-CD1 3.84Å; V217-L221 HydrophobicContact CG1-CG 4.42Å; V217-L221 WeakPolarHBondContact O-CB 3.32Å; V217-L221 WeakPolarHBondContact O-CG 3.44Å; V217-L221 PolarHBondContact O-N 2.87Å; V217-I326 HydrophobicContact CG1-CD1 4.1Å
218	L	98.9	Very high	97.7	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-67.5	-40.1	179.7	-64.9	-175.7	0	0	0	112.4	Q208 V214 W215 N216 I220 L221 Q222 A229 A231 I326 L416	Q208-L218 HydrophobicContact CB-CD1 3.84Å; Q208-L218 HydrophobicContact CG-CD1 4.16Å; V214-L218 HydrophobicContact CG1-CD1 3.92Å; V214-L218 HydrophobicContact CG1-CG 4.15Å; V214-L218 WeakPolarHBondContact O-CB 3.5Å; V214-L218 VanDerWaalsContact O-CG 3.29Å; V214-L218 WeakPolarHBondContact O-CG 3.46Å; V214-L218 PolarHBondContact O-N 3.13Å; W215-L218 PolarHBondContact O-N 2.8Å; N216-L218 PolarHBondContact O-N 2.96Å; L218-I220 PolarHBondContact O-N 3.3Å; L218-L221 PolarHBondContact O-N 2.88Å; L218-Q222 PolarHBondContact O-N 3.46Å; L218-A229 HydrophobicContact CB-CB 4.34Å; L218-A229 HydrophobicContact CD2-CB 4.15Å; L218-A231 HydrophobicContact CD1-CB 3.85Å; L218-A231 HydrophobicContact CD2-CB 4.28Å; L218-I326 HydrophobicContact CD2-CB 4.37Å; L218-I326 HydrophobicContact CD2-CD1 3.99Å; L218-I326 HydrophobicContact CD2-CG1 3.94Å; L218-I326 HydrophobicContact CD2-CG2 3.7Å; L218-L416 HydrophobicContact CB-CD1 3.47Å; L218-L416 VanDerWaalsContact CB-CD1 3.47Å; L218-L416 HydrophobicContact CD1-CD1 4.2Å
219	S	98.2	Very high	97.7	Very high	12 Å²	12	26 Å²	26	8%	0.084	14%	0.141	C	C	.	.	H	α-helix	trans	-63.4	-29.7	177.9	75.9	0	0	0	0	112.8	W215 N216 Q222	W215-S219 VanDerWaalsContact O-CB 3.29Å; W215-S219 WeakPolarHBondContact O-CB 3.46Å; W215-S219 PolarHBondContact O-N 3.04Å; W215-S219 PolarHBondContact O-OG 3.45Å; N216-S219 PolarHBondContact O-N 3.19Å; N216-S219 PolarHBondContact O-OG 3.39Å; S219-Q222 WeakPolarHBondContact O-CG 3.46Å
220	I	98.4	Very high	97.7	Very high	10 Å²	10	25.7 Å²	25.7	5%	0.051	14%	0.139	C	C	.	.	H	α-helix	trans	-78.8	-43.6	173.7	-66.9	168.1	0	0	0	110.5	L95 L98 R107 A108 L111 N216 V217 L218 Q222 E223	L95-I220 HydrophobicContact CD2-CD1 4.38Å; L98-I220 HydrophobicContact CD1-CD1 4.23Å; R107-I220 HydrophobicContact CB-CG2 4.47Å; A108-I220 HydrophobicContact CB-CG2 4.15Å; A108-I220 VanDerWaalsContact CB-O 3.27Å; A108-I220 WeakPolarHBondContact CB-O 3.33Å; L111-I220 HydrophobicContact CB-CG2 3.94Å; L111-I220 HydrophobicContact CD2-CB 3.68Å; L111-I220 HydrophobicContact CD2-CD1 4.21Å; L111-I220 HydrophobicContact CD2-CG2 3.46Å; L111-I220 VanDerWaalsContact CD2-CG2 3.46Å; L111-I220 HydrophobicContact CG-CG2 4.35Å; N216-I220 WeakPolarHBondContact O-CG1 3.46Å; N216-I220 PolarHBondContact O-N 2.96Å; N216-I220 VanDerWaalsContact OD1-CD1 3.31Å; N216-I220 WeakPolarHBondContact OD1-CD1 3.47Å; V217-I220 PolarHBondContact O-N 2.6Å; L218-I220 PolarHBondContact O-N 3.3Å; I220-Q222 PolarHBondContact O-N 3.07Å; I220-E223 PolarHBondContact O-N 2.84Å
221	L	98.5	Very high	97.7	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.005	13%	0.134	C	C	.	.	H	α-helix	trans	-69.1	-31	-177.8	-72.9	177.5	0	0	0	113.5	L111 F112 L115 V217 L218 E223 K224 F225 A229 I326	L111-L221 HydrophobicContact CD2-CD2 4.15Å; L111-L221 HydrophobicContact CD2-CG 3.98Å; L111-L221 HydrophobicContact CG-CD2 4.12Å; L111-L221 HydrophobicContact CG-CG 4.44Å; F112-L221 HydrophobicContact CB-CD2 4.11Å; F112-L221 HydrophobicContact CD2-CD2 4.14Å; L115-L221 HydrophobicContact CD2-CD1 4.23Å; V217-L221 HydrophobicContact CG1-CD1 3.84Å; V217-L221 HydrophobicContact CG1-CG 4.42Å; V217-L221 WeakPolarHBondContact O-CB 3.32Å; V217-L221 WeakPolarHBondContact O-CG 3.44Å; V217-L221 PolarHBondContact O-N 2.87Å; L218-L221 PolarHBondContact O-N 2.88Å; L221-E223 PolarHBondContact O-N 3.29Å; L221-K224 WeakPolarHBondContact O-CA 3.44Å; L221-K224 VanDerWaalsContact O-CB 3.28Å; L221-K224 WeakPolarHBondContact O-CB 3.3Å; L221-K224 PolarHBondContact O-N 3Å; L221-F225 HydrophobicContact CB-CD2 4.46Å; L221-F225 HydrophobicContact CB-CE2 4.12Å; L221-F225 WeakPolarHBondContact O-CD2 3.49Å; L221-F225 PolarHBondContact O-N 3.13Å; L221-A229 HydrophobicContact CB-CB 4.28Å; L221-I326 HydrophobicContact CD1-CD1 3.85Å; L221-I326 HydrophobicContact CD1-CG2 4.23Å
222	Q	97.5	Very high	97.7	Very high	12 Å²	12	26 Å²	26	6%	0.056	14%	0.142	C	C	.	.	H	α-helix	trans	-62	-32.6	177.6	78.6	-170.2	27.6	0	0	112	L218 S219 I220 K224 F225 D226 S227 A229 L416	L218-Q222 PolarHBondContact O-N 3.46Å; S219-Q222 WeakPolarHBondContact O-CG 3.46Å; I220-Q222 PolarHBondContact O-N 3.07Å; Q222-K224 PolarHBondContact O-N 2.89Å; Q222-F225 PolarHBondContact O-N 3.36Å; Q222-D226 PolarHBondContact O-N 2.85Å; Q222-S227 WeakPolarHBondContact CA-O 3.2Å; Q222-S227 WeakPolarHBondContact CB-O 3.36Å; Q222-A229 HydrophobicContact CB-CB 3.93Å; Q222-L416 PolarHBondContact NE2-O 2.7Å
223	E	95.8	Very high	97.7	Very high	30 Å²	30	22.3 Å²	22.3	14%	0.14	12%	0.116	C	C	.	.	H	α-helix	trans	-70.5	-21.4	174.3	-170.4	173.4	-173.2	0	0	111.7	S104 K105 A108 I220 L221 G460	S104-E223 WeakPolarHBondContact CB-OE2 2.91Å; S104-E223 VanDerWaalsContact OG-CD 3.26Å; S104-E223 PolarHBondContact OG-OE1 3.37Å; S104-E223 PolarHBondContact OG-OE2 2.86Å; S104-E223 VanDerWaalsContact OG-OE2 3.05Å; K105-E223 HydrophobicContact CG-CG 4.25Å; K105-E223 WeakPolarHBondContact CG-OE1 3.41Å; K105-E223 PolarHBondContact N-OE1 3.15Å; A108-E223 HydrophobicContact CB-CB 4.19Å; I220-E223 PolarHBondContact O-N 2.84Å; L221-E223 PolarHBondContact O-N 3.29Å; E223-G460 PolarHBondContact OE1-N 3.05Å
224	K	96.4	Very high	97.8	Very high	50 Å²	50	21.9 Å²	21.9	22%	0.217	11%	0.111	C	C	.	.	H	α-helix	trans	-76.5	-35.6	172.9	179.8	58.4	-169.4	164.3	0	112.4	A108 N109 F112 F125 L221 Q222	A108-K224 HydrophobicContact CB-CB 4.05Å; N109-K224 WeakPolarHBondContact OD1-CD 3.45Å; N109-K224 WeakPolarHBondContact OD1-CE 3.49Å; N109-K224 PolarHBondContact OD1-NZ 3.35Å; F112-K224 HydrophobicContact CB-CD 4.38Å; F112-K224 HydrophobicContact CB-CG 3.87Å; F112-K224 HydrophobicContact CD1-CD 4.44Å; F112-K224 HydrophobicContact CD1-CG 4.16Å; F112-K224 HydrophobicContact CD2-CG 4.22Å; F112-K224 HydrophobicContact CG-CD 4.46Å; F112-K224 HydrophobicContact CG-CG 3.82Å; F125-K224 VanDerWaalsContact CE2-CE 3.41Å; L221-K224 WeakPolarHBondContact O-CA 3.44Å; L221-K224 VanDerWaalsContact O-CB 3.28Å; L221-K224 WeakPolarHBondContact O-CB 3.3Å; L221-K224 PolarHBondContact O-N 3Å; Q222-K224 PolarHBondContact O-N 2.89Å
225	F	96.1	Very high	97.8	Very high	10 Å²	10	21.8 Å²	21.8	4%	0.044	11%	0.111	C	C	.	.	H	α-helix	trans	-93.1	-14.7	-172.8	-63.9	-55	0	0	0	113.8	F112 W129 L221 Q222 S227 F253	F112-F225 HydrophobicContact CD2-CE1 4.25Å; F112-F225 AromaticContact CD2-CZ 3.97Å; F112-F225 HydrophobicContact CD2-CZ 3.97Å; F112-F225 AromaticContact CE2-CE1 3.67Å; F112-F225 HydrophobicContact CE2-CE1 3.67Å; F112-F225 AromaticContact CE2-CZ 3.59Å; F112-F225 HydrophobicContact CE2-CZ 3.59Å; F112-F225 HydrophobicContact CZ-CE1 4.19Å; W129-F225 HydrophobicContact CH2-CD1 4.04Å; W129-F225 AromaticContact CH2-CE1 3.97Å; W129-F225 HydrophobicContact CH2-CE1 3.97Å; W129-F225 HydrophobicContact CZ3-CE1 4.11Å; L221-F225 HydrophobicContact CB-CD2 4.46Å; L221-F225 HydrophobicContact CB-CE2 4.12Å; L221-F225 WeakPolarHBondContact O-CD2 3.49Å; L221-F225 PolarHBondContact O-N 3.13Å; Q222-F225 PolarHBondContact O-N 3.36Å; F225-S227 PolarHBondContact O-N 2.93Å; F225-F253 HydrophobicContact CE1-CE2 4.14Å; F225-F253 HydrophobicContact CE1-CZ 4.27Å; F225-F253 HydrophobicContact CZ-CD2 4.47Å; F225-F253 AromaticContact CZ-CE2 3.63Å; F225-F253 HydrophobicContact CZ-CE2 3.63Å; F225-F253 HydrophobicContact CZ-CZ 4.01Å
226	D	94.2	Very high	97.8	Very high	116 Å²	116	19.4 Å²	19.4	62%	0.62	10%	0.102	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.1	39.1	-167	-63.9	-48.6	0	0	0	110.9	Q222	Q222-D226 PolarHBondContact O-N 2.85Å
227	S	95.9	Very high	97.8	Very high	9 Å²	9	18.2 Å²	18.2	6%	0.063	10%	0.096	C	C	.	.	S	Bend	trans	-160	149.7	-176.1	-176.8	0	0	0	0	108.3	Q222 F225 A229 Y329 F411	Q222-S227 WeakPolarHBondContact CA-O 3.2Å; Q222-S227 WeakPolarHBondContact CB-O 3.36Å; F225-S227 PolarHBondContact O-N 2.93Å; S227-A229 PolarHBondContact O-N 3.02Å; S227-Y329 WeakPolarHBondContact OG-CA 3.21Å; S227-Y329 PolarHBondContact OG-N 3.19Å; S227-Y329 VanDerWaalsContact OG-N 3.15Å; S227-F411 VanDerWaalsContact N-CE2 3.3Å
228	M	95.9	Very high	97.7	Very high	40 Å²	40	20.6 Å²	20.6	20%	0.197	11%	0.112	C	C	.	.			trans	-52.2	133	178.2	-175.2	-167.6	174.1	0	0	110.4	S328 D414 Y483	M228-S328 WeakPolarHBondContact O-CA 3.38Å; M228-S328 WeakPolarHBondContact O-CB 3.26Å; M228-S328 PolarHBondContact O-OG 2.66Å; M228-D414 HydrophobicContact CB-CB 3.98Å; M228-D414 HydrophobicContact CG-CB 4.28Å; M228-D414 HydrophobicContact SD-CB 4.27Å; M228-Y483 HydrophobicContact CE-CD2 3.46Å; M228-Y483 VanDerWaalsContact CE-CD2 3.46Å; M228-Y483 HydrophobicContact CE-CE2 4.13Å; M228-Y483 HydrophobicContact CE-CG 4.19Å; M228-Y483 HydrophobicContact SD-CD2 3.52Å; M228-Y483 VanDerWaalsContact SD-CD2 3.52Å; M228-Y483 HydrophobicContact SD-CE2 3.53Å; M228-Y483 VanDerWaalsContact SD-CE2 3.53Å
229	A	98.1	Very high	97.7	Very high	0 Å²	0	23 Å²	23	0%	0	14%	0.136	C	C	.	.			trans	-102.4	109.7	168.1	0	0	0	0	0	108.6	L218 L221 Q222 S227 S327	L218-A229 HydrophobicContact CB-CB 4.34Å; L218-A229 HydrophobicContact CD2-CB 4.15Å; L221-A229 HydrophobicContact CB-CB 4.28Å; Q222-A229 HydrophobicContact CB-CB 3.93Å; S227-A229 PolarHBondContact O-N 3.02Å; A229-S327 WeakPolarHBondContact CA-O 3.45Å
230	G	98.4	Very high	97.7	Very high	10 Å²	10	24 Å²	24	10%	0.103	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	171.7	174.3	0	0	0	0	0	111.7	I326 S327	G230-I326 WeakPolarHBondContact O-CA 3.43Å; G230-S327 PolarHBondContact N-O 2.76Å; G230-S327 PolarHBondContact O-N 3.04Å
231	A	98.8	Very high	97.7	Very high	3 Å²	3	24.7 Å²	24.7	3%	0.025	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	155.7	168.5	0	0	0	0	0	113.1	P207 L218 I324 T325 I326	P207-A231 WeakPolarHBondContact CD-O 3.39Å; P207-A231 HydrophobicContact CG-CB 3.85Å; L218-A231 HydrophobicContact CD1-CB 3.85Å; L218-A231 HydrophobicContact CD2-CB 4.28Å; A231-I324 HydrophobicContact CB-CD1 3.87Å; A231-I324 HydrophobicContact CB-CG1 3.91Å; A231-T325 CarbonylContact C-O 3.58Å; A231-T325 WeakPolarHBondContact CA-O 3.23Å; A231-T325 WeakPolarHBondContact CB-O 3.48Å; A231-I326 HydrophobicContact CB-CG1 4.47Å
232	N	98.9	Very high	97.6	Very high	38 Å²	38	24.7 Å²	24.7	20%	0.203	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	145.8	161.6	-53.8	132.8	0	0	0	109.6	R203 L204 L205 Y234 I324 T325	R203-N232 HydrophobicContact CG-CB 4.47Å; L204-N232 CarbonylContact O-C 3.49Å; L204-N232 VanDerWaalsContact O-CA 3.26Å; L204-N232 WeakPolarHBondContact O-CA 3.39Å; L205-N232 WeakPolarHBondContact CA-ND2 3.48Å; L205-N232 PolarHBondContact O-ND2 2.63Å; N232-Y234 HydrophobicContact CB-CD2 4.28Å; N232-Y234 HydrophobicContact CB-CE2 3.48Å; N232-Y234 VanDerWaalsContact CB-CE2 3.48Å; N232-Y234 PolarHBondContact OD1-OH 3.2Å; N232-I324 CarbonylContact O-C 3.6Å; N232-I324 WeakPolarHBondContact O-CA 3.46Å; N232-T325 PolarHBondContact N-O 3.2Å; N232-T325 PolarHBondContact O-N 2.79Å
233	V	98.9	Very high	97.7	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	135.4	172.3	176.4	0	0	0	0	109.2	F148 F153 R203 L204 P207 L322 H323 I324	F148-V233 HydrophobicContact CD1-CG1 3.92Å; F148-V233 HydrophobicContact CD1-CG2 3.96Å; F148-V233 HydrophobicContact CE1-CB 4.36Å; F148-V233 HydrophobicContact CE1-CG1 3.83Å; F148-V233 HydrophobicContact CE1-CG2 4.07Å; F148-V233 HydrophobicContact CG-CG2 4.23Å; F148-V233 HydrophobicContact CZ-CG2 4.4Å; F153-V233 HydrophobicContact CD2-CG1 4.06Å; F153-V233 HydrophobicContact CE2-CG1 4.06Å; R203-V233 CarbonylContact C-O 3.59Å; R203-V233 VanDerWaalsContact CA-O 3.28Å; R203-V233 WeakPolarHBondContact CA-O 3.36Å; L204-V233 HydrophobicContact CB-CB 4.2Å; L204-V233 PolarHBondContact N-O 2.96Å; L204-V233 PolarHBondContact O-N 3.38Å; P207-V233 HydrophobicContact CB-CG2 3.8Å; P207-V233 HydrophobicContact CG-CG2 3.97Å; V233-L322 HydrophobicContact CG1-CD1 3.51Å; V233-L322 HydrophobicContact CG1-CG 4.32Å; V233-H323 WeakPolarHBondContact CA-O 3.5Å; V233-I324 HydrophobicContact CG2-CB 4.07Å; V233-I324 HydrophobicContact CG2-CD1 3.99Å; V233-I324 HydrophobicContact CG2-CG1 3.88Å
234	Y	98.9	Very high	97.8	Very high	25 Å²	25	24.3 Å²	24.3	10%	0.098	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	117.8	-177.8	-61.9	-97.7	0	0	0	109.9	R203 N232 F243 L322 H323	R203-Y234 HydrophobicContact CB-CD1 4.16Å; R203-Y234 HydrophobicContact CB-CE1 4.3Å; R203-Y234 HydrophobicContact CG-CD1 3.94Å; R203-Y234 HydrophobicContact CG-CE1 3.69Å; N232-Y234 HydrophobicContact CB-CD2 4.28Å; N232-Y234 HydrophobicContact CB-CE2 3.48Å; N232-Y234 VanDerWaalsContact CB-CE2 3.48Å; N232-Y234 PolarHBondContact OD1-OH 3.2Å; Y234-F243 HydrophobicContact CD1-CD2 4.36Å; Y234-F243 AromaticContact CD1-CE2 3.63Å; Y234-F243 HydrophobicContact CD1-CE2 3.63Å; Y234-F243 HydrophobicContact CD1-CZ 4.07Å; Y234-F243 HydrophobicContact CE1-CD2 4.39Å; Y234-F243 AromaticContact CE1-CE2 3.73Å; Y234-F243 HydrophobicContact CE1-CE2 3.73Å; Y234-F243 AromaticContact CE1-CZ 3.81Å; Y234-F243 HydrophobicContact CE1-CZ 3.81Å; Y234-L322 WeakPolarHBondContact O-CA 3.38Å; Y234-H323 WeakPolarHBondContact CB-CE1 3.37Å; Y234-H323 AromaticContact CD2-CD2 3.75Å; Y234-H323 AromaticContact CD2-CE1 3.82Å; Y234-H323 AromaticContact CD2-NE2 3.21Å; Y234-H323 WeakPolarHBondContact CD2-NE2 3.35Å; Y234-H323 AromaticContact CE2-NE2 3.95Å; Y234-H323 AromaticContact CG-CE1 3.67Å; Y234-H323 AromaticContact CG-NE2 3.54Å; Y234-H323 PolarHBondContact N-O 2.83Å; Y234-H323 PolarHBondContact O-N 2.77Å; Y234-H323 VanDerWaalsContact O-N 3.08Å
235	L	98.9	Very high	97.9	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	119.6	173.6	177.5	55	0	0	0	109	T150 F153 W193 Y196 S201 V202 S321 L322	T150-L235 HydrophobicContact CG2-CD2 4.04Å; F153-L235 HydrophobicContact CE2-CB 4.43Å; W193-L235 HydrophobicContact CH2-CD2 3.72Å; W193-L235 HydrophobicContact CZ3-CD2 3.55Å; Y196-L235 HydrophobicContact CD2-CD2 4.42Å; Y196-L235 HydrophobicContact CD2-CG 4.1Å; Y196-L235 HydrophobicContact CE2-CD1 3.93Å; Y196-L235 HydrophobicContact CE2-CD2 4.22Å; Y196-L235 HydrophobicContact CE2-CG 3.63Å; S201-L235 CarbonylContact C-O 3.58Å; S201-L235 VanDerWaalsContact CA-O 3.3Å; S201-L235 WeakPolarHBondContact CA-O 3.36Å; V202-L235 HydrophobicContact CB-CB 4.43Å; V202-L235 PolarHBondContact N-O 3.39Å; V202-L235 PolarHBondContact O-N 3.49Å; L235-S321 WeakPolarHBondContact CA-O 3.28Å; L235-L322 HydrophobicContact CB-CD1 3.83Å; L235-L322 HydrophobicContact CD1-CB 4.41Å; L235-L322 HydrophobicContact CD1-CD1 4.17Å; L235-L322 HydrophobicContact CG-CD1 4.45Å
236	T	98.8	Very high	98	Very high	1 Å²	1	22.8 Å²	22.8	1%	0.006	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	130.5	-176.1	-60.6	0	0	0	0	110.4	S201 T240 K261 C315 H320 S321	S201-T236 WeakPolarHBondContact OG-CB 3.36Å; S201-T236 VanDerWaalsContact OG-CG2 3.24Å; S201-T236 WeakPolarHBondContact OG-CG2 3.19Å; S201-T236 PolarHBondContact OG-OG1 3.41Å; T236-T240 VanDerWaalsContact CG2-OG1 3.24Å; T236-T240 WeakPolarHBondContact CG2-OG1 3.4Å; T236-K261 PolarHBondContact OG1-NZ 2.83Å; T236-C315 VanDerWaalsContact CB-SG 3.52Å; T236-C315 HydrophobicContact CG2-CB 4.24Å; T236-C315 WeakPolarHBondContact CG2-SG 3.34Å; T236-C315 PolarHBondContact O-SG 3.04Å; T236-C315 VanDerWaalsContact O-SG 3.34Å; T236-H320 WeakPolarHBondContact O-CA 3.3Å; T236-S321 PolarHBondContact N-O 3.22Å; T236-S321 PolarHBondContact O-N 3.29Å
237	P	98.6	Very high	98.2	Very high	7 Å²	7	18.5 Å²	18.5	5%	0.045	11%	0.112	C	C	.	.			trans	-70.9	159.7	-179.9	24.1	-28.5	0	0	0	112.8	Y196 C200 T240 C315	Y196-P237 HydrophobicContact CD1-CB 4.46Å; Y196-P237 HydrophobicContact CD2-CB 4.18Å; Y196-P237 HydrophobicContact CD2-CG 4.21Å; Y196-P237 HydrophobicContact CE1-CB 4.06Å; Y196-P237 HydrophobicContact CE2-CB 3.75Å; Y196-P237 HydrophobicContact CE2-CG 4.12Å; Y196-P237 WeakPolarHBondContact O-CG 3.5Å; Y196-P237 WeakPolarHBondContact OH-CA 3.23Å; C200-P237 VanDerWaalsContact O-CD 3.24Å; C200-P237 WeakPolarHBondContact O-CD 3.45Å; P237-T240 WeakPolarHBondContact CD-OG1 3.46Å; P237-T240 HydrophobicContact CG-CG2 3.95Å; P237-T240 WeakPolarHBondContact CG-OG1 3.45Å; P237-T240 PolarHBondContact O-N 3.32Å; P237-T240 PolarHBondContact O-OG1 2.9Å; P237-C315 VanDerWaalsContact O-CB 3.26Å; P237-C315 WeakPolarHBondContact O-CB 3.24Å
238	P	98.6	Very high	98.4	Very high	59 Å²	59	20 Å²	20	38%	0.383	12%	0.119	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	142.1	178.9	-21.5	30.1	0	0	0	113.1	T240 P317 A319 H320	P238-T240 WeakPolarHBondContact O-CG2 3.23Å; P238-T240 PolarHBondContact O-N 2.96Å; P238-P317 WeakPolarHBondContact CB-O 3.41Å; P238-A319 WeakPolarHBondContact CA-O 3.44Å; P238-H320 HydrophobicContact CG-CB 4.41Å
239	G	97.9	Very high	98.5	Very high	50 Å²	50	19.1 Å²	19.1	52%	0.515	12%	0.115	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.9	9	174.9	0	0	0	0	0	116	L316	G239-L316 PolarHBondContact N-O 3.21Å
240	T	98.3	Very high	98.5	Very high	32 Å²	32	20 Å²	20	20%	0.196	12%	0.12	C	C	.	.			trans	-115.2	167	-175.7	70	0	0	0	0	113.9	T236 P237 P238 C315	T236-T240 VanDerWaalsContact CG2-OG1 3.24Å; T236-T240 WeakPolarHBondContact CG2-OG1 3.4Å; P237-T240 WeakPolarHBondContact CD-OG1 3.46Å; P237-T240 HydrophobicContact CG-CG2 3.95Å; P237-T240 WeakPolarHBondContact CG-OG1 3.45Å; P237-T240 PolarHBondContact O-N 3.32Å; P237-T240 PolarHBondContact O-OG1 2.9Å; P238-T240 WeakPolarHBondContact O-CG2 3.23Å; P238-T240 PolarHBondContact O-N 2.96Å; T240-C315 PolarHBondContact O-N 3.18Å
241	Q	98.3	Very high	98.5	Very high	26 Å²	26	19.6 Å²	19.6	12%	0.121	12%	0.115	C	C	.	.	B	Isolated β-bridge	trans	-129.5	132.5	170.9	-176.7	167.5	-18.1	0	0	108.9	Y173 F243 N314	Y173-Q241 WeakPolarHBondContact CB-O 3.41Å; Y173-Q241 HydrophobicContact CD1-CB 4.15Å; Y173-Q241 HydrophobicContact CD1-CG 3.72Å; Y173-Q241 HydrophobicContact CG-CG 4.27Å; Y173-Q241 PolarHBondContact N-O 3.31Å; Q241-F243 WeakPolarHBondContact CG-O 3.43Å; Q241-F243 PolarHBondContact NE2-O 3.4Å; Q241-N314 HydrophobicContact CB-CB 3.94Å; Q241-N314 HydrophobicContact CG-CB 4.24Å
242	G	96.9	Very high	98.5	Very high	1 Å²	1	19.5 Å²	19.5	1%	0.01	12%	0.115	C	C	.	.			trans	-92.5	-28.1	-177.3	0	0	0	0	0	115	T171 S172 S201	T171-G242 WeakPolarHBondContact CB-O 3.32Å; T171-G242 PolarHBondContact OG1-O 2.97Å; S172-G242 CarbonylContact C-O 3.55Å; S201-G242 WeakPolarHBondContact OG-CA 3.49Å
243	F	98.3	Very high	98.5	Very high	31 Å²	31	17.7 Å²	17.7	14%	0.136	11%	0.105	C	C	.	.	S	Bend	trans	-135.4	144.1	-169.2	-64.4	-93.9	0	0	0	110.7	T171 R203 Y234 Q241	T171-F243 HydrophobicContact CG2-CE1 3.94Å; T171-F243 HydrophobicContact CG2-CZ 3.86Å; T171-F243 WeakPolarHBondContact OG1-CE2 3.46Å; T171-F243 VanDerWaalsContact OG1-CZ 3.29Å; T171-F243 WeakPolarHBondContact OG1-CZ 3.25Å; R203-F243 HydrophobicContact CB-CZ 4.15Å; Y234-F243 HydrophobicContact CD1-CD2 4.36Å; Y234-F243 AromaticContact CD1-CE2 3.63Å; Y234-F243 HydrophobicContact CD1-CE2 3.63Å; Y234-F243 HydrophobicContact CD1-CZ 4.07Å; Y234-F243 HydrophobicContact CE1-CD2 4.39Å; Y234-F243 AromaticContact CE1-CE2 3.73Å; Y234-F243 HydrophobicContact CE1-CE2 3.73Å; Y234-F243 AromaticContact CE1-CZ 3.81Å; Y234-F243 HydrophobicContact CE1-CZ 3.81Å; Q241-F243 WeakPolarHBondContact CG-O 3.43Å; Q241-F243 PolarHBondContact NE2-O 3.4Å
244	A	98.4	Very high	98.5	Very high	2 Å²	2	17.7 Å²	17.7	2%	0.017	11%	0.105	C	C	.	.			trans	-68.8	162.9	170.6	0	0	0	0	0	110.8	Y173 R178 H246 N282	Y173-A244 HydrophobicContact CD2-CB 3.68Å; Y173-A244 HydrophobicContact CE2-CB 3.46Å; Y173-A244 VanDerWaalsContact CE2-CB 3.46Å; R178-A244 HydrophobicContact CB-CB 3.99Å; A244-H246 PolarHBondContact O-N 2.92Å; A244-H246 PolarHBondContact O-ND1 3.5Å; A244-N282 HydrophobicContact CB-CB 3.69Å
245	P	98.6	Very high	98.5	Very high	0 Å²	0	16.6 Å²	16.6	0%	0	10%	0.101	C	C	.	.	S	Bend	trans	-55.3	131	167.1	-19.2	27.2	0	0	0	112.2	F283 I288 I310 H311 Q312	P245-F283 HydrophobicContact CB-CB 4.31Å; P245-F283 WeakPolarHBondContact CD-O 3.27Å; P245-F283 PolarHBondContact O-N 2.97Å; P245-I288 HydrophobicContact CB-CD1 3.78Å; P245-I288 HydrophobicContact CB-CG2 3.99Å; P245-I288 HydrophobicContact CG-CD1 3.74Å; P245-I310 HydrophobicContact CB-CG2 4.11Å; P245-H311 WeakPolarHBondContact CA-O 3.28Å; P245-Q312 HydrophobicContact CB-CB 4.35Å; P245-Q312 HydrophobicContact CG-CB 4.23Å; P245-Q312 HydrophobicContact CG-CG 4.5Å
246	H	98.8	Very high	98.5	Very high	29 Å²	29	16.6 Å²	16.6	13%	0.134	10%	0.101	C	C	.	.	B	Isolated β-bridge	trans	-157.6	169.3	177.8	59.6	-71.9	0	0	0	110.7	A244 D248 S280 I310 H311	A244-H246 PolarHBondContact O-N 2.92Å; A244-H246 PolarHBondContact O-ND1 3.5Å; H246-D248 IonicContact CD2-OD1 2.69Å; H246-D248 PolarHBondContact CD2-OD1 3.03Å; H246-D248 IonicContact NE2-OD1 3.75Å; H246-S280 WeakPolarHBondContact CA-OG 3.11Å; H246-S280 WeakPolarHBondContact CB-OG 3.44Å; H246-I310 CarbonylContact O-C 3.55Å; H246-I310 VanDerWaalsContact O-CA 3.26Å; H246-I310 WeakPolarHBondContact O-CA 3.18Å; H246-H311 AromaticContact CE1-NE2 3.7Å; H246-H311 PolarHBondContact N-O 2.82Å; H246-H311 AromaticContact NE2-CE1 3.98Å; H246-H311 AromaticContact NE2-NE2 3.54Å; H246-H311 PolarHBondContact O-N 3.4Å; H246-H311 PolarHBondContact O-ND1 2.87Å
247	Y	98.7	Very high	98.5	Very high	26 Å²	26	17.4 Å²	17.4	10%	0.102	11%	0.105	C	C	.	.			trans	-119.6	152.3	161.7	64.1	-113.9	0	0	0	110.1	E273 P276 L278 S280 F283 I310	Y247-E273 HydrophobicContact CE1-CB 4.24Å; Y247-E273 HydrophobicContact CE1-CG 4.06Å; Y247-P276 HydrophobicContact CD2-CB 4.5Å; Y247-P276 HydrophobicContact CD2-CG 3.65Å; Y247-P276 HydrophobicContact CE2-CB 3.82Å; Y247-P276 HydrophobicContact CE2-CG 3.45Å; Y247-P276 VanDerWaalsContact CE2-CG 3.45Å; Y247-L278 WeakPolarHBondContact CE2-O 3.49Å; Y247-S280 VanDerWaalsContact CE1-CB 3.46Å; Y247-S280 VanDerWaalsContact CE2-N 3.32Å; Y247-S280 PolarHBondContact N-OG 3.08Å; Y247-S280 PolarHBondContact O-N 3.22Å; Y247-S280 PolarHBondContact O-OG 2.68Å; Y247-F283 AromaticContact CD1-CE2 3.91Å; Y247-F283 HydrophobicContact CD1-CE2 3.91Å; Y247-F283 HydrophobicContact CD1-CZ 4.36Å; Y247-F283 HydrophobicContact CE1-CE2 4Å; Y247-F283 AromaticContact CE1-CZ 3.97Å; Y247-F283 HydrophobicContact CE1-CZ 3.97Å; Y247-I310 HydrophobicContact CD1-CG1 3.79Å
248	D	98.7	Very high	98.5	Very high	40 Å²	40	19.2 Å²	19.2	21%	0.214	11%	0.113	C	C	.	.			trans	-102.1	171.6	176	-59.5	-55.3	0	0	0	112.2	H246 I250 R307 G308 H311	H246-D248 IonicContact CD2-OD1 2.69Å; H246-D248 PolarHBondContact CD2-OD1 3.03Å; H246-D248 IonicContact NE2-OD1 3.75Å; D248-I250 HydrophobicContact CB-CD1 4.15Å; D248-I250 HydrophobicContact CB-CG1 3.99Å; D248-R307 WeakPolarHBondContact O-CB 3.4Å; D248-G308 PolarHBondContact O-N 3.23Å; D248-H311 IonicContact OD2-CE1 3.02Å; D248-H311 PolarHBondContact OD2-CE1 3.02Å; D248-H311 IonicContact OD2-NE2 2.73Å
249	D	98.4	Very high	98.5	Very high	21 Å²	21	17.6 Å²	17.6	11%	0.112	11%	0.107	C	C	.	.	S	Bend	trans	-95.7	17.7	175.2	64	-13.3	0	0	0	113.8	S279 Q330	D249-S279 PolarHBondContact N-OG 3.5Å; D249-S279 PolarHBondContact OD1-OG 3.49Å; D249-Q330 PolarHBondContact OD1-NE2 2.94Å; D249-Q330 PolarHBondContact OD2-NE2 3.35Å
250	I	98.6	Very high	98.5	Very high	20 Å²	20	18.5 Å²	18.5	10%	0.103	10%	0.097	C	C	.	.	S	Bend	trans	-128	157.7	-178.3	55.5	72.1	0	0	0	112.7	D248 A252 R307 Q330	D248-I250 HydrophobicContact CB-CD1 4.15Å; D248-I250 HydrophobicContact CB-CG1 3.99Å; I250-A252 HydrophobicContact CD1-CB 3.66Å; I250-R307 WeakPolarHBondContact O-CA 3.29Å; I250-R307 VanDerWaalsContact O-CB 3.26Å; I250-R307 WeakPolarHBondContact O-CB 3.47Å; I250-R307 PolarHBondContact O-N 3.11Å; I250-Q330 HydrophobicContact CG2-CB 3.68Å; I250-Q330 HydrophobicContact CG2-CG 3.81Å
251	E	98.8	Very high	98.5	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	122.1	167.6	-59.4	-62.9	111.3	0	0	108.6	W129 E130 F304 P306 R307 S327 S328 Y329	W129-E251 HydrophobicContact CH2-CB 3.57Å; W129-E251 HydrophobicContact CH2-CG 3.6Å; W129-E251 HydrophobicContact CZ2-CB 4.25Å; W129-E251 HydrophobicContact CZ2-CG 3.76Å; W129-E251 HydrophobicContact CZ3-CB 3.73Å; W129-E251 HydrophobicContact CZ3-CG 4Å; E130-E251 PolarHBondContact N-OE2 3.46Å; E251-F304 HydrophobicContact CB-CE2 4.25Å; E251-P306 WeakPolarHBondContact OE2-CA 3.41Å; E251-P306 WeakPolarHBondContact OE2-CB 3.26Å; E251-R307 WeakPolarHBondContact OE1-CG 3.41Å; E251-R307 PolarHBondContact OE1-N 2.89Å; E251-R307 IonicContact OE1-NH1 3.22Å; E251-R307 PolarHBondContact OE1-NH1 2.9Å; E251-S327 WeakPolarHBondContact O-CA 3.28Å; E251-S328 PolarHBondContact N-O 2.82Å; E251-S328 PolarHBondContact O-N 3.16Å; E251-S328 VanDerWaalsContact O-N 3.17Å; E251-Y329 HydrophobicContact CG-CG 4.42Å
252	A	98.8	Very high	98.5	Very high	1 Å²	1	17.9 Å²	17.9	1%	0.008	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	131.5	-167.9	0	0	0	0	0	113	I250 F304 F305 T325	I250-A252 HydrophobicContact CD1-CB 3.66Å; A252-F304 VanDerWaalsContact O-CA 3.3Å; A252-F304 WeakPolarHBondContact O-CA 3.4Å; A252-F304 VanDerWaalsContact O-CD2 3.23Å; A252-F304 WeakPolarHBondContact O-CD2 3.44Å; A252-F305 HydrophobicContact CB-CD2 3.92Å; A252-F305 HydrophobicContact CB-CE2 3.5Å; A252-F305 VanDerWaalsContact CB-CE2 3.5Å; A252-F305 HydrophobicContact CB-CZ 3.88Å; A252-F305 PolarHBondContact N-O 3.08Å; A252-F305 VanDerWaalsContact N-O 3.13Å; A252-F305 PolarHBondContact O-N 3.15Å; A252-F305 VanDerWaalsContact O-N 3.13Å; A252-T325 HydrophobicContact CB-CG2 4.1Å
253	F	98.9	Very high	98.6	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	98.4	168.9	-63.3	-91.1	0	0	0	109.4	F112 L115 L116 F124 W129 F225 L302 F304 T325 I326	F112-F253 HydrophobicContact CE2-CE1 4.16Å; F112-F253 AromaticContact CE2-CZ 3.87Å; F112-F253 HydrophobicContact CE2-CZ 3.87Å; F112-F253 HydrophobicContact CZ-CZ 4.28Å; L115-F253 HydrophobicContact CD2-CD1 4.46Å; L116-F253 HydrophobicContact CD2-CE1 4.12Å; F124-F253 HydrophobicContact CE1-CE1 4.28Å; F124-F253 HydrophobicContact CE1-CZ 4.08Å; F124-F253 HydrophobicContact CE2-CE1 4.33Å; F124-F253 AromaticContact CZ-CE1 3.69Å; F124-F253 HydrophobicContact CZ-CE1 3.69Å; F124-F253 AromaticContact CZ-CZ 3.79Å; F124-F253 HydrophobicContact CZ-CZ 3.79Å; W129-F253 HydrophobicContact CE3-CZ 4.45Å; W129-F253 AromaticContact CZ3-CE2 3.9Å; W129-F253 HydrophobicContact CZ3-CE2 3.9Å; W129-F253 AromaticContact CZ3-CZ 3.81Å; W129-F253 HydrophobicContact CZ3-CZ 3.81Å; F225-F253 HydrophobicContact CE1-CE2 4.14Å; F225-F253 HydrophobicContact CE1-CZ 4.27Å; F225-F253 HydrophobicContact CZ-CD2 4.47Å; F225-F253 AromaticContact CZ-CE2 3.63Å; F225-F253 HydrophobicContact CZ-CE2 3.63Å; F225-F253 HydrophobicContact CZ-CZ 4.01Å; F253-L302 HydrophobicContact CB-CD1 4.18Å; F253-L302 HydrophobicContact CD1-CD1 4.39Å; F253-L302 HydrophobicContact CD1-CD2 4.5Å; F253-F304 HydrophobicContact CD1-CB 4.17Å; F253-F304 AromaticContact CD1-CD2 3.79Å; F253-F304 HydrophobicContact CD1-CD2 3.79Å; F253-F304 HydrophobicContact CD1-CG 4.38Å; F253-F304 HydrophobicContact CD2-CD2 4.32Å; F253-F304 HydrophobicContact CE1-CB 4.3Å; F253-F304 AromaticContact CE1-CD2 3.5Å; F253-F304 HydrophobicContact CE1-CD2 3.5Å; F253-F304 HydrophobicContact CE1-CE2 4.19Å; F253-F304 HydrophobicContact CE1-CG 4.15Å; F253-F304 HydrophobicContact CE2-CD2 4.07Å; F253-F304 HydrophobicContact CE2-CE2 4.18Å; F253-F304 HydrophobicContact CG-CD2 4.19Å; F253-F304 AromaticContact CZ-CD2 3.66Å; F253-F304 HydrophobicContact CZ-CD2 3.66Å; F253-F304 AromaticContact CZ-CE2 3.89Å; F253-F304 HydrophobicContact CZ-CE2 3.89Å; F253-T325 CarbonylContact O-C 3.58Å; F253-T325 WeakPolarHBondContact O-CA 3.48Å; F253-I326 HydrophobicContact CB-CB 4.3Å; F253-I326 PolarHBondContact N-O 2.85Å; F253-I326 PolarHBondContact O-N 3.37Å
254	V	98.9	Very high	98.7	Very high	1 Å²	1	19.2 Å²	19.2	1%	0.006	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	115	174.8	178.4	0	0	0	0	109.1	W263 L297 L302 L303 F305 H323 T325	V254-W263 HydrophobicContact CG1-CH2 4.16Å; V254-W263 HydrophobicContact CG1-CZ2 3.61Å; V254-W263 HydrophobicContact CG2-CH2 3.96Å; V254-W263 HydrophobicContact CG2-CZ2 4.27Å; V254-W263 HydrophobicContact CG2-CZ3 4.37Å; V254-L297 HydrophobicContact CG1-CD1 3.9Å; V254-L302 WeakPolarHBondContact O-CA 3.44Å; V254-L303 HydrophobicContact CB-CB 4.15Å; V254-L303 WeakPolarHBondContact CB-O 3.46Å; V254-L303 PolarHBondContact N-O 3.01Å; V254-L303 PolarHBondContact O-N 2.91Å; V254-F305 HydrophobicContact CG2-CE1 3.76Å; V254-F305 HydrophobicContact CG2-CZ 3.96Å; V254-H323 HydrophobicContact CG1-CB 4.35Å; V254-T325 HydrophobicContact CG2-CG2 4.32Å
255	I	98.9	Very high	98.7	Very high	1 Å²	1	19.1 Å²	19.1	1%	0.005	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	109.3	-176.9	-64.4	171.1	0	0	0	108.1	L115 Y144 L147 L257 L302 H323 I324 I326	L115-I255 HydrophobicContact CD1-CD1 3.66Å; L115-I255 HydrophobicContact CD1-CG1 4.14Å; Y144-I255 HydrophobicContact CD1-CG2 3.73Å; Y144-I255 HydrophobicContact CD2-CG2 3.49Å; Y144-I255 VanDerWaalsContact CD2-CG2 3.49Å; Y144-I255 HydrophobicContact CE1-CG2 3.74Å; Y144-I255 HydrophobicContact CE2-CG2 3.5Å; Y144-I255 HydrophobicContact CG-CG2 3.59Å; L147-I255 HydrophobicContact CD2-CD1 4.43Å; L147-I255 HydrophobicContact CD2-CG2 4.15Å; I255-L257 HydrophobicContact CG2-CD2 3.88Å; I255-L257 PolarHBondContact O-N 2.74Å; I255-L302 HydrophobicContact CG1-CD1 3.66Å; I255-H323 VanDerWaalsContact O-CA 3.24Å; I255-H323 WeakPolarHBondContact O-CA 3.41Å; I255-H323 VanDerWaalsContact O-CB 3.23Å; I255-H323 WeakPolarHBondContact O-CB 3.47Å; I255-I324 HydrophobicContact CB-CG2 3.72Å; I255-I324 WeakPolarHBondContact CB-O 3.48Å; I255-I324 HydrophobicContact CD1-CG2 4.28Å; I255-I324 HydrophobicContact CG2-CG2 3.92Å; I255-I324 PolarHBondContact N-O 2.92Å; I255-I324 PolarHBondContact O-N 2.82Å; I255-I326 HydrophobicContact CD1-CD1 3.55Å; I255-I326 HydrophobicContact CD1-CG1 3.91Å
256	Q	98.9	Very high	98.7	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	118.5	-178.4	-171.7	75.6	29.2	0	0	110.3	E258 L297 E298 G300 D301 S321	Q256-E258 PolarHBondContact NE2-O 3.23Å; Q256-L297 HydrophobicContact CB-CB 4.07Å; Q256-L297 HydrophobicContact CG-CB 4.08Å; Q256-E298 WeakPolarHBondContact CB-O 3.28Å; Q256-E298 VanDerWaalsContact CG-O 3.31Å; Q256-E298 WeakPolarHBondContact CG-O 3.26Å; Q256-G300 PolarHBondContact O-N 3.28Å; Q256-D301 PolarHBondContact N-O 3.13Å; Q256-D301 VanDerWaalsContact N-O 3.07Å; Q256-S321 PolarHBondContact NE2-OG 2.99Å
257	L	98.8	Very high	98.6	Very high	18 Å²	18	24.4 Å²	24.4	9%	0.094	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	-44.9	-172.9	-60.5	174.7	0	0	0	112.3	Y144 L147 F148 I255 A299 L322 I324	Y144-L257 HydrophobicContact CG-CD2 4.41Å; L147-L257 HydrophobicContact CB-CD2 4.29Å; L147-L257 HydrophobicContact CD2-CD2 4.1Å; L147-L257 HydrophobicContact CG-CD2 4.44Å; F148-L257 HydrophobicContact CB-CD1 3.84Å; I255-L257 HydrophobicContact CG2-CD2 3.88Å; I255-L257 PolarHBondContact O-N 2.74Å; L257-A299 WeakPolarHBondContact O-CB 3.31Å; L257-L322 HydrophobicContact CB-CB 4.41Å; L257-L322 HydrophobicContact CB-CD2 4.12Å; L257-L322 HydrophobicContact CB-CG 4.24Å; L257-L322 WeakPolarHBondContact CB-O 3.45Å; L257-L322 HydrophobicContact CD1-CD2 4.06Å; L257-L322 HydrophobicContact CD1-CG 4.15Å; L257-L322 PolarHBondContact N-O 3Å; L257-I324 HydrophobicContact CD1-CB 3.97Å; L257-I324 HydrophobicContact CD1-CG2 3.81Å; L257-I324 HydrophobicContact CD2-CG2 4.06Å; L257-I324 HydrophobicContact CG-CG2 4.08Å
258	E	98.7	Very high	98.5	Very high	45 Å²	45	24.3 Å²	24.3	21%	0.21	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	151.8	-179	-54.6	174.6	-171.5	0	0	111	S149 T150 Q256 H320 S321 L322	S149-E258 VanDerWaalsContact CA-OE1 3.27Å; S149-E258 WeakPolarHBondContact CA-OE1 3.43Å; S149-E258 WeakPolarHBondContact CB-OE1 3.16Å; T150-E258 WeakPolarHBondContact CB-OE2 3.31Å; T150-E258 PolarHBondContact N-OE1 3.37Å; T150-E258 VanDerWaalsContact OG1-CD 3.32Å; T150-E258 PolarHBondContact OG1-OE1 2.84Å; T150-E258 PolarHBondContact OG1-OE2 2.79Å; Q256-E258 PolarHBondContact NE2-O 3.23Å; E258-H320 IonicContact OE2-CE1 3.77Å; E258-H320 IonicContact OE2-NE2 2.84Å; E258-H320 PolarHBondContact OE2-NE2 3.4Å; E258-S321 WeakPolarHBondContact O-CA 3.21Å; E258-L322 HydrophobicContact CB-CB 3.79Å; E258-L322 HydrophobicContact CG-CB 4.03Å; E258-L322 HydrophobicContact CG-CD2 3.98Å; E258-L322 PolarHBondContact N-O 3.31Å; E258-L322 PolarHBondContact O-N 3Å; E258-L322 WeakPolarHBondContact OE1-CD2 3.34Å
259	G	98.1	Very high	98.4	Very high	25 Å²	25	27.2 Å²	27.2	26%	0.258	13%	0.127	S	C	.	.	E	Extended strand (participates in β ladder)	trans	61.6	-147.8	173	0	0	0	0	0	113.4	A299 H320	G259-A299 PolarHBondContact O-N 3.05Å; G259-H320 CarbonylContact C-O 3.51Å; G259-H320 VanDerWaalsContact CA-O 3.26Å; G259-H320 WeakPolarHBondContact CA-O 3.37Å
260	K	98.1	Very high	98.3	Very high	69 Å²	69	29.2 Å²	29.2	30%	0.3	14%	0.143	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	139.9	-172.5	-55.2	-168.4	-176.9	-160.5	0	112.4	V296 L297 E298 L316 A319 H320	K260-V296 HydrophobicContact CB-CG1 4.02Å; K260-V296 HydrophobicContact CD-CG1 4.38Å; K260-L297 VanDerWaalsContact CA-O 3.28Å; K260-L297 WeakPolarHBondContact CA-O 3.29Å; K260-E298 HydrophobicContact CD-CG 4.04Å; K260-E298 WeakPolarHBondContact CE-OE1 3.44Å; K260-E298 HydrophobicContact CG-CG 4.07Å; K260-E298 VanDerWaalsContact NZ-CD 3.3Å; K260-E298 IonicContact NZ-OE1 2.7Å; K260-E298 PolarHBondContact NZ-OE1 2.86Å; K260-E298 IonicContact NZ-OE2 3.41Å; K260-E298 PolarHBondContact NZ-OE2 2.85Å; K260-L316 HydrophobicContact CB-CD1 3.95Å; K260-L316 HydrophobicContact CD-CD1 4.13Å; K260-A319 HydrophobicContact CB-CB 4.28Å; K260-A319 HydrophobicContact CG-CB 4.41Å; K260-H320 PolarHBondContact N-O 3.1Å
261	K	98.6	Very high	98.2	Very high	8 Å²	8	36.3 Å²	36.3	4%	0.035	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	131.1	174.5	-170.8	165.7	-89.5	-175.1	0	111.3	T236 W263 V296 L297 S321	T236-K261 PolarHBondContact OG1-NZ 2.83Å; K261-W263 HydrophobicContact CD-CZ2 4.06Å; K261-V296 WeakPolarHBondContact O-CA 3.47Å; K261-L297 PolarHBondContact N-O 3.07Å; K261-L297 PolarHBondContact O-N 3.43Å; K261-S321 WeakPolarHBondContact CB-OG 3.46Å; K261-S321 WeakPolarHBondContact CE-OG 3.11Å
262	H	98.8	Very high	98	Very high	38 Å²	38	39.7 Å²	39.7	18%	0.176	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	118.1	173	177.6	-143.9	0	0	0	109.2	D294 V295 V296 G313 N314	H262-D294 IonicContact CD2-OD1 3.09Å; H262-D294 IonicContact CE1-OD1 3.13Å; H262-D294 IonicContact NE2-OD1 3.62Å; H262-D294 PolarHBondContact NE2-OD1 3.45Å; H262-D294 IonicContact NE2-OD2 2.59Å; H262-V295 PolarHBondContact CD2-O 2.93Å; H262-V296 HydrophobicContact CB-CG2 4.42Å; H262-G313 CarbonylContact O-C 3.58Å; H262-G313 WeakPolarHBondContact O-CA 3.37Å; H262-N314 WeakPolarHBondContact CB-O 3.36Å; H262-N314 PolarHBondContact N-O 3.31Å; H262-N314 PolarHBondContact ND1-OD1 2.96Å; H262-N314 PolarHBondContact O-N 2.91Å
263	W	98.8	Very high	97.8	Very high	12 Å²	12	40.7 Å²	40.7	5%	0.045	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	134.8	-178.5	-79.2	88.1	0	0	0	111.4	V254 K261 D294 V295 L297 L303 F305 H311 H323	V254-W263 HydrophobicContact CG1-CH2 4.16Å; V254-W263 HydrophobicContact CG1-CZ2 3.61Å; V254-W263 HydrophobicContact CG2-CH2 3.96Å; V254-W263 HydrophobicContact CG2-CZ2 4.27Å; V254-W263 HydrophobicContact CG2-CZ3 4.37Å; K261-W263 HydrophobicContact CD-CZ2 4.06Å; W263-D294 WeakPolarHBondContact O-CA 3.26Å; W263-V295 HydrophobicContact CB-CG2 4.41Å; W263-V295 PolarHBondContact N-O 2.88Å; W263-V295 PolarHBondContact O-N 3.29Å; W263-L297 HydrophobicContact CD2-CD1 4.29Å; W263-L297 HydrophobicContact CG-CD1 3.78Å; W263-L297 HydrophobicContact CG-CG 4.5Å; W263-L297 VanDerWaalsContact NE1-CD1 3.31Å; W263-L303 HydrophobicContact CB-CD2 4.01Å; W263-L303 HydrophobicContact CD2-CD2 4.08Å; W263-L303 HydrophobicContact CE3-CD2 4.08Å; W263-L303 HydrophobicContact CG-CD2 4.07Å; W263-F305 HydrophobicContact CZ3-CE1 4.4Å; W263-F305 HydrophobicContact CZ3-CZ 4.43Å; W263-H311 HydrophobicContact CZ3-CB 4.36Å; W263-H311 AromaticContact CZ3-CD2 3.67Å; W263-H323 AromaticContact CH2-NE2 3.99Å; W263-H323 AromaticContact CZ2-CE1 3.61Å; W263-H323 AromaticContact CZ2-NE2 3.63Å
264	R	98.8	Very high	97.8	Very high	48 Å²	48	44 Å²	44	18%	0.181	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	124.6	172.6	-73.1	168.6	-77.2	158.7	0.3	108.9	Y266 P291 L293 D294 H311 Q312 N314	R264-Y266 HydrophobicContact CB-CE2 3.67Å; R264-Y266 WeakPolarHBondContact O-CE2 3.33Å; R264-P291 HydrophobicContact CB-CB 4.15Å; R264-P291 HydrophobicContact CG-CB 4.36Å; R264-P291 HydrophobicContact CG-CG 4.49Å; R264-L293 CarbonylContact C-O 3.5Å; R264-L293 WeakPolarHBondContact CA-O 3.3Å; R264-D294 HydrophobicContact CG-CB 4.36Å; R264-H311 CarbonylContact O-C 3.57Å; R264-H311 VanDerWaalsContact O-CA 3.28Å; R264-H311 WeakPolarHBondContact O-CA 3.25Å; R264-Q312 HydrophobicContact CB-CG 4.06Å; R264-Q312 PolarHBondContact N-O 2.85Å; R264-Q312 PolarHBondContact O-N 3.04Å; R264-N314 PolarHBondContact NH2-OD1 3.31Å
265	V	98.8	Very high	97.8	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	137.4	178.7	-174.4	0	0	0	0	109.4	P133 P291 I292 L293 L303 F305 F309 I310 H311	P133-V265 HydrophobicContact CB-CG1 4.39Å; V265-P291 CarbonylContact O-C 3.52Å; V265-P291 WeakPolarHBondContact O-CA 3.14Å; V265-I292 VanDerWaalsContact O-CG1 3.26Å; V265-I292 WeakPolarHBondContact O-CG1 3.5Å; V265-I292 PolarHBondContact O-N 3.34Å; V265-L293 HydrophobicContact CB-CB 4.23Å; V265-L293 HydrophobicContact CG2-CD2 4.23Å; V265-L293 PolarHBondContact N-O 2.96Å; V265-L293 PolarHBondContact O-N 2.96Å; V265-L303 HydrophobicContact CG2-CD1 4.44Å; V265-L303 HydrophobicContact CG2-CD2 3.98Å; V265-F305 HydrophobicContact CG1-CB 4.27Å; V265-F305 HydrophobicContact CG1-CG 4.47Å; V265-F305 HydrophobicContact CG2-CD1 4.13Å; V265-F309 HydrophobicContact CG1-CB 4Å; V265-F309 HydrophobicContact CG1-CD1 4.13Å; V265-I310 CarbonylContact C-O 3.51Å; V265-I310 WeakPolarHBondContact CA-O 3.43Å; V265-H311 HydrophobicContact CG2-CB 4.31Å
266	Y	98.7	Very high	97.7	Very high	6 Å²	6	47.1 Å²	47.1	2%	0.024	25%	0.252	C	S	.	.			trans	-125.8	153.1	-172.8	-50.4	-108.1	0	0	0	109.2	R264 I288 G289 K290 P291 F309 I310 Q312	R264-Y266 HydrophobicContact CB-CE2 3.67Å; R264-Y266 WeakPolarHBondContact O-CE2 3.33Å; Y266-I288 HydrophobicContact CD1-CB 4.31Å; Y266-I288 HydrophobicContact CD1-CG1 4.24Å; Y266-I288 WeakPolarHBondContact CD1-O 3.41Å; Y266-I288 HydrophobicContact CE1-CB 4.43Å; Y266-I288 HydrophobicContact CE1-CD1 3.93Å; Y266-I288 HydrophobicContact CE1-CG1 3.86Å; Y266-I288 HydrophobicContact CE2-CD1 3.92Å; Y266-G289 WeakPolarHBondContact CE1-O 3.43Å; Y266-K290 VanDerWaalsContact CD1-C 3.42Å; Y266-K290 WeakPolarHBondContact CD1-O 3.39Å; Y266-P291 VanDerWaalsContact CD1-CA 3.5Å; Y266-P291 HydrophobicContact CD1-CB 4.14Å; Y266-P291 HydrophobicContact CE1-CB 3.81Å; Y266-P291 HydrophobicContact CE1-CG 4.25Å; Y266-P291 VanDerWaalsContact CE1-N 3.29Å; Y266-P291 HydrophobicContact CE2-CB 4.41Å; Y266-F309 WeakPolarHBondContact O-CA 3.41Å; Y266-F309 VanDerWaalsContact O-CD1 3.27Å; Y266-F309 WeakPolarHBondContact O-CD1 3.24Å; Y266-I310 HydrophobicContact CD2-CB 4.4Å; Y266-I310 HydrophobicContact CD2-CG2 4.14Å; Y266-I310 WeakPolarHBondContact CD2-O 3.45Å; Y266-I310 PolarHBondContact N-O 3.44Å; Y266-I310 PolarHBondContact O-N 2.89Å; Y266-Q312 HydrophobicContact CE2-CG 4.18Å; Y266-Q312 PolarHBondContact OH-NE2 2.99Å
267	K	97	Very high	97.6	Very high	134 Å²	134	52 Å²	52	58%	0.583	28%	0.281	S	S	*	.			trans	-70.3	155.3	172.8	-73.1	176.6	174.1	178.9	0	110.4	R269 I292 F309	K267-R269 PolarHBondContact O-N 2.81Å; K267-I292 HydrophobicContact CD-CG2 3.96Å; K267-I292 HydrophobicContact CG-CD1 3.74Å; K267-I292 HydrophobicContact CG-CG1 4.24Å; K267-I292 HydrophobicContact CG-CG2 3.78Å; K267-F309 HydrophobicContact CG-CE1 4.28Å
268	P	97.3	Very high	97.5	Very high	23 Å²	23	56.9 Å²	56.9	15%	0.149	31%	0.307	C	S	.	.			trans	-46.1	135.6	160.9	-28.1	35.2	0	0	0	111.3	S270 E273 V274 F309	P268-S270 VanDerWaalsContact C-N 3.29Å; P268-S270 PolarHBondContact O-N 3.25Å; P268-E273 HydrophobicContact CB-CB 3.91Å; P268-V274 HydrophobicContact CB-CG2 3.8Å; P268-V274 HydrophobicContact CG-CG2 3.99Å; P268-F309 HydrophobicContact CG-CD2 4.46Å; P268-F309 HydrophobicContact CG-CE2 4.45Å
269	R	96.3	Very high	97.5	Very high	101 Å²	101	57.3 Å²	57.3	38%	0.381	32%	0.315	S	S	.	.	S	Bend	trans	-76.9	-21	-173.7	-53.8	175.7	-63.7	174.8	4.4	112.2	K267 E273 F283 E287 I310	K267-R269 PolarHBondContact O-N 2.81Å; R269-E273 WeakPolarHBondContact CA-OE2 3.38Å; R269-E273 WeakPolarHBondContact CB-OE2 3.34Å; R269-E273 VanDerWaalsContact CG-OE2 3.3Å; R269-E273 WeakPolarHBondContact CG-OE2 3.13Å; R269-E273 IonicContact CZ-OE1 3.39Å; R269-E273 VanDerWaalsContact CZ-OE1 3.22Å; R269-E273 PolarHBondContact N-OE2 3.47Å; R269-E273 IonicContact NE-OE1 2.96Å; R269-E273 PolarHBondContact NE-OE1 3.01Å; R269-E273 IonicContact NE-OE2 2.71Å; R269-E273 PolarHBondContact NE-OE2 2.69Å; R269-E273 VanDerWaalsContact NE-OE2 3.17Å; R269-E273 IonicContact NH2-OE1 2.64Å; R269-E273 PolarHBondContact NH2-OE1 2.81Å; R269-F283 VanDerWaalsContact NH1-CE1 3.32Å; R269-F283 VanDerWaalsContact NH2-CZ 3.3Å; R269-E287 WeakPolarHBondContact CD-O 3.43Å; R269-E287 IonicContact NH1-OE1 2.67Å; R269-E287 PolarHBondContact NH1-OE1 3.09Å; R269-E287 VanDerWaalsContact NH1-OE1 3.14Å; R269-I310 HydrophobicContact CG-CD1 3.66Å
270	S	96.3	Very high	97.5	Very high	64 Å²	64	57 Å²	57	45%	0.448	31%	0.309	S	S	.	.	S	Bend	trans	-149.6	165.4	176.6	73.8	0	0	0	0	110.8	P268 G272 E273	P268-S270 VanDerWaalsContact C-N 3.29Å; P268-S270 PolarHBondContact O-N 3.25Å; S270-G272 PolarHBondContact O-N 3.18Å; S270-G272 PolarHBondContact OG-N 3.49Å; S270-E273 PolarHBondContact O-N 2.83Å
271	E	96.1	Very high	97.5	Very high	169 Å²	169	58.2 Å²	58.2	79%	0.79	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-56.3	-30.5	174.7	-66.4	-63.3	148.7	0	0	112.9	E273 V274	E271-E273 PolarHBondContact O-N 2.74Å; E271-V274 PolarHBondContact O-N 3.05Å
272	G	93.7	Very high	97.5	Very high	71 Å²	71	61.9 Å²	61.9	73%	0.732	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-71.8	-11.8	177.6	0	0	0	0	0	114.6	S270	S270-G272 PolarHBondContact O-N 3.18Å; S270-G272 PolarHBondContact OG-N 3.49Å
273	E	96.6	Very high	97.4	Very high	22 Å²	22	60.4 Å²	60.4	10%	0.103	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-102.3	0.5	175.5	-64.5	178.1	-176.5	0	0	112.1	Y247 P268 R269 S270 E271 P276	Y247-E273 HydrophobicContact CE1-CB 4.24Å; Y247-E273 HydrophobicContact CE1-CG 4.06Å; P268-E273 HydrophobicContact CB-CB 3.91Å; R269-E273 WeakPolarHBondContact CA-OE2 3.38Å; R269-E273 WeakPolarHBondContact CB-OE2 3.34Å; R269-E273 VanDerWaalsContact CG-OE2 3.3Å; R269-E273 WeakPolarHBondContact CG-OE2 3.13Å; R269-E273 IonicContact CZ-OE1 3.39Å; R269-E273 VanDerWaalsContact CZ-OE1 3.22Å; R269-E273 PolarHBondContact N-OE2 3.47Å; R269-E273 IonicContact NE-OE1 2.96Å; R269-E273 PolarHBondContact NE-OE1 3.01Å; R269-E273 IonicContact NE-OE2 2.71Å; R269-E273 PolarHBondContact NE-OE2 2.69Å; R269-E273 VanDerWaalsContact NE-OE2 3.17Å; R269-E273 IonicContact NH2-OE1 2.64Å; R269-E273 PolarHBondContact NH2-OE1 2.81Å; S270-E273 PolarHBondContact O-N 2.83Å; E271-E273 PolarHBondContact O-N 2.74Å; E273-P276 WeakPolarHBondContact O-CD 3.26Å
274	V	97.9	Very high	97.3	Very high	69 Å²	69	64.3 Å²	64.3	42%	0.418	36%	0.359	S	S	.	.	S	Bend	trans	-78.3	123.3	174.8	178	0	0	0	0	108.2	P268 E271	P268-V274 HydrophobicContact CB-CG2 3.8Å; P268-V274 HydrophobicContact CG-CG2 3.99Å; E271-V274 PolarHBondContact O-N 3.05Å
275	L	98.2	Very high	97.2	Very high	56 Å²	56	65.9 Å²	65.9	29%	0.293	37%	0.368	S	S	.	.	S	Bend	trans	51.3	54.1	-179.1	-58.1	177.2	0	0	0	113.3	E130 P306 R307	E130-L275 HydrophobicContact CB-CD1 4.19Å; E130-L275 HydrophobicContact CB-CD2 3.86Å; E130-L275 HydrophobicContact CG-CD2 4.05Å; L275-P306 HydrophobicContact CD2-CB 4.26Å; L275-R307 HydrophobicContact CB-CG 4.48Å; L275-R307 HydrophobicContact CD2-CG 4.02Å
276	P	97.5	Very high	97.1	Very high	12 Å²	12	70.9 Å²	70.9	8%	0.078	41%	0.409	C	S	.	.			trans	-64.8	154.7	-173.6	31.2	-36.8	0	0	0	111.1	Y247 E273 R307	Y247-P276 HydrophobicContact CD2-CB 4.5Å; Y247-P276 HydrophobicContact CD2-CG 3.65Å; Y247-P276 HydrophobicContact CE2-CB 3.82Å; Y247-P276 HydrophobicContact CE2-CG 3.45Å; Y247-P276 VanDerWaalsContact CE2-CG 3.45Å; E273-P276 WeakPolarHBondContact O-CD 3.26Å; P276-R307 WeakPolarHBondContact O-CD 3.5Å
277	V	96.3	Very high	96.9	Very high	101 Å²	101	74.6 Å²	74.6	61%	0.612	43%	0.427	S	S	*	.	S	Bend	trans	-80.1	-24.9	177.5	-179.1	0	0	0	0	111.8
278	L	97.5	Very high	96.8	Very high	121 Å²	121	68.6 Å²	68.6	63%	0.634	40%	0.401	S	S	*	.	S	Bend	trans	-135.1	149.7	-174.8	-61.5	174.7	0	0	0	110.3	Y247	Y247-L278 WeakPolarHBondContact CE2-O 3.49Å
279	S	98.2	Very high	96.6	Very high	55 Å²	55	70.2 Å²	70.2	39%	0.385	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-61.9	154.5	175.3	-53.3	0	0	0	0	112.3	D249	D249-S279 PolarHBondContact N-OG 3.5Å; D249-S279 PolarHBondContact OD1-OG 3.49Å
280	S	98.4	Very high	96.6	Very high	19 Å²	19	74.3 Å²	74.3	13%	0.133	44%	0.443	C	S	.	.	P	Polyproline II helix	trans	-76.3	161.2	178.8	78.5	0	0	0	0	112.3	H246 Y247 F283	H246-S280 WeakPolarHBondContact CA-OG 3.11Å; H246-S280 WeakPolarHBondContact CB-OG 3.44Å; Y247-S280 VanDerWaalsContact CE1-CB 3.46Å; Y247-S280 VanDerWaalsContact CE2-N 3.32Å; Y247-S280 PolarHBondContact N-OG 3.08Å; Y247-S280 PolarHBondContact O-N 3.22Å; Y247-S280 PolarHBondContact O-OG 2.68Å; S280-F283 VanDerWaalsContact OG-CE2 3.32Å; S280-F283 WeakPolarHBondContact OG-CE2 3.37Å
281	P	97.9	Very high	96.7	Very high	93 Å²	93	73.5 Å²	73.5	60%	0.604	44%	0.436	S	S	*	.	P	Polyproline II helix	trans	-64	169.9	153.5	31.6	-35.8	0	0	0	111	F283	P281-F283 HydrophobicContact CG-CE1 4.25Å
282	N	97.9	Very high	96.8	Very high	86 Å²	86	69.1 Å²	69.1	46%	0.46	42%	0.417	S	S	.	.	P	Polyproline II helix	trans	-65.3	134.7	168.4	-64.9	-43.3	0	0	0	110	A244	A244-N282 HydrophobicContact CB-CB 3.69Å
283	F	97.9	Very high	97	Very high	7 Å²	7	67 Å²	67	3%	0.031	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-101.9	152	175.9	-63.1	-57	0	0	0	112.6	P245 Y247 R269 S280 P281 E287 I288 I310	P245-F283 HydrophobicContact CB-CB 4.31Å; P245-F283 WeakPolarHBondContact CD-O 3.27Å; P245-F283 PolarHBondContact O-N 2.97Å; Y247-F283 AromaticContact CD1-CE2 3.91Å; Y247-F283 HydrophobicContact CD1-CE2 3.91Å; Y247-F283 HydrophobicContact CD1-CZ 4.36Å; Y247-F283 HydrophobicContact CE1-CE2 4Å; Y247-F283 AromaticContact CE1-CZ 3.97Å; Y247-F283 HydrophobicContact CE1-CZ 3.97Å; R269-F283 VanDerWaalsContact NH1-CE1 3.32Å; R269-F283 VanDerWaalsContact NH2-CZ 3.3Å; S280-F283 VanDerWaalsContact OG-CE2 3.32Å; S280-F283 WeakPolarHBondContact OG-CE2 3.37Å; P281-F283 HydrophobicContact CG-CE1 4.25Å; F283-E287 WeakPolarHBondContact CA-OE2 3.3Å; F283-E287 HydrophobicContact CB-CB 4.36Å; F283-I288 HydrophobicContact CB-CG2 3.6Å; F283-I288 HydrophobicContact CD2-CG2 4.24Å; F283-I288 HydrophobicContact CG-CG2 4.15Å; F283-I310 HydrophobicContact CD2-CD1 3.87Å; F283-I310 HydrophobicContact CD2-CG1 4.12Å; F283-I310 HydrophobicContact CD2-CG2 4.28Å; F283-I310 HydrophobicContact CE2-CD1 3.73Å; F283-I310 HydrophobicContact CE2-CG1 3.88Å
284	D	97.1	Very high	97.1	Very high	94 Å²	94	70.1 Å²	70.1	50%	0.503	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-82.1	155.3	166.7	-68.5	-33.6	0	0	0	111.3	A286 E287	D284-A286 PolarHBondContact O-N 3.31Å; D284-A286 VanDerWaalsContact O-N 3.1Å; D284-E287 HydrophobicContact CB-CG 4.29Å; D284-E287 PolarHBondContact N-OE2 3.29Å; D284-E287 WeakPolarHBondContact O-CB 3.34Å; D284-E287 PolarHBondContact O-N 3.01Å
285	Q	95.9	Very high	97.1	Very high	81 Å²	81	68.1 Å²	68.1	38%	0.379	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-28.8	178.7	-62	-63.9	-36	0	0	112.9	E287	Q285-E287 PolarHBondContact O-N 3.23Å
286	A	95.6	Very high	97.2	Very high	104 Å²	104	67.8 Å²	67.8	86%	0.86	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-18.5	177.6	0	0	0	0	0	113.2	D284	D284-A286 PolarHBondContact O-N 3.31Å; D284-A286 VanDerWaalsContact O-N 3.1Å
287	E	95.5	Very high	97.2	Very high	84 Å²	84	67.2 Å²	67.2	39%	0.393	39%	0.39	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-22.1	-173.2	-64.4	-174.9	79.7	0	0	114.5	R269 F283 D284 Q285	R269-E287 WeakPolarHBondContact CD-O 3.43Å; R269-E287 IonicContact NH1-OE1 2.67Å; R269-E287 PolarHBondContact NH1-OE1 3.09Å; R269-E287 VanDerWaalsContact NH1-OE1 3.14Å; F283-E287 WeakPolarHBondContact CA-OE2 3.3Å; F283-E287 HydrophobicContact CB-CB 4.36Å; D284-E287 HydrophobicContact CB-CG 4.29Å; D284-E287 PolarHBondContact N-OE2 3.29Å; D284-E287 WeakPolarHBondContact O-CB 3.34Å; D284-E287 PolarHBondContact O-N 3.01Å; Q285-E287 PolarHBondContact O-N 3.23Å
288	I	94.1	Very high	97.3	Very high	8 Å²	8	66.2 Å²	66.2	4%	0.041	38%	0.379	C	S	.	.	S	Bend	trans	-98.2	-8.2	-162.8	65.9	-179.2	0	0	0	114.2	P245 Y266 F283 I310	P245-I288 HydrophobicContact CB-CD1 3.78Å; P245-I288 HydrophobicContact CB-CG2 3.99Å; P245-I288 HydrophobicContact CG-CD1 3.74Å; Y266-I288 HydrophobicContact CD1-CB 4.31Å; Y266-I288 HydrophobicContact CD1-CG1 4.24Å; Y266-I288 WeakPolarHBondContact CD1-O 3.41Å; Y266-I288 HydrophobicContact CE1-CB 4.43Å; Y266-I288 HydrophobicContact CE1-CD1 3.93Å; Y266-I288 HydrophobicContact CE1-CG1 3.86Å; Y266-I288 HydrophobicContact CE2-CD1 3.92Å; F283-I288 HydrophobicContact CB-CG2 3.6Å; F283-I288 HydrophobicContact CD2-CG2 4.24Å; F283-I288 HydrophobicContact CG-CG2 4.15Å; I288-I310 HydrophobicContact CB-CD1 4.5Å; I288-I310 HydrophobicContact CB-CG2 4.23Å; I288-I310 HydrophobicContact CG2-CD1 4.16Å; I288-I310 HydrophobicContact CG2-CG2 3.85Å
289	G	93.9	Very high	97.4	Very high	57 Å²	57	61.3 Å²	61.3	59%	0.588	36%	0.356	S	S	*	.			trans	70.2	-146.5	176.2	0	0	0	0	0	114.1	Y266	Y266-G289 WeakPolarHBondContact CE1-O 3.43Å
290	K	96.9	Very high	97.4	Very high	187 Å²	187	58.7 Å²	58.7	81%	0.813	34%	0.338	S	S	*	.	S	Bend	trans	-96.8	137.1	-178.7	-68.5	-174.9	178.9	-176.5	0	111	Y266	Y266-K290 VanDerWaalsContact CD1-C 3.42Å; Y266-K290 WeakPolarHBondContact CD1-O 3.39Å
291	P	98.1	Very high	97.4	Very high	47 Å²	47	57.9 Å²	57.9	31%	0.305	33%	0.332	S	S	.	.			trans	-65.2	144.9	176.2	28.3	-33.1	0	0	0	110.2	R264 V265 Y266 D294	R264-P291 HydrophobicContact CB-CB 4.15Å; R264-P291 HydrophobicContact CG-CB 4.36Å; R264-P291 HydrophobicContact CG-CG 4.49Å; V265-P291 CarbonylContact O-C 3.52Å; V265-P291 WeakPolarHBondContact O-CA 3.14Å; Y266-P291 VanDerWaalsContact CD1-CA 3.5Å; Y266-P291 HydrophobicContact CD1-CB 4.14Å; Y266-P291 HydrophobicContact CE1-CB 3.81Å; Y266-P291 HydrophobicContact CE1-CG 4.25Å; Y266-P291 VanDerWaalsContact CE1-N 3.29Å; Y266-P291 HydrophobicContact CE2-CB 4.41Å; P291-D294 HydrophobicContact CB-CB 4.39Å; P291-D294 HydrophobicContact CG-CB 4.21Å
292	I	98.1	Very high	97.4	Very high	77 Å²	77	53.4 Å²	53.4	40%	0.395	30%	0.303	S	S	.	.	S	Bend	trans	-94.9	-14.6	170.6	58.3	152.8	0	0	0	112.4	P133 V265 K267 F309	P133-I292 HydrophobicContact CG-CD1 3.65Å; V265-I292 VanDerWaalsContact O-CG1 3.26Å; V265-I292 WeakPolarHBondContact O-CG1 3.5Å; V265-I292 PolarHBondContact O-N 3.34Å; K267-I292 HydrophobicContact CD-CG2 3.96Å; K267-I292 HydrophobicContact CG-CD1 3.74Å; K267-I292 HydrophobicContact CG-CG1 4.24Å; K267-I292 HydrophobicContact CG-CG2 3.78Å; I292-F309 HydrophobicContact CD1-CD1 4.15Å; I292-F309 HydrophobicContact CD1-CE1 3.82Å
293	L	98.1	Very high	97.5	Very high	26 Å²	26	49.3 Å²	49.3	14%	0.136	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	127.1	173.7	-174.3	149.6	0	0	0	107.4	P133 R264 V265 V295 L303	P133-L293 HydrophobicContact CB-CD1 4.37Å; P133-L293 HydrophobicContact CG-CD1 4.5Å; R264-L293 CarbonylContact C-O 3.5Å; R264-L293 WeakPolarHBondContact CA-O 3.3Å; V265-L293 HydrophobicContact CB-CB 4.23Å; V265-L293 HydrophobicContact CG2-CD2 4.23Å; V265-L293 PolarHBondContact N-O 2.96Å; V265-L293 PolarHBondContact O-N 2.96Å; L293-V295 HydrophobicContact CD2-CB 4.23Å; L293-V295 HydrophobicContact CD2-CG1 3.79Å; L293-V295 HydrophobicContact CD2-CG2 3.51Å; L293-V295 HydrophobicContact CG-CG1 4.05Å; L293-L303 HydrophobicContact CD1-CD1 4.1Å; L293-L303 HydrophobicContact CD2-CD1 3.91Å
294	D	98.4	Very high	97.5	Very high	89 Å²	89	49 Å²	49	48%	0.476	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	99.3	-174.6	-170.8	-36.8	0	0	0	106.7	H262 W263 R264 P291	H262-D294 IonicContact CD2-OD1 3.09Å; H262-D294 IonicContact CE1-OD1 3.13Å; H262-D294 IonicContact NE2-OD1 3.62Å; H262-D294 PolarHBondContact NE2-OD1 3.45Å; H262-D294 IonicContact NE2-OD2 2.59Å; W263-D294 WeakPolarHBondContact O-CA 3.26Å; R264-D294 HydrophobicContact CG-CB 4.36Å; P291-D294 HydrophobicContact CB-CB 4.39Å; P291-D294 HydrophobicContact CG-CB 4.21Å
295	V	98.4	Very high	97.6	Very high	27 Å²	27	44.9 Å²	44.9	16%	0.164	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	155.8	-168.1	-57.6	0	0	0	0	111.4	Y135 H262 W263 L293	Y135-V295 HydrophobicContact CD1-CB 4.37Å; Y135-V295 HydrophobicContact CD1-CG1 3.87Å; Y135-V295 HydrophobicContact CD2-CG2 4.42Å; Y135-V295 HydrophobicContact CE1-CB 4.28Å; Y135-V295 HydrophobicContact CE1-CG1 4.12Å; Y135-V295 HydrophobicContact CG-CG1 4.4Å; Y135-V295 HydrophobicContact CG-CG2 4.38Å; H262-V295 PolarHBondContact CD2-O 2.93Å; W263-V295 HydrophobicContact CB-CG2 4.41Å; W263-V295 PolarHBondContact N-O 2.88Å; W263-V295 PolarHBondContact O-N 3.29Å; L293-V295 HydrophobicContact CD2-CB 4.23Å; L293-V295 HydrophobicContact CD2-CG1 3.79Å; L293-V295 HydrophobicContact CD2-CG2 3.51Å; L293-V295 HydrophobicContact CG-CG1 4.05Å
296	V	98.6	Very high	97.7	Very high	48 Å²	48	41 Å²	41	29%	0.291	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	115.7	166.2	178.5	0	0	0	0	107.8	K260 K261 H262 L316	K260-V296 HydrophobicContact CB-CG1 4.02Å; K260-V296 HydrophobicContact CD-CG1 4.38Å; K261-V296 WeakPolarHBondContact O-CA 3.47Å; H262-V296 HydrophobicContact CB-CG2 4.42Å; V296-L316 HydrophobicContact CG1-CD1 3.85Å; V296-L316 HydrophobicContact CG2-CD1 4.45Å
297	L	98.7	Very high	97.8	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	131.3	170.3	-76.4	168.3	0	0	0	109.1	Y135 V254 Q256 K260 K261 W263 D301 L303	Y135-L297 HydrophobicContact CD2-CD2 3.81Å; Y135-L297 HydrophobicContact CE2-CD2 3.57Å; V254-L297 HydrophobicContact CG1-CD1 3.9Å; Q256-L297 HydrophobicContact CB-CB 4.07Å; Q256-L297 HydrophobicContact CG-CB 4.08Å; K260-L297 VanDerWaalsContact CA-O 3.28Å; K260-L297 WeakPolarHBondContact CA-O 3.29Å; K261-L297 PolarHBondContact N-O 3.07Å; K261-L297 PolarHBondContact O-N 3.43Å; W263-L297 HydrophobicContact CD2-CD1 4.29Å; W263-L297 HydrophobicContact CG-CD1 3.78Å; W263-L297 HydrophobicContact CG-CG 4.5Å; W263-L297 VanDerWaalsContact NE1-CD1 3.31Å; L297-D301 HydrophobicContact CD2-CB 3.44Å; L297-D301 VanDerWaalsContact CD2-CB 3.44Å; L297-L303 HydrophobicContact CD1-CB 3.81Å; L297-L303 HydrophobicContact CD1-CD2 4.1Å; L297-L303 HydrophobicContact CD2-CB 4.14Å
298	E	98.5	Very high	98	Very high	80 Å²	80	33 Å²	33	37%	0.374	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	162.7	169.9	-53.5	-164.5	177.5	0	0	110.2	Q256 K260 G300 D301	Q256-E298 WeakPolarHBondContact CB-O 3.28Å; Q256-E298 VanDerWaalsContact CG-O 3.31Å; Q256-E298 WeakPolarHBondContact CG-O 3.26Å; K260-E298 HydrophobicContact CD-CG 4.04Å; K260-E298 WeakPolarHBondContact CE-OE1 3.44Å; K260-E298 HydrophobicContact CG-CG 4.07Å; K260-E298 VanDerWaalsContact NZ-CD 3.3Å; K260-E298 IonicContact NZ-OE1 2.7Å; K260-E298 PolarHBondContact NZ-OE1 2.86Å; K260-E298 IonicContact NZ-OE2 3.41Å; K260-E298 PolarHBondContact NZ-OE2 2.85Å; E298-G300 PolarHBondContact O-N 2.89Å; E298-D301 PolarHBondContact N-OD2 2.91Å; E298-D301 VanDerWaalsContact O-CB 3.25Å; E298-D301 WeakPolarHBondContact O-CB 3.49Å; E298-D301 PolarHBondContact O-N 2.76Å
299	A	98.3	Very high	98.2	Very high	18 Å²	18	33.4 Å²	33.4	15%	0.149	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.6	132.6	178.7	0	0	0	0	0	111.5	P141 L257 G259	P141-A299 WeakPolarHBondContact CA-O 3.32Å; P141-A299 HydrophobicContact CB-CB 4.03Å; L257-A299 WeakPolarHBondContact O-CB 3.31Å; G259-A299 PolarHBondContact O-N 3.05Å
300	G	98.1	Very high	98.4	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.5	-13.2	-176.2	0	0	0	0	0	115.4	R138 N140 Y144 Q256 E298	R138-G300 VanDerWaalsContact CD-O 3.3Å; R138-G300 WeakPolarHBondContact CD-O 3.5Å; R138-G300 WeakPolarHBondContact CG-O 3.33Å; R138-G300 PolarHBondContact NH1-O 3.5Å; N140-G300 WeakPolarHBondContact O-CA 3.45Å; Y144-G300 VanDerWaalsContact CD2-CA 3.47Å; Y144-G300 WeakPolarHBondContact CE2-O 3.47Å; Q256-G300 PolarHBondContact O-N 3.28Å; E298-G300 PolarHBondContact O-N 2.89Å
301	D	98.7	Very high	98.5	Very high	2 Å²	2	22.4 Å²	22.4	1%	0.011	12%	0.121	C	C	.	.			trans	-81.3	153.6	178.8	-70	-9.4	0	0	0	112.9	Y135 V136 Q137 R138 Y144 Q256 L297 E298	Y135-D301 HydrophobicContact CE2-CB 3.97Å; Y135-D301 WeakPolarHBondContact CE2-OD2 3.35Å; Y135-D301 PolarHBondContact OH-OD2 3.07Å; V136-D301 WeakPolarHBondContact O-CA 3.49Å; Q137-D301 WeakPolarHBondContact CA-OD1 3.41Å; R138-D301 PolarHBondContact N-OD1 2.73Å; Y144-D301 WeakPolarHBondContact CE2-O 3.45Å; Q256-D301 PolarHBondContact N-O 3.13Å; Q256-D301 VanDerWaalsContact N-O 3.07Å; L297-D301 HydrophobicContact CD2-CB 3.44Å; L297-D301 VanDerWaalsContact CD2-CB 3.44Å; E298-D301 PolarHBondContact N-OD2 2.91Å; E298-D301 VanDerWaalsContact O-CB 3.25Å; E298-D301 WeakPolarHBondContact O-CB 3.49Å; E298-D301 PolarHBondContact O-N 2.76Å
302	L	98.8	Very high	98.5	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	137.3	174.2	-179.7	77	0	0	0	110.5	L115 L116 V136 F253 V254 I255	L115-L302 HydrophobicContact CD1-CD1 4.19Å; L115-L302 WeakPolarHBondContact O-CD2 3.27Å; L116-L302 HydrophobicContact CD2-CD2 3.97Å; V136-L302 HydrophobicContact CB-CB 4.19Å; V136-L302 HydrophobicContact CG2-CD2 4.45Å; V136-L302 PolarHBondContact N-O 2.71Å; V136-L302 PolarHBondContact O-N 2.98Å; V136-L302 VanDerWaalsContact O-N 3.1Å; F253-L302 HydrophobicContact CB-CD1 4.18Å; F253-L302 HydrophobicContact CD1-CD1 4.39Å; F253-L302 HydrophobicContact CD1-CD2 4.5Å; V254-L302 WeakPolarHBondContact O-CA 3.44Å; I255-L302 HydrophobicContact CG1-CD1 3.66Å
303	L	98.9	Very high	98.5	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	120.5	165.5	171.5	66	0	0	0	109.8	V134 V254 W263 V265 L293 L297 F305	V134-L303 CarbonylContact O-C 3.57Å; V134-L303 WeakPolarHBondContact O-CA 3.17Å; V254-L303 HydrophobicContact CB-CB 4.15Å; V254-L303 WeakPolarHBondContact CB-O 3.46Å; V254-L303 PolarHBondContact N-O 3.01Å; V254-L303 PolarHBondContact O-N 2.91Å; W263-L303 HydrophobicContact CB-CD2 4.01Å; W263-L303 HydrophobicContact CD2-CD2 4.08Å; W263-L303 HydrophobicContact CE3-CD2 4.08Å; W263-L303 HydrophobicContact CG-CD2 4.07Å; V265-L303 HydrophobicContact CG2-CD1 4.44Å; V265-L303 HydrophobicContact CG2-CD2 3.98Å; L293-L303 HydrophobicContact CD1-CD1 4.1Å; L293-L303 HydrophobicContact CD2-CD1 3.91Å; L297-L303 HydrophobicContact CD1-CB 3.81Å; L297-L303 HydrophobicContact CD1-CD2 4.1Å; L297-L303 HydrophobicContact CD2-CB 4.14Å; L303-F305 HydrophobicContact CD1-CD1 4.39Å; L303-F305 HydrophobicContact CD2-CD1 4.1Å; L303-F305 HydrophobicContact CD2-CE1 3.94Å; L303-F305 HydrophobicContact CG-CD1 3.88Å; L303-F305 HydrophobicContact CG-CE1 4.06Å
304	F	98.9	Very high	98.5	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	141.5	170.6	168.1	-98	0	0	0	110.5	F124 T128 W129 P133 V134 E251 A252 F253 P306	F124-F304 HydrophobicContact CE2-CB 4.23Å; F124-F304 AromaticContact CE2-CD1 3.56Å; F124-F304 HydrophobicContact CE2-CD1 3.56Å; F124-F304 HydrophobicContact CE2-CD2 4.2Å; F124-F304 AromaticContact CE2-CE1 3.94Å; F124-F304 HydrophobicContact CE2-CE1 3.94Å; F124-F304 AromaticContact CE2-CG 3.7Å; F124-F304 HydrophobicContact CE2-CG 3.7Å; F124-F304 HydrophobicContact CE2-CZ 4.41Å; F124-F304 AromaticContact CZ-CD1 3.74Å; F124-F304 HydrophobicContact CZ-CD1 3.74Å; F124-F304 AromaticContact CZ-CD2 3.73Å; F124-F304 HydrophobicContact CZ-CD2 3.73Å; F124-F304 AromaticContact CZ-CE1 3.77Å; F124-F304 HydrophobicContact CZ-CE1 3.77Å; F124-F304 AromaticContact CZ-CE2 3.75Å; F124-F304 HydrophobicContact CZ-CE2 3.75Å; F124-F304 AromaticContact CZ-CG 3.72Å; F124-F304 HydrophobicContact CZ-CG 3.72Å; F124-F304 AromaticContact CZ-CZ 3.78Å; F124-F304 HydrophobicContact CZ-CZ 3.78Å; T128-F304 HydrophobicContact CG2-CD1 3.75Å; T128-F304 HydrophobicContact CG2-CE1 3.82Å; W129-F304 AromaticContact CE3-CE2 3.85Å; W129-F304 HydrophobicContact CE3-CE2 3.85Å; W129-F304 AromaticContact CE3-CZ 3.77Å; W129-F304 HydrophobicContact CE3-CZ 3.77Å; W129-F304 AromaticContact CZ3-CE2 3.87Å; W129-F304 HydrophobicContact CZ3-CE2 3.87Å; W129-F304 HydrophobicContact CZ3-CZ 4.24Å; P133-F304 CarbonylContact C-O 3.55Å; P133-F304 WeakPolarHBondContact CA-O 3.44Å; P133-F304 WeakPolarHBondContact CB-O 3.47Å; V134-F304 PolarHBondContact N-O 2.84Å; V134-F304 PolarHBondContact O-N 2.85Å; E251-F304 HydrophobicContact CB-CE2 4.25Å; A252-F304 VanDerWaalsContact O-CA 3.3Å; A252-F304 WeakPolarHBondContact O-CA 3.4Å; A252-F304 VanDerWaalsContact O-CD2 3.23Å; A252-F304 WeakPolarHBondContact O-CD2 3.44Å; F253-F304 HydrophobicContact CD1-CB 4.17Å; F253-F304 AromaticContact CD1-CD2 3.79Å; F253-F304 HydrophobicContact CD1-CD2 3.79Å; F253-F304 HydrophobicContact CD1-CG 4.38Å; F253-F304 HydrophobicContact CD2-CD2 4.32Å; F253-F304 HydrophobicContact CE1-CB 4.3Å; F253-F304 AromaticContact CE1-CD2 3.5Å; F253-F304 HydrophobicContact CE1-CD2 3.5Å; F253-F304 HydrophobicContact CE1-CE2 4.19Å; F253-F304 HydrophobicContact CE1-CG 4.15Å; F253-F304 HydrophobicContact CE2-CD2 4.07Å; F253-F304 HydrophobicContact CE2-CE2 4.18Å; F253-F304 HydrophobicContact CG-CD2 4.19Å; F253-F304 AromaticContact CZ-CD2 3.66Å; F253-F304 HydrophobicContact CZ-CD2 3.66Å; F253-F304 AromaticContact CZ-CE2 3.89Å; F253-F304 HydrophobicContact CZ-CE2 3.89Å; F304-P306 HydrophobicContact CE1-CG 4.07Å; F304-P306 HydrophobicContact CZ-CG 4.2Å
305	F	98.8	Very high	98.5	Very high	7 Å²	7	13.5 Å²	13.5	3%	0.031	8%	0.075	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	145.6	164.1	46.8	-96.9	0	0	0	112.2	P133 A252 V254 W263 V265 L303 F309 H311	P133-F305 HydrophobicContact CB-CB 4.04Å; A252-F305 HydrophobicContact CB-CD2 3.92Å; A252-F305 HydrophobicContact CB-CE2 3.5Å; A252-F305 VanDerWaalsContact CB-CE2 3.5Å; A252-F305 HydrophobicContact CB-CZ 3.88Å; A252-F305 PolarHBondContact N-O 3.08Å; A252-F305 VanDerWaalsContact N-O 3.13Å; A252-F305 PolarHBondContact O-N 3.15Å; A252-F305 VanDerWaalsContact O-N 3.13Å; V254-F305 HydrophobicContact CG2-CE1 3.76Å; V254-F305 HydrophobicContact CG2-CZ 3.96Å; W263-F305 HydrophobicContact CZ3-CE1 4.4Å; W263-F305 HydrophobicContact CZ3-CZ 4.43Å; V265-F305 HydrophobicContact CG1-CB 4.27Å; V265-F305 HydrophobicContact CG1-CG 4.47Å; V265-F305 HydrophobicContact CG2-CD1 4.13Å; L303-F305 HydrophobicContact CD1-CD1 4.39Å; L303-F305 HydrophobicContact CD2-CD1 4.1Å; L303-F305 HydrophobicContact CD2-CE1 3.94Å; L303-F305 HydrophobicContact CG-CD1 3.88Å; L303-F305 HydrophobicContact CG-CE1 4.06Å; F305-F309 HydrophobicContact CB-CB 4.12Å; F305-F309 HydrophobicContact CB-CG 4.49Å; F305-F309 HydrophobicContact CD2-CB 4.45Å; F305-H311 HydrophobicContact CE1-CB 4.48Å; F305-H311 HydrophobicContact CE2-CB 4.49Å; F305-H311 AromaticContact CE2-CE1 3.75Å; F305-H311 AromaticContact CE2-CG 3.88Å; F305-H311 AromaticContact CE2-ND1 3.4Å; F305-H311 WeakPolarHBondContact CE2-ND1 3.45Å; F305-H311 HydrophobicContact CZ-CB 4.2Å; F305-H311 AromaticContact CZ-CG 3.7Å; F305-H311 AromaticContact CZ-ND1 3.7Å
306	P	98.6	Very high	98.3	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.079	C	C	.	.			trans	-67.3	160.1	174.4	-22.5	33.9	0	0	0	114.2	E251 L275 F304 F309	E251-P306 WeakPolarHBondContact OE2-CA 3.41Å; E251-P306 WeakPolarHBondContact OE2-CB 3.26Å; L275-P306 HydrophobicContact CD2-CB 4.26Å; F304-P306 HydrophobicContact CE1-CG 4.07Å; F304-P306 HydrophobicContact CZ-CG 4.2Å; P306-F309 HydrophobicContact CB-CD2 3.8Å; P306-F309 HydrophobicContact CB-CE2 3.87Å; P306-F309 HydrophobicContact CG-CD2 3.98Å; P306-F309 HydrophobicContact CG-CE2 3.74Å; P306-F309 WeakPolarHBondContact O-CB 3.23Å; P306-F309 WeakPolarHBondContact O-CD2 3.38Å; P306-F309 PolarHBondContact O-N 3.28Å
307	R	98.5	Very high	98.1	Very high	21 Å²	21	17.5 Å²	17.5	8%	0.079	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	141.9	168.6	70.8	-174.7	177.1	-78.9	3.6	110.9	E130 D248 I250 E251 L275 P276	E130-R307 IonicContact OE1-CZ 3.04Å; E130-R307 VanDerWaalsContact OE1-CZ 3.25Å; E130-R307 IonicContact OE1-NH1 3.99Å; E130-R307 PolarHBondContact OE1-NH1 2.84Å; E130-R307 IonicContact OE1-NH2 3.4Å; E130-R307 PolarHBondContact OE1-NH2 3Å; D248-R307 WeakPolarHBondContact O-CB 3.4Å; I250-R307 WeakPolarHBondContact O-CA 3.29Å; I250-R307 VanDerWaalsContact O-CB 3.26Å; I250-R307 WeakPolarHBondContact O-CB 3.47Å; I250-R307 PolarHBondContact O-N 3.11Å; E251-R307 WeakPolarHBondContact OE1-CG 3.41Å; E251-R307 PolarHBondContact OE1-N 2.89Å; E251-R307 IonicContact OE1-NH1 3.22Å; E251-R307 PolarHBondContact OE1-NH1 2.9Å; L275-R307 HydrophobicContact CB-CG 4.48Å; L275-R307 HydrophobicContact CD2-CG 4.02Å; P276-R307 WeakPolarHBondContact O-CD 3.5Å
308	G	98.3	Very high	98	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.8	-12.5	-175	0	0	0	0	0	115.9	D248 I310	D248-G308 PolarHBondContact O-N 3.23Å; G308-I310 PolarHBondContact O-N 2.93Å
309	F	98.7	Very high	97.9	Very high	16 Å²	16	20.7 Å²	20.7	7%	0.07	12%	0.122	C	C	.	.			trans	-76.1	113	170.1	-77.9	-105.3	0	0	0	109.5	P133 V265 Y266 K267 P268 I292 F305 P306 H311	P133-F309 HydrophobicContact CG-CE1 4.39Å; V265-F309 HydrophobicContact CG1-CB 4Å; V265-F309 HydrophobicContact CG1-CD1 4.13Å; Y266-F309 WeakPolarHBondContact O-CA 3.41Å; Y266-F309 VanDerWaalsContact O-CD1 3.27Å; Y266-F309 WeakPolarHBondContact O-CD1 3.24Å; K267-F309 HydrophobicContact CG-CE1 4.28Å; P268-F309 HydrophobicContact CG-CD2 4.46Å; P268-F309 HydrophobicContact CG-CE2 4.45Å; I292-F309 HydrophobicContact CD1-CD1 4.15Å; I292-F309 HydrophobicContact CD1-CE1 3.82Å; F305-F309 HydrophobicContact CB-CB 4.12Å; F305-F309 HydrophobicContact CB-CG 4.49Å; F305-F309 HydrophobicContact CD2-CB 4.45Å; P306-F309 HydrophobicContact CB-CD2 3.8Å; P306-F309 HydrophobicContact CB-CE2 3.87Å; P306-F309 HydrophobicContact CG-CD2 3.98Å; P306-F309 HydrophobicContact CG-CE2 3.74Å; P306-F309 WeakPolarHBondContact O-CB 3.23Å; P306-F309 WeakPolarHBondContact O-CD2 3.38Å; P306-F309 PolarHBondContact O-N 3.28Å; F309-H311 PolarHBondContact O-N 3.3Å; F309-H311 PolarHBondContact O-ND1 2.87Å
310	I	98.8	Very high	97.9	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.128	C	C	.	.			trans	-63.3	137.8	176	-61.1	167.5	0	0	0	108	P245 H246 Y247 V265 Y266 R269 F283 I288 G308	P245-I310 HydrophobicContact CB-CG2 4.11Å; H246-I310 CarbonylContact O-C 3.55Å; H246-I310 VanDerWaalsContact O-CA 3.26Å; H246-I310 WeakPolarHBondContact O-CA 3.18Å; Y247-I310 HydrophobicContact CD1-CG1 3.79Å; V265-I310 CarbonylContact C-O 3.51Å; V265-I310 WeakPolarHBondContact CA-O 3.43Å; Y266-I310 HydrophobicContact CD2-CB 4.4Å; Y266-I310 HydrophobicContact CD2-CG2 4.14Å; Y266-I310 WeakPolarHBondContact CD2-O 3.45Å; Y266-I310 PolarHBondContact N-O 3.44Å; Y266-I310 PolarHBondContact O-N 2.89Å; R269-I310 HydrophobicContact CG-CD1 3.66Å; F283-I310 HydrophobicContact CD2-CD1 3.87Å; F283-I310 HydrophobicContact CD2-CG1 4.12Å; F283-I310 HydrophobicContact CD2-CG2 4.28Å; F283-I310 HydrophobicContact CE2-CD1 3.73Å; F283-I310 HydrophobicContact CE2-CG1 3.88Å; I288-I310 HydrophobicContact CB-CD1 4.5Å; I288-I310 HydrophobicContact CB-CG2 4.23Å; I288-I310 HydrophobicContact CG2-CD1 4.16Å; I288-I310 HydrophobicContact CG2-CG2 3.85Å; G308-I310 PolarHBondContact O-N 2.93Å
311	H	98.8	Very high	97.9	Very high	12 Å²	12	22.7 Å²	22.7	6%	0.056	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	156.3	178.3	61	-87.1	0	0	0	111.6	P245 H246 D248 W263 R264 V265 F305 F309	P245-H311 WeakPolarHBondContact CA-O 3.28Å; H246-H311 AromaticContact CE1-NE2 3.7Å; H246-H311 PolarHBondContact N-O 2.82Å; H246-H311 AromaticContact NE2-CE1 3.98Å; H246-H311 AromaticContact NE2-NE2 3.54Å; H246-H311 PolarHBondContact O-N 3.4Å; H246-H311 PolarHBondContact O-ND1 2.87Å; D248-H311 IonicContact OD2-CE1 3.02Å; D248-H311 PolarHBondContact OD2-CE1 3.02Å; D248-H311 IonicContact OD2-NE2 2.73Å; W263-H311 HydrophobicContact CZ3-CB 4.36Å; W263-H311 AromaticContact CZ3-CD2 3.67Å; R264-H311 CarbonylContact O-C 3.57Å; R264-H311 VanDerWaalsContact O-CA 3.28Å; R264-H311 WeakPolarHBondContact O-CA 3.25Å; V265-H311 HydrophobicContact CG2-CB 4.31Å; F305-H311 HydrophobicContact CE1-CB 4.48Å; F305-H311 HydrophobicContact CE2-CB 4.49Å; F305-H311 AromaticContact CE2-CE1 3.75Å; F305-H311 AromaticContact CE2-CG 3.88Å; F305-H311 AromaticContact CE2-ND1 3.4Å; F305-H311 WeakPolarHBondContact CE2-ND1 3.45Å; F305-H311 HydrophobicContact CZ-CB 4.2Å; F305-H311 AromaticContact CZ-CG 3.7Å; F305-H311 AromaticContact CZ-ND1 3.7Å; F309-H311 PolarHBondContact O-N 3.3Å; F309-H311 PolarHBondContact O-ND1 2.87Å
312	Q	98.4	Very high	97.9	Very high	3 Å²	3	22.6 Å²	22.6	1%	0.014	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	149.5	168.9	60.1	179.7	-33.5	0	0	110	P245 R264 Y266	P245-Q312 HydrophobicContact CB-CB 4.35Å; P245-Q312 HydrophobicContact CG-CB 4.23Å; P245-Q312 HydrophobicContact CG-CG 4.5Å; R264-Q312 HydrophobicContact CB-CG 4.06Å; R264-Q312 PolarHBondContact N-O 2.85Å; R264-Q312 PolarHBondContact O-N 3.04Å; Y266-Q312 HydrophobicContact CE2-CG 4.18Å; Y266-Q312 PolarHBondContact OH-NE2 2.99Å
313	G	97.7	Very high	97.9	Very high	13 Å²	13	22.8 Å²	22.8	13%	0.134	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	130.4	178.9	0	0	0	0	0	112.4	H262	H262-G313 CarbonylContact O-C 3.58Å; H262-G313 WeakPolarHBondContact O-CA 3.37Å
314	N	97.9	Very high	97.9	Very high	33 Å²	33	22.8 Å²	22.8	18%	0.176	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	144.7	175.2	59.1	-86.3	0	0	0	110.7	Q241 H262 R264	Q241-N314 HydrophobicContact CB-CB 3.94Å; Q241-N314 HydrophobicContact CG-CB 4.24Å; H262-N314 WeakPolarHBondContact CB-O 3.36Å; H262-N314 PolarHBondContact N-O 3.31Å; H262-N314 PolarHBondContact ND1-OD1 2.96Å; H262-N314 PolarHBondContact O-N 2.91Å; R264-N314 PolarHBondContact NH2-OD1 3.31Å
315	C	97.3	Very high	97.9	Very high	4 Å²	4	23.4 Å²	23.4	3%	0.027	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	150.8	174.8	-75.4	0	0	0	0	110.9	T236 P237 T240 S321	T236-C315 VanDerWaalsContact CB-SG 3.52Å; T236-C315 HydrophobicContact CG2-CB 4.24Å; T236-C315 WeakPolarHBondContact CG2-SG 3.34Å; T236-C315 PolarHBondContact O-SG 3.04Å; T236-C315 VanDerWaalsContact O-SG 3.34Å; P237-C315 VanDerWaalsContact O-CB 3.26Å; P237-C315 WeakPolarHBondContact O-CB 3.24Å; T240-C315 PolarHBondContact O-N 3.18Å; C315-S321 VanDerWaalsContact SG-CB 3.5Å
316	L	94.1	Very high	97.9	Very high	48 Å²	48	23.2 Å²	23.2	25%	0.251	13%	0.131	S	C	.	.			trans	-72.1	157.4	167.6	-66.6	169.8	0	0	0	109.9	G239 K260 V296 D318	G239-L316 PolarHBondContact N-O 3.21Å; K260-L316 HydrophobicContact CB-CD1 3.95Å; K260-L316 HydrophobicContact CD-CD1 4.13Å; V296-L316 HydrophobicContact CG1-CD1 3.85Å; V296-L316 HydrophobicContact CG2-CD1 4.45Å; L316-D318 WeakPolarHBondContact CB-OD1 3.46Å; L316-D318 PolarHBondContact O-N 2.95Å
317	P	95.2	Very high	97.9	Very high	111 Å²	111	24.2 Å²	24.2	72%	0.721	14%	0.138	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-24.8	-177.2	-25.2	35.6	0	0	0	115.2	P238	P238-P317 WeakPolarHBondContact CB-O 3.41Å
318	D	95.8	Very high	97.9	Very high	130 Å²	130	23.3 Å²	23.3	70%	0.695	14%	0.135	S	C	*	.	T	Hydrogen-bonded Turn	trans	-104.4	-6.1	-169.3	63.6	-39.4	0	0	0	114.4	L316	L316-D318 WeakPolarHBondContact CB-OD1 3.46Å; L316-D318 PolarHBondContact O-N 2.95Å
319	A	96.6	Very high	97.9	Very high	17 Å²	17	26 Å²	26	14%	0.14	15%	0.146	C	C	.	.			trans	-142.6	138.5	-175.2	0	0	0	0	0	112.3	P238 K260	P238-A319 WeakPolarHBondContact CA-O 3.44Å; K260-A319 HydrophobicContact CB-CB 4.28Å; K260-A319 HydrophobicContact CG-CB 4.41Å
320	H	98.4	Very high	97.8	Very high	59 Å²	59	29.8 Å²	29.8	27%	0.273	16%	0.164	S	C	.	.			trans	-71.1	175.6	164.7	74.5	-71.7	0	0	0	110.2	Y196 T236 P238 E258 G259 K260	Y196-H320 WeakPolarHBondContact OH-CB 3.46Å; T236-H320 WeakPolarHBondContact O-CA 3.3Å; P238-H320 HydrophobicContact CG-CB 4.41Å; E258-H320 IonicContact OE2-CE1 3.77Å; E258-H320 IonicContact OE2-NE2 2.84Å; E258-H320 PolarHBondContact OE2-NE2 3.4Å; G259-H320 CarbonylContact C-O 3.51Å; G259-H320 VanDerWaalsContact CA-O 3.26Å; G259-H320 WeakPolarHBondContact CA-O 3.37Å; K260-H320 PolarHBondContact N-O 3.1Å
321	S	98.8	Very high	97.6	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	134.2	168.4	165.5	0	0	0	0	110.8	L235 T236 Q256 E258 K261 C315	L235-S321 WeakPolarHBondContact CA-O 3.28Å; T236-S321 PolarHBondContact N-O 3.22Å; T236-S321 PolarHBondContact O-N 3.29Å; Q256-S321 PolarHBondContact NE2-OG 2.99Å; E258-S321 WeakPolarHBondContact O-CA 3.21Å; K261-S321 WeakPolarHBondContact CB-OG 3.46Å; K261-S321 WeakPolarHBondContact CE-OG 3.11Å; C315-S321 VanDerWaalsContact SG-CB 3.5Å
322	L	98.9	Very high	97.5	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	127	161.7	-172.6	72.4	0	0	0	108.5	F148 F153 V233 Y234 L235 L257 E258	F148-L322 HydrophobicContact CD1-CD2 4.41Å; F153-L322 HydrophobicContact CD2-CD1 4.45Å; V233-L322 HydrophobicContact CG1-CD1 3.51Å; V233-L322 HydrophobicContact CG1-CG 4.32Å; Y234-L322 WeakPolarHBondContact O-CA 3.38Å; L235-L322 HydrophobicContact CB-CD1 3.83Å; L235-L322 HydrophobicContact CD1-CB 4.41Å; L235-L322 HydrophobicContact CD1-CD1 4.17Å; L235-L322 HydrophobicContact CG-CD1 4.45Å; L257-L322 HydrophobicContact CB-CB 4.41Å; L257-L322 HydrophobicContact CB-CD2 4.12Å; L257-L322 HydrophobicContact CB-CG 4.24Å; L257-L322 WeakPolarHBondContact CB-O 3.45Å; L257-L322 HydrophobicContact CD1-CD2 4.06Å; L257-L322 HydrophobicContact CD1-CG 4.15Å; L257-L322 PolarHBondContact N-O 3Å; E258-L322 HydrophobicContact CB-CB 3.79Å; E258-L322 HydrophobicContact CG-CB 4.03Å; E258-L322 HydrophobicContact CG-CD2 3.98Å; E258-L322 PolarHBondContact N-O 3.31Å; E258-L322 PolarHBondContact O-N 3Å; E258-L322 WeakPolarHBondContact OE1-CD2 3.34Å
323	H	98.9	Very high	97.5	Very high	4 Å²	4	39 Å²	39	2%	0.019	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	155.6	167.4	70.5	-88.9	0	0	0	110.6	V233 Y234 V254 I255 W263 T325	V233-H323 WeakPolarHBondContact CA-O 3.5Å; Y234-H323 WeakPolarHBondContact CB-CE1 3.37Å; Y234-H323 AromaticContact CD2-CD2 3.75Å; Y234-H323 AromaticContact CD2-CE1 3.82Å; Y234-H323 AromaticContact CD2-NE2 3.21Å; Y234-H323 WeakPolarHBondContact CD2-NE2 3.35Å; Y234-H323 AromaticContact CE2-NE2 3.95Å; Y234-H323 AromaticContact CG-CE1 3.67Å; Y234-H323 AromaticContact CG-NE2 3.54Å; Y234-H323 PolarHBondContact N-O 2.83Å; Y234-H323 PolarHBondContact O-N 2.77Å; Y234-H323 VanDerWaalsContact O-N 3.08Å; V254-H323 HydrophobicContact CG1-CB 4.35Å; I255-H323 VanDerWaalsContact O-CA 3.24Å; I255-H323 WeakPolarHBondContact O-CA 3.41Å; I255-H323 VanDerWaalsContact O-CB 3.23Å; I255-H323 WeakPolarHBondContact O-CB 3.47Å; W263-H323 AromaticContact CH2-NE2 3.99Å; W263-H323 AromaticContact CZ2-CE1 3.61Å; W263-H323 AromaticContact CZ2-NE2 3.63Å; H323-T325 PolarHBondContact CD2-OG1 2.91Å
324	I	98.9	Very high	97.5	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	130.2	167.5	-173.7	170.6	0	0	0	108.2	L147 P207 V214 A231 N232 V233 I255 L257	L147-I324 HydrophobicContact CD2-CG2 3.88Å; P207-I324 HydrophobicContact CG-CD1 4.35Å; V214-I324 HydrophobicContact CG1-CD1 3.92Å; V214-I324 HydrophobicContact CG2-CD1 4.02Å; A231-I324 HydrophobicContact CB-CD1 3.87Å; A231-I324 HydrophobicContact CB-CG1 3.91Å; N232-I324 CarbonylContact O-C 3.6Å; N232-I324 WeakPolarHBondContact O-CA 3.46Å; V233-I324 HydrophobicContact CG2-CB 4.07Å; V233-I324 HydrophobicContact CG2-CD1 3.99Å; V233-I324 HydrophobicContact CG2-CG1 3.88Å; I255-I324 HydrophobicContact CB-CG2 3.72Å; I255-I324 WeakPolarHBondContact CB-O 3.48Å; I255-I324 HydrophobicContact CD1-CG2 4.28Å; I255-I324 HydrophobicContact CG2-CG2 3.92Å; I255-I324 PolarHBondContact N-O 2.92Å; I255-I324 PolarHBondContact O-N 2.82Å; L257-I324 HydrophobicContact CD1-CB 3.97Å; L257-I324 HydrophobicContact CD1-CG2 3.81Å; L257-I324 HydrophobicContact CD2-CG2 4.06Å; L257-I324 HydrophobicContact CG-CG2 4.08Å
325	T	98.9	Very high	97.5	Very high	14 Å²	14	48.7 Å²	48.7	9%	0.086	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	114	170.8	-57.8	0	0	0	0	107.3	A231 N232 A252 F253 V254 H323	A231-T325 CarbonylContact C-O 3.58Å; A231-T325 WeakPolarHBondContact CA-O 3.23Å; A231-T325 WeakPolarHBondContact CB-O 3.48Å; N232-T325 PolarHBondContact N-O 3.2Å; N232-T325 PolarHBondContact O-N 2.79Å; A252-T325 HydrophobicContact CB-CG2 4.1Å; F253-T325 CarbonylContact O-C 3.58Å; F253-T325 WeakPolarHBondContact O-CA 3.48Å; V254-T325 HydrophobicContact CG2-CG2 4.32Å; H323-T325 PolarHBondContact CD2-OG1 2.91Å
326	I	98.9	Very high	97.4	Very high	2 Å²	2	49.7 Å²	49.7	1%	0.01	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	129.8	167.8	-61.9	-178.1	0	0	0	107.6	V217 L218 L221 G230 A231 F253 I255	V217-I326 HydrophobicContact CG1-CD1 4.1Å; L218-I326 HydrophobicContact CD2-CB 4.37Å; L218-I326 HydrophobicContact CD2-CD1 3.99Å; L218-I326 HydrophobicContact CD2-CG1 3.94Å; L218-I326 HydrophobicContact CD2-CG2 3.7Å; L221-I326 HydrophobicContact CD1-CD1 3.85Å; L221-I326 HydrophobicContact CD1-CG2 4.23Å; G230-I326 WeakPolarHBondContact O-CA 3.43Å; A231-I326 HydrophobicContact CB-CG1 4.47Å; F253-I326 HydrophobicContact CB-CB 4.3Å; F253-I326 PolarHBondContact N-O 2.85Å; F253-I326 PolarHBondContact O-N 3.37Å; I255-I326 HydrophobicContact CD1-CD1 3.55Å; I255-I326 HydrophobicContact CD1-CG1 3.91Å
327	S	98.4	Very high	97.6	Very high	21 Å²	21	48.7 Å²	48.7	15%	0.147	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	144	-175.9	57.5	0	0	0	0	111.5	A229 G230 E251	A229-S327 WeakPolarHBondContact CA-O 3.45Å; G230-S327 PolarHBondContact N-O 2.76Å; G230-S327 PolarHBondContact O-N 3.04Å; E251-S327 WeakPolarHBondContact O-CA 3.28Å
328	S	98.3	Very high	97.7	Very high	3 Å²	3	47.5 Å²	47.5	2%	0.021	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	-177.5	173.6	-164.6	0	0	0	0	111.6	M228 E251 Q330	M228-S328 WeakPolarHBondContact O-CA 3.38Å; M228-S328 WeakPolarHBondContact O-CB 3.26Å; M228-S328 PolarHBondContact O-OG 2.66Å; E251-S328 PolarHBondContact N-O 2.82Å; E251-S328 PolarHBondContact O-N 3.16Å; E251-S328 VanDerWaalsContact O-N 3.17Å; S328-Q330 VanDerWaalsContact C-N 3.3Å; S328-Q330 PolarHBondContact O-N 2.85Å
329	Y	97.9	Very high	97.8	Very high	56 Å²	56	47.5 Å²	47.5	22%	0.22	23%	0.234	C	C	.	.			trans	69.3	17.5	171.9	-115.2	-122.6	0	0	0	116.3	W129 S227 E251 K331 N332	W129-Y329 HydrophobicContact CH2-CD2 4.35Å; W129-Y329 HydrophobicContact CH2-CG 4.34Å; W129-Y329 AromaticContact CZ2-CD1 3.82Å; W129-Y329 HydrophobicContact CZ2-CD1 3.82Å; W129-Y329 AromaticContact CZ2-CD2 3.67Å; W129-Y329 HydrophobicContact CZ2-CD2 3.67Å; W129-Y329 HydrophobicContact CZ2-CE1 4.06Å; W129-Y329 AromaticContact CZ2-CE2 3.9Å; W129-Y329 HydrophobicContact CZ2-CE2 3.9Å; W129-Y329 AromaticContact CZ2-CG 3.62Å; W129-Y329 HydrophobicContact CZ2-CG 3.62Å; W129-Y329 AromaticContact NE1-CE1 3.88Å; S227-Y329 WeakPolarHBondContact OG-CA 3.21Å; S227-Y329 PolarHBondContact OG-N 3.19Å; S227-Y329 VanDerWaalsContact OG-N 3.15Å; E251-Y329 HydrophobicContact CG-CG 4.42Å; Y329-K331 PolarHBondContact O-N 2.87Å; Y329-N332 HydrophobicContact CD1-CB 4.28Å; Y329-N332 HydrophobicContact CD2-CB 4.33Å; Y329-N332 WeakPolarHBondContact CD2-ND2 3.39Å; Y329-N332 VanDerWaalsContact CE2-ND2 3.25Å; Y329-N332 WeakPolarHBondContact CE2-ND2 3.31Å; Y329-N332 HydrophobicContact CG-CB 4.13Å; Y329-N332 PolarHBondContact O-N 3.42Å
330	Q	97.2	Very high	97.7	Very high	95 Å²	95	50 Å²	50	44%	0.444	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	133.4	170.5	-151.9	-179.7	19.9	0	0	109.9	D249 I250 S328 N332	D249-Q330 PolarHBondContact OD1-NE2 2.94Å; D249-Q330 PolarHBondContact OD2-NE2 3.35Å; I250-Q330 HydrophobicContact CG2-CB 3.68Å; I250-Q330 HydrophobicContact CG2-CG 3.81Å; S328-Q330 VanDerWaalsContact C-N 3.3Å; S328-Q330 PolarHBondContact O-N 2.85Å; Q330-N332 PolarHBondContact O-N 2.67Å; Q330-N332 VanDerWaalsContact O-N 3.09Å
331	K	94.5	Very high	97.6	Very high	137 Å²	137	47.8 Å²	47.8	60%	0.596	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.3	35.5	178.9	-60.2	176.8	-179.2	176.3	0	114	Y329 D336 K407	Y329-K331 PolarHBondContact O-N 2.87Å; K331-D336 VanDerWaalsContact C-CG 3.5Å; K331-D336 WeakPolarHBondContact CA-OD2 3.24Å; K331-D336 WeakPolarHBondContact O-CB 3.48Å; K331-K407 PolarHBondContact O-NZ 3.4Å
332	N	96.7	Very high	97.6	Very high	35 Å²	35	52 Å²	52	19%	0.187	25%	0.254	C	S	.	.			trans	-115	39.2	-178.7	-155.2	28.5	0	0	0	113.6	Y329 Q330 D336 K407	Y329-N332 HydrophobicContact CD1-CB 4.28Å; Y329-N332 HydrophobicContact CD2-CB 4.33Å; Y329-N332 WeakPolarHBondContact CD2-ND2 3.39Å; Y329-N332 VanDerWaalsContact CE2-ND2 3.25Å; Y329-N332 WeakPolarHBondContact CE2-ND2 3.31Å; Y329-N332 HydrophobicContact CG-CB 4.13Å; Y329-N332 PolarHBondContact O-N 3.42Å; Q330-N332 PolarHBondContact O-N 2.67Å; Q330-N332 VanDerWaalsContact O-N 3.09Å; N332-D336 PolarHBondContact N-OD2 3.34Å; N332-K407 WeakPolarHBondContact OD1-CE 3.38Å; N332-K407 PolarHBondContact OD1-NZ 3.02Å
333	S	97.1	Very high	97.4	Very high	38 Å²	38	54.7 Å²	54.7	27%	0.266	27%	0.272	S	S	.	.	S	Bend	trans	-98.3	166.8	-179.6	76.8	0	0	0	0	113.5	G335 D336 L337	S333-G335 PolarHBondContact O-N 2.83Å; S333-G335 PolarHBondContact OG-N 3.06Å; S333-D336 VanDerWaalsContact CB-OD2 3.29Å; S333-D336 WeakPolarHBondContact CB-OD2 3.33Å; S333-D336 PolarHBondContact N-OD2 3.13Å; S333-D336 WeakPolarHBondContact O-CB 3.29Å; S333-D336 PolarHBondContact O-N 3.05Å; S333-D336 PolarHBondContact OG-N 3.18Å; S333-D336 PolarHBondContact OG-OD2 3.43Å; S333-L337 PolarHBondContact O-N 3.4Å; S333-L337 VanDerWaalsContact O-N 3.13Å
334	W	98.1	Very high	97.2	Very high	212 Å²	212	55.8 Å²	55.8	80%	0.803	28%	0.281	S	S	*	.	H	α-helix	trans	-56.2	-32.5	167.5	-73.6	101	0	0	0	112.8	L337 L338	W334-L337 HydrophobicContact CE3-CD2 4.31Å; W334-L337 HydrophobicContact CZ3-CD2 4.24Å; W334-L337 PolarHBondContact O-N 3.31Å; W334-L338 WeakPolarHBondContact O-CB 3.46Å; W334-L338 VanDerWaalsContact O-CG 3.27Å; W334-L338 WeakPolarHBondContact O-CG 3.4Å; W334-L338 PolarHBondContact O-N 3.41Å
335	G	97.7	Very high	97.1	Very high	36 Å²	36	55.9 Å²	55.9	37%	0.371	28%	0.282	S	S	.	.	H	α-helix	trans	-65.9	-38.5	175.1	0	0	0	0	0	112.2	S333 L338 Q339	S333-G335 PolarHBondContact O-N 2.83Å; S333-G335 PolarHBondContact OG-N 3.06Å; G335-L338 PolarHBondContact O-N 3.26Å; G335-Q339 WeakPolarHBondContact O-CG 3.11Å; G335-Q339 PolarHBondContact O-N 2.83Å; G335-Q339 PolarHBondContact O-NE2 2.91Å
336	D	96.8	Very high	97	Very high	26 Å²	26	58.8 Å²	58.8	14%	0.139	30%	0.297	C	S	.	.	H	α-helix	trans	-67.1	-39.4	176.5	-57.1	-58.1	0	0	0	111.6	K331 N332 S333 Q339	K331-D336 VanDerWaalsContact C-CG 3.5Å; K331-D336 WeakPolarHBondContact CA-OD2 3.24Å; K331-D336 WeakPolarHBondContact O-CB 3.48Å; N332-D336 PolarHBondContact N-OD2 3.34Å; S333-D336 VanDerWaalsContact CB-OD2 3.29Å; S333-D336 WeakPolarHBondContact CB-OD2 3.33Å; S333-D336 PolarHBondContact N-OD2 3.13Å; S333-D336 WeakPolarHBondContact O-CB 3.29Å; S333-D336 PolarHBondContact O-N 3.05Å; S333-D336 PolarHBondContact OG-N 3.18Å; S333-D336 PolarHBondContact OG-OD2 3.43Å; D336-Q339 WeakPolarHBondContact O-CB 3.48Å; D336-Q339 PolarHBondContact O-N 3Å; D336-Q339 PolarHBondContact OD1-NE2 2.7Å
337	L	97.3	Very high	96.8	Very high	27 Å²	27	62.9 Å²	62.9	14%	0.141	32%	0.316	C	S	.	.	H	α-helix	trans	-65.1	-45	171.9	179.6	60.2	0	0	0	111.6	S333 W334 Q339 K340 V341 A403 V404	S333-L337 PolarHBondContact O-N 3.4Å; S333-L337 VanDerWaalsContact O-N 3.13Å; W334-L337 HydrophobicContact CE3-CD2 4.31Å; W334-L337 HydrophobicContact CZ3-CD2 4.24Å; W334-L337 PolarHBondContact O-N 3.31Å; L337-Q339 PolarHBondContact O-N 3.16Å; L337-K340 WeakPolarHBondContact O-CA 3.27Å; L337-K340 WeakPolarHBondContact O-CB 3.35Å; L337-K340 PolarHBondContact O-N 3.43Å; L337-V341 HydrophobicContact CD1-CG2 4.12Å; L337-V341 HydrophobicContact CG-CG2 4.05Å; L337-V341 WeakPolarHBondContact O-CG2 3.46Å; L337-V341 PolarHBondContact O-N 3.36Å; L337-A403 HydrophobicContact CD1-CB 4.28Å; L337-V404 HydrophobicContact CD1-CG2 3.92Å; L337-V404 HydrophobicContact CD2-CG2 4.49Å
338	L	97.8	Very high	96.7	Very high	85 Å²	85	63.7 Å²	63.7	45%	0.445	32%	0.32	S	S	.	.	H	α-helix	trans	-64.5	-26.9	179.1	-73.7	173.5	0	0	0	113	W334 G335 K340 V341 I342	W334-L338 WeakPolarHBondContact O-CB 3.46Å; W334-L338 VanDerWaalsContact O-CG 3.27Å; W334-L338 WeakPolarHBondContact O-CG 3.4Å; W334-L338 PolarHBondContact O-N 3.41Å; G335-L338 PolarHBondContact O-N 3.26Å; L338-K340 PolarHBondContact O-N 3.3Å; L338-V341 HydrophobicContact CD2-CB 4.42Å; L338-V341 PolarHBondContact O-N 2.82Å; L338-I342 HydrophobicContact CB-CD1 4.26Å; L338-I342 HydrophobicContact CD2-CG1 4.45Å; L338-I342 WeakPolarHBondContact O-CB 3.47Å; L338-I342 WeakPolarHBondContact O-CG1 3.25Å; L338-I342 PolarHBondContact O-N 3.42Å
339	Q	96.6	Very high	96.7	Very high	130 Å²	130	63.6 Å²	63.6	61%	0.607	32%	0.319	S	S	*	.	H	α-helix	trans	-62.8	-22.4	170.4	-78	173.8	85.7	0	0	112.9	G335 D336 L337 P343	G335-Q339 WeakPolarHBondContact O-CG 3.11Å; G335-Q339 PolarHBondContact O-N 2.83Å; G335-Q339 PolarHBondContact O-NE2 2.91Å; D336-Q339 WeakPolarHBondContact O-CB 3.48Å; D336-Q339 PolarHBondContact O-N 3Å; D336-Q339 PolarHBondContact OD1-NE2 2.7Å; L337-Q339 PolarHBondContact O-N 3.16Å; Q339-P343 VanDerWaalsContact O-CD 3.22Å; Q339-P343 WeakPolarHBondContact O-CD 3.47Å; Q339-P343 VanDerWaalsContact O-CG 3.29Å; Q339-P343 WeakPolarHBondContact O-CG 3.39Å
340	K	95.3	Very high	96.7	Very high	69 Å²	69	65.4 Å²	65.4	30%	0.3	33%	0.331	S	S	.	.	H	α-helix	trans	-92	-43.9	171.4	-57.8	-63.1	-174.6	173.2	0	111.9	L337 L338 A344 A403 E410	L337-K340 WeakPolarHBondContact O-CA 3.27Å; L337-K340 WeakPolarHBondContact O-CB 3.35Å; L337-K340 PolarHBondContact O-N 3.43Å; L338-K340 PolarHBondContact O-N 3.3Å; K340-A344 WeakPolarHBondContact O-CB 3.36Å; K340-A344 PolarHBondContact O-N 3.48Å; K340-A403 HydrophobicContact CB-CB 3.84Å; K340-E410 VanDerWaalsContact CE-OE1 3.27Å; K340-E410 WeakPolarHBondContact CE-OE1 3.49Å; K340-E410 IonicContact NZ-OE1 3.17Å; K340-E410 PolarHBondContact NZ-OE1 2.65Å; K340-E410 IonicContact NZ-OE2 3.14Å
341	V	97.5	Very high	96.7	Very high	13 Å²	13	68 Å²	68	8%	0.079	34%	0.343	C	S	.	.	H	α-helix	trans	-65.7	-46.6	-176.2	176.6	0	0	0	0	112.3	L337 L338 A344 A345 A398 A403	L337-V341 HydrophobicContact CD1-CG2 4.12Å; L337-V341 HydrophobicContact CG-CG2 4.05Å; L337-V341 WeakPolarHBondContact O-CG2 3.46Å; L337-V341 PolarHBondContact O-N 3.36Å; L338-V341 HydrophobicContact CD2-CB 4.42Å; L338-V341 PolarHBondContact O-N 2.82Å; V341-A344 PolarHBondContact O-N 2.91Å; V341-A345 VanDerWaalsContact O-CB 3.24Å; V341-A345 WeakPolarHBondContact O-CB 3.45Å; V341-A345 PolarHBondContact O-N 3.21Å; V341-A398 HydrophobicContact CG1-CB 3.83Å; V341-A403 HydrophobicContact CB-CB 4.29Å; V341-A403 HydrophobicContact CG2-CB 3.44Å; V341-A403 VanDerWaalsContact CG2-CB 3.44Å
342	I	97.4	Very high	96.8	Very high	88 Å²	88	67.9 Å²	67.9	45%	0.451	34%	0.344	S	S	.	.	H	α-helix	trans	-65.5	-48.2	-171.9	-68.7	176.4	0	0	0	112.3	L338 A345 L346 L394	L338-I342 HydrophobicContact CB-CD1 4.26Å; L338-I342 HydrophobicContact CD2-CG1 4.45Å; L338-I342 WeakPolarHBondContact O-CB 3.47Å; L338-I342 WeakPolarHBondContact O-CG1 3.25Å; L338-I342 PolarHBondContact O-N 3.42Å; I342-A345 PolarHBondContact O-N 3.31Å; I342-L346 WeakPolarHBondContact O-CB 3.26Å; I342-L346 PolarHBondContact O-N 3.22Å; I342-L394 HydrophobicContact CG2-CD2 4.22Å
343	P	95.1	Very high	96.9	Very high	57 Å²	57	67 Å²	67	37%	0.37	34%	0.339	S	S	.	.	H	α-helix	trans	-59.6	-46.3	176.1	-26.1	36.9	0	0	0	112.4	Q339 A345 L346 E347	Q339-P343 VanDerWaalsContact O-CD 3.22Å; Q339-P343 WeakPolarHBondContact O-CD 3.47Å; Q339-P343 VanDerWaalsContact O-CG 3.29Å; Q339-P343 WeakPolarHBondContact O-CG 3.39Å; P343-A345 PolarHBondContact O-N 2.96Å; P343-L346 WeakPolarHBondContact O-CB 3.46Å; P343-L346 PolarHBondContact O-N 3.07Å; P343-L346 VanDerWaalsContact O-N 3.13Å; P343-E347 PolarHBondContact O-N 2.83Å
344	A	94	Very high	97	Very high	27 Å²	27	68.7 Å²	68.7	22%	0.223	35%	0.348	C	S	.	.	H	α-helix	trans	-63.3	-42.2	179.5	0	0	0	0	0	112.1	K340 V341 L346 E347 V348 P399	K340-A344 WeakPolarHBondContact O-CB 3.36Å; K340-A344 PolarHBondContact O-N 3.48Å; V341-A344 PolarHBondContact O-N 2.91Å; A344-L346 VanDerWaalsContact C-N 3.25Å; A344-L346 PolarHBondContact O-N 3.4Å; A344-E347 PolarHBondContact O-N 2.83Å; A344-V348 WeakPolarHBondContact O-CG2 3.44Å; A344-V348 PolarHBondContact O-N 3.05Å; A344-P399 HydrophobicContact CB-CG 3.51Å
345	A	97.3	Very high	96.9	Very high	2 Å²	2	60.7 Å²	60.7	2%	0.017	32%	0.32	C	S	.	.	H	α-helix	trans	-61	-35.7	175.1	0	0	0	0	0	112.4	V341 I342 P343 A349 L394 F397 A398	V341-A345 VanDerWaalsContact O-CB 3.24Å; V341-A345 WeakPolarHBondContact O-CB 3.45Å; V341-A345 PolarHBondContact O-N 3.21Å; I342-A345 PolarHBondContact O-N 3.31Å; P343-A345 PolarHBondContact O-N 2.96Å; A345-A349 WeakPolarHBondContact O-CB 3.26Å; A345-A349 PolarHBondContact O-N 2.83Å; A345-L394 HydrophobicContact CB-CD1 3.86Å; A345-L394 HydrophobicContact CB-CG 3.95Å; A345-F397 WeakPolarHBondContact CA-O 3.43Å; A345-A398 HydrophobicContact CB-CB 4.23Å
346	L	97.6	Very high	97	Very high	75 Å²	75	60.6 Å²	60.6	39%	0.393	31%	0.309	S	S	.	.	H	α-helix	trans	-70.6	-39.4	179.1	-179	61.2	0	0	0	111.3	I342 P343 A344 A349 M350 F356 L394	I342-L346 WeakPolarHBondContact O-CB 3.26Å; I342-L346 PolarHBondContact O-N 3.22Å; P343-L346 WeakPolarHBondContact O-CB 3.46Å; P343-L346 PolarHBondContact O-N 3.07Å; P343-L346 VanDerWaalsContact O-N 3.13Å; A344-L346 VanDerWaalsContact C-N 3.25Å; A344-L346 PolarHBondContact O-N 3.4Å; L346-A349 PolarHBondContact O-N 3.42Å; L346-M350 HydrophobicContact CD1-CG 4.37Å; L346-M350 HydrophobicContact CD1-SD 4.39Å; L346-M350 HydrophobicContact CG-SD 4.22Å; L346-M350 WeakPolarHBondContact O-CB 3.5Å; L346-M350 VanDerWaalsContact O-CG 3.25Å; L346-M350 WeakPolarHBondContact O-CG 3.35Å; L346-M350 PolarHBondContact O-N 3.22Å; L346-F356 HydrophobicContact CD1-CD1 4Å; L346-F356 HydrophobicContact CD1-CE1 4.38Å; L346-L394 HydrophobicContact CB-CD1 4.27Å; L346-L394 HydrophobicContact CD1-CD1 4.47Å
347	E	94.8	Very high	97	Very high	89 Å²	89	65.3 Å²	65.3	42%	0.416	33%	0.325	S	S	.	.	H	α-helix	trans	-60.5	-52.7	174.5	-70.8	175.4	174.5	0	0	110.8	P343 A344 A349 M350 E351	P343-E347 PolarHBondContact O-N 2.83Å; A344-E347 PolarHBondContact O-N 2.83Å; E347-A349 PolarHBondContact O-N 3.19Å; E347-M350 WeakPolarHBondContact O-CB 3.38Å; E347-M350 PolarHBondContact O-N 2.81Å; E347-M350 VanDerWaalsContact O-N 3.09Å; E347-E351 PolarHBondContact O-N 3.27Å; E347-E351 VanDerWaalsContact O-N 3.11Å
348	V	96.3	Very high	97	Very high	38 Å²	38	71.1 Å²	71.1	23%	0.23	35%	0.345	C	S	.	.	H	α-helix	trans	-58.3	-45.7	176.7	177.4	0	0	0	0	111.3	A344 M350 E351 E352 F397	A344-V348 WeakPolarHBondContact O-CG2 3.44Å; A344-V348 PolarHBondContact O-N 3.05Å; V348-M350 VanDerWaalsContact C-N 3.28Å; V348-M350 PolarHBondContact O-N 3.1Å; V348-E351 PolarHBondContact O-N 3.4Å; V348-E351 VanDerWaalsContact O-N 3.08Å; V348-E352 HydrophobicContact CG1-CG 4.32Å; V348-E352 PolarHBondContact O-N 2.93Å; V348-F397 HydrophobicContact CB-CB 4.24Å; V348-F397 HydrophobicContact CG1-CB 4.03Å; V348-F397 HydrophobicContact CG1-CD1 4.17Å
349	A	98.1	Very high	97	Very high	0 Å²	0	70.5 Å²	70.5	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-61.3	-36.9	177.8	0	0	0	0	0	112.6	A345 L346 E347 E351 D353 F356 L394 F397	A345-A349 WeakPolarHBondContact O-CB 3.26Å; A345-A349 PolarHBondContact O-N 2.83Å; L346-A349 PolarHBondContact O-N 3.42Å; E347-A349 PolarHBondContact O-N 3.19Å; A349-E351 VanDerWaalsContact C-N 3.3Å; A349-E351 PolarHBondContact O-N 3Å; A349-D353 WeakPolarHBondContact O-CB 3.46Å; A349-D353 PolarHBondContact O-N 3.19Å; A349-F356 HydrophobicContact CB-CD1 3.95Å; A349-F356 HydrophobicContact CB-CD2 3.87Å; A349-F356 HydrophobicContact CB-CE1 3.98Å; A349-F356 HydrophobicContact CB-CE2 3.89Å; A349-F356 HydrophobicContact CB-CG 3.89Å; A349-F356 HydrophobicContact CB-CZ 3.94Å; A349-L394 HydrophobicContact CB-CD1 4.16Å; A349-F397 HydrophobicContact CB-CB 4.08Å; A349-F397 HydrophobicContact CB-CD1 4.3Å; A349-F397 HydrophobicContact CB-CD2 3.52Å; A349-F397 HydrophobicContact CB-CE2 3.94Å; A349-F397 HydrophobicContact CB-CG 3.71Å; A349-F397 HydrophobicContact CB-CZ 4.49Å
350	M	97.8	Very high	97.1	Very high	94 Å²	94	69.2 Å²	69.2	46%	0.463	36%	0.356	S	S	.	.	H	α-helix	trans	-70.3	-24.5	176.3	-77.2	179.2	59	0	0	112.8	L346 E347 V348 F356 R357	L346-M350 HydrophobicContact CD1-CG 4.37Å; L346-M350 HydrophobicContact CD1-SD 4.39Å; L346-M350 HydrophobicContact CG-SD 4.22Å; L346-M350 WeakPolarHBondContact O-CB 3.5Å; L346-M350 VanDerWaalsContact O-CG 3.25Å; L346-M350 WeakPolarHBondContact O-CG 3.35Å; L346-M350 PolarHBondContact O-N 3.22Å; E347-M350 WeakPolarHBondContact O-CB 3.38Å; E347-M350 PolarHBondContact O-N 2.81Å; E347-M350 VanDerWaalsContact O-N 3.09Å; V348-M350 VanDerWaalsContact C-N 3.28Å; V348-M350 PolarHBondContact O-N 3.1Å; M350-F356 HydrophobicContact CG-CB 4.13Å; M350-R357 WeakPolarHBondContact O-CD 3.25Å; M350-R357 WeakPolarHBondContact O-CG 3.36Å; M350-R357 PolarHBondContact O-NH1 2.82Å
351	E	96.9	Very high	97.2	Very high	150 Å²	150	69 Å²	69	70%	0.701	36%	0.361	S	S	*	.	H	α-helix	trans	-82.1	-42.6	174.9	-69.6	176.7	177.1	0	0	111.5	E347 V348 A349 R357	E347-E351 PolarHBondContact O-N 3.27Å; E347-E351 VanDerWaalsContact O-N 3.11Å; V348-E351 PolarHBondContact O-N 3.4Å; V348-E351 VanDerWaalsContact O-N 3.08Å; A349-E351 VanDerWaalsContact C-N 3.3Å; A349-E351 PolarHBondContact O-N 3Å; E351-R357 PolarHBondContact O-NH1 2.95Å
352	E	97.6	Very high	97.2	Very high	134 Å²	134	75.9 Å²	75.9	63%	0.626	40%	0.397	S	S	*	.	H	α-helix	trans	-91.5	-28.8	-170.3	-63.9	-174.9	178.6	0	0	114.1	V348 F397	V348-E352 HydrophobicContact CG1-CG 4.32Å; V348-E352 PolarHBondContact O-N 2.93Å; E352-F397 HydrophobicContact CB-CD1 4.43Å; E352-F397 HydrophobicContact CB-CE1 3.99Å; E352-F397 WeakPolarHBondContact OE2-CD1 3.23Å
353	D	98.3	Very high	97.1	Very high	16 Å²	16	77.1 Å²	77.1	9%	0.086	41%	0.405	C	S	.	.			trans	-124.4	114.4	-170.1	-177.5	9.1	0	0	0	113.6	A349 E355 F356 K393 F397	A349-D353 WeakPolarHBondContact O-CB 3.46Å; A349-D353 PolarHBondContact O-N 3.19Å; D353-E355 PolarHBondContact O-N 3.03Å; D353-E355 VanDerWaalsContact O-N 3.08Å; D353-E355 WeakPolarHBondContact OD1-CB 3.4Å; D353-E355 WeakPolarHBondContact OD1-CG 3.37Å; D353-E355 PolarHBondContact OD1-N 2.87Å; D353-F356 HydrophobicContact CB-CD2 3.91Å; D353-F356 HydrophobicContact CB-CE2 4.46Å; D353-F356 PolarHBondContact O-N 2.85Å; D353-F356 WeakPolarHBondContact OD2-CD2 3.24Å; D353-F356 WeakPolarHBondContact OD2-CE2 3.36Å; D353-K393 VanDerWaalsContact CG-NZ 3.35Å; D353-K393 IonicContact OD1-NZ 2.74Å; D353-K393 WeakPolarHBondContact OD2-CD 3.4Å; D353-K393 WeakPolarHBondContact OD2-CE 3.26Å; D353-K393 IonicContact OD2-NZ 3.95Å; D353-K393 PolarHBondContact OD2-NZ 3.26Å; D353-F397 HydrophobicContact CB-CE1 4.32Å; D353-F397 HydrophobicContact CB-CZ 3.75Å
354	V	98.1	Very high	97.2	Very high	74 Å²	74	78.2 Å²	78.2	45%	0.448	40%	0.402	S	S	.	.	H	α-helix	trans	-58.5	-25	178.5	72.3	0	0	0	0	113	F356 R357 R358	V354-F356 PolarHBondContact O-N 2.86Å; V354-R357 PolarHBondContact O-N 2.76Å; V354-R358 WeakPolarHBondContact O-CG 3.24Å; V354-R358 PolarHBondContact O-N 3.13Å
355	E	97.8	Very high	97.4	Very high	45 Å²	45	82 Å²	82	21%	0.21	42%	0.418	C	S	.	.	H	α-helix	trans	-62.3	-29.3	178.1	-65.9	-66.8	114.9	0	0	112.8	D353 R358 R386 L390	D353-E355 PolarHBondContact O-N 3.03Å; D353-E355 VanDerWaalsContact O-N 3.08Å; D353-E355 WeakPolarHBondContact OD1-CB 3.4Å; D353-E355 WeakPolarHBondContact OD1-CG 3.37Å; D353-E355 PolarHBondContact OD1-N 2.87Å; E355-R358 IonicContact OE1-CZ 3.68Å; E355-R358 IonicContact OE1-NE 3.25Å; E355-R358 IonicContact OE1-NH1 3.33Å; E355-R358 PolarHBondContact OE1-NH1 3.18Å; E355-R358 IonicContact OE1-NH2 2.63Å; E355-R358 PolarHBondContact OE1-NH2 3.34Å; E355-R358 IonicContact OE2-NH1 2.76Å; E355-R358 PolarHBondContact OE2-NH1 3.45Å; E355-R386 PolarHBondContact O-NH2 2.82Å; E355-R386 VanDerWaalsContact O-NH2 3.12Å; E355-R386 IonicContact OE2-CZ 3.49Å; E355-R386 IonicContact OE2-NH1 3.41Å; E355-R386 PolarHBondContact OE2-NH1 2.85Å; E355-R386 IonicContact OE2-NH2 3.2Å; E355-R386 PolarHBondContact OE2-NH2 2.83Å; E355-L390 HydrophobicContact CB-CD2 4.07Å
356	F	97.9	Very high	97.4	Very high	33 Å²	33	85.2 Å²	85.2	15%	0.145	44%	0.437	C	S	.	.	H	α-helix	trans	-82.8	-22.7	174	-71.9	-97.9	0	0	0	112.7	L346 A349 M350 D353 V354 L390 K393 L394 F397	L346-F356 HydrophobicContact CD1-CD1 4Å; L346-F356 HydrophobicContact CD1-CE1 4.38Å; A349-F356 HydrophobicContact CB-CD1 3.95Å; A349-F356 HydrophobicContact CB-CD2 3.87Å; A349-F356 HydrophobicContact CB-CE1 3.98Å; A349-F356 HydrophobicContact CB-CE2 3.89Å; A349-F356 HydrophobicContact CB-CG 3.89Å; A349-F356 HydrophobicContact CB-CZ 3.94Å; M350-F356 HydrophobicContact CG-CB 4.13Å; D353-F356 HydrophobicContact CB-CD2 3.91Å; D353-F356 HydrophobicContact CB-CE2 4.46Å; D353-F356 PolarHBondContact O-N 2.85Å; D353-F356 WeakPolarHBondContact OD2-CD2 3.24Å; D353-F356 WeakPolarHBondContact OD2-CE2 3.36Å; V354-F356 PolarHBondContact O-N 2.86Å; F356-L390 HydrophobicContact CD1-CD2 4.45Å; F356-L390 HydrophobicContact CD2-CD2 4.2Å; F356-L390 HydrophobicContact CE1-CB 4.01Å; F356-L390 HydrophobicContact CE1-CD2 4.38Å; F356-L390 HydrophobicContact CE2-CD2 4.12Å; F356-L390 HydrophobicContact CG-CD2 4.37Å; F356-L390 HydrophobicContact CZ-CB 4.23Å; F356-L390 HydrophobicContact CZ-CD2 4.22Å; F356-L390 WeakPolarHBondContact CZ-O 3.3Å; F356-K393 HydrophobicContact CE2-CB 4.31Å; F356-K393 HydrophobicContact CE2-CD 4.12Å; F356-K393 HydrophobicContact CE2-CG 4.38Å; F356-K393 HydrophobicContact CZ-CB 4.2Å; F356-L394 HydrophobicContact CE1-CD1 4.12Å; F356-L394 HydrophobicContact CZ-CD1 4.45Å; F356-F397 HydrophobicContact CE2-CD2 4.45Å; F356-F397 AromaticContact CE2-CE2 3.81Å; F356-F397 HydrophobicContact CE2-CE2 3.81Å; F356-F397 HydrophobicContact CZ-CE2 4.33Å
357	R	98.1	Very high	97.3	Very high	126 Å²	126	82.1 Å²	82.1	48%	0.475	42%	0.421	S	S	.	.	H	α-helix	trans	-87.8	-16.1	176.4	-64.8	-167.9	-70.1	-81.7	11.3	114.3	M350 E351 V354 G359	M350-R357 WeakPolarHBondContact O-CD 3.25Å; M350-R357 WeakPolarHBondContact O-CG 3.36Å; M350-R357 PolarHBondContact O-NH1 2.82Å; E351-R357 PolarHBondContact O-NH1 2.95Å; V354-R357 PolarHBondContact O-N 2.76Å; R357-G359 PolarHBondContact O-N 2.89Å
358	R	97.9	Very high	97.5	Very high	149 Å²	149	79 Å²	79	56%	0.562	41%	0.406	S	S	*	.	S	Bend	trans	-59.3	129.7	178.5	-82.1	-173.9	176.5	152.9	9.9	110.6	V354 E355	V354-R358 WeakPolarHBondContact O-CG 3.24Å; V354-R358 PolarHBondContact O-N 3.13Å; E355-R358 IonicContact OE1-CZ 3.68Å; E355-R358 IonicContact OE1-NE 3.25Å; E355-R358 IonicContact OE1-NH1 3.33Å; E355-R358 PolarHBondContact OE1-NH1 3.18Å; E355-R358 IonicContact OE1-NH2 2.63Å; E355-R358 PolarHBondContact OE1-NH2 3.34Å; E355-R358 IonicContact OE2-NH1 2.76Å; E355-R358 PolarHBondContact OE2-NH1 3.45Å
359	G	97.8	Very high	97.5	Very high	71 Å²	71	79.4 Å²	79.4	73%	0.732	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-58	149.5	178	0	0	0	0	0	112.8	R357	R357-G359 PolarHBondContact O-N 2.89Å
360	L	97.9	Very high	97.4	Very high	103 Å²	103	85.9 Å²	85.9	54%	0.539	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-61.3	152.9	174.7	-64.5	177.1	0	0	0	111.1	L362 Y364 F383	L360-L362 PolarHBondContact O-N 2.78Å; L360-Y364 HydrophobicContact CB-CD1 4.13Å; L360-Y364 HydrophobicContact CB-CE1 4.28Å; L360-Y364 HydrophobicContact CD1-CD1 4.35Å; L360-Y364 HydrophobicContact CD1-CE1 3.86Å; L360-Y364 HydrophobicContact CD1-CE2 4.17Å; L360-F383 HydrophobicContact CD2-CE2 4.26Å; L360-F383 HydrophobicContact CD2-CZ 4.18Å
361	P	97.5	Very high	97.3	Very high	65 Å²	65	88.7 Å²	88.7	42%	0.422	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-55.7	137.5	174.2	-24	33.6	0	0	0	111.7	Y364 Y367 F383	P361-Y364 WeakPolarHBondContact O-CB 3.5Å; P361-Y364 WeakPolarHBondContact O-CD1 3.41Å; P361-Y364 PolarHBondContact O-N 2.83Å; P361-Y367 WeakPolarHBondContact CB-OH 3.36Å; P361-F383 HydrophobicContact CG-CD2 4.22Å; P361-F383 HydrophobicContact CG-CE2 4.5Å
362	L	96.8	Very high	97.2	Very high	157 Å²	157	81.7 Å²	81.7	82%	0.822	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	145.2	171.8	-61.4	179.2	0	0	0	110.1	L360 Y364	L360-L362 PolarHBondContact O-N 2.78Å; L362-Y364 PolarHBondContact O-N 2.83Å
363	N	96.1	Very high	97	Very high	115 Å²	115	77.8 Å²	77.8	62%	0.615	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.3	17.8	-179.9	-50.3	-38.3	0	0	0	115.2	L365 T366	N363-L365 PolarHBondContact O-N 3.15Å; N363-L365 VanDerWaalsContact O-N 3.11Å; N363-T366 HydrophobicContact CB-CG2 4.16Å; N363-T366 WeakPolarHBondContact O-CB 3.35Å; N363-T366 PolarHBondContact O-N 2.96Å; N363-T366 PolarHBondContact O-OG1 3.32Å
364	Y	97.3	Very high	96.8	Very high	79 Å²	79	84.3 Å²	84.3	31%	0.31	46%	0.459	S	S	.	.	G	3₁₀ helix	trans	-55.8	-29.6	177.8	80.2	-81.7	0	0	0	113.7	L360 P361 L362 T366 Y367 M368 F383	L360-Y364 HydrophobicContact CB-CD1 4.13Å; L360-Y364 HydrophobicContact CB-CE1 4.28Å; L360-Y364 HydrophobicContact CD1-CD1 4.35Å; L360-Y364 HydrophobicContact CD1-CE1 3.86Å; L360-Y364 HydrophobicContact CD1-CE2 4.17Å; P361-Y364 WeakPolarHBondContact O-CB 3.5Å; P361-Y364 WeakPolarHBondContact O-CD1 3.41Å; P361-Y364 PolarHBondContact O-N 2.83Å; L362-Y364 PolarHBondContact O-N 2.83Å; Y364-T366 PolarHBondContact O-N 3.42Å; Y364-T366 VanDerWaalsContact O-N 3.11Å; Y364-Y367 VanDerWaalsContact CA-CE1 3.43Å; Y364-Y367 PolarHBondContact O-N 3.17Å; Y364-Y367 VanDerWaalsContact O-N 3.14Å; Y364-M368 HydrophobicContact CD2-CB 4.19Å; Y364-M368 HydrophobicContact CD2-CG 4.34Å; Y364-M368 WeakPolarHBondContact O-CB 3.18Å; Y364-M368 PolarHBondContact O-N 2.85Å; Y364-F383 HydrophobicContact CD2-CE2 4.15Å; Y364-F383 HydrophobicContact CD2-CZ 4.35Å; Y364-F383 HydrophobicContact CG-CE2 4.25Å
365	L	97.6	Very high	96.5	Very high	108 Å²	108	86.4 Å²	86.4	57%	0.565	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-61.1	-17.5	174.8	-61	176.9	0	0	0	114.2	N363 Q371 N372	N363-L365 PolarHBondContact O-N 3.15Å; N363-L365 VanDerWaalsContact O-N 3.11Å; L365-Q371 PolarHBondContact O-NE2 2.88Å; L365-N372 PolarHBondContact O-ND2 2.77Å
366	T	97.1	Very high	96.2	Very high	69 Å²	69	94 Å²	94	42%	0.423	50%	0.497	S	S	.	.	G	3₁₀ helix	trans	-81.7	-15.9	178.4	67	0	0	0	0	113.5	N363 Y364 N372	N363-T366 HydrophobicContact CB-CG2 4.16Å; N363-T366 WeakPolarHBondContact O-CB 3.35Å; N363-T366 PolarHBondContact O-N 2.96Å; N363-T366 PolarHBondContact O-OG1 3.32Å; Y364-T366 PolarHBondContact O-N 3.42Å; Y364-T366 VanDerWaalsContact O-N 3.11Å; T366-N372 VanDerWaalsContact C-ND2 3.29Å; T366-N372 PolarHBondContact O-ND2 2.8Å; T366-N372 PolarHBondContact O-OD1 3.23Å
367	Y	96.6	Very high	96.1	Very high	10 Å²	10	94.2 Å²	94.2	4%	0.039	50%	0.5	C	S	.	.	T	Hydrogen-bonded Turn	trans	-135.6	-7.9	-177.8	62.1	-96.4	0	0	0	114.7	P361 Y364 N372 R379 R380 F383	P361-Y367 WeakPolarHBondContact CB-OH 3.36Å; Y364-Y367 VanDerWaalsContact CA-CE1 3.43Å; Y364-Y367 PolarHBondContact O-N 3.17Å; Y364-Y367 VanDerWaalsContact O-N 3.14Å; Y367-N372 PolarHBondContact N-ND2 3.43Å; Y367-R379 HydrophobicContact CD1-CB 4.24Å; Y367-R379 VanDerWaalsContact CD1-CZ 3.42Å; Y367-R379 HydrophobicContact CD2-CB 3.95Å; Y367-R379 HydrophobicContact CE1-CB 4.1Å; Y367-R379 HydrophobicContact CE2-CB 3.86Å; Y367-R379 HydrophobicContact CG-CB 4.16Å; Y367-R380 HydrophobicContact CD2-CB 4.48Å; Y367-R380 PolarHBondContact O-NH1 2.64Å; Y367-F383 HydrophobicContact CE2-CB 4.12Å; Y367-F383 HydrophobicContact CE2-CD2 4.16Å; Y367-F383 HydrophobicContact CE2-CG 4.42Å
368	M	97.3	Very high	96	Very high	24 Å²	24	92.7 Å²	92.7	12%	0.118	51%	0.506	C	S	.	.	S	Bend	trans	-107.4	167.7	171.4	-58.9	-54.5	-63.8	0	0	111.5	Y364 N372 R380 F383 L384	Y364-M368 HydrophobicContact CD2-CB 4.19Å; Y364-M368 HydrophobicContact CD2-CG 4.34Å; Y364-M368 WeakPolarHBondContact O-CB 3.18Å; Y364-M368 PolarHBondContact O-N 2.85Å; M368-N372 PolarHBondContact O-ND2 2.8Å; M368-R380 HydrophobicContact CE-CG 4.39Å; M368-R380 HydrophobicContact SD-CB 4.26Å; M368-R380 HydrophobicContact SD-CG 3.75Å; M368-F383 HydrophobicContact CE-CD1 3.51Å; M368-F383 HydrophobicContact CE-CE1 3.9Å; M368-F383 HydrophobicContact CE-CG 4.15Å; M368-F383 HydrophobicContact CG-CD1 4.15Å; M368-F383 HydrophobicContact CG-CD2 4.1Å; M368-F383 HydrophobicContact CG-CE1 4.33Å; M368-F383 HydrophobicContact CG-CE2 4.27Å; M368-F383 HydrophobicContact CG-CG 4.04Å; M368-F383 HydrophobicContact CG-CZ 4.39Å; M368-F383 HydrophobicContact SD-CB 3.98Å; M368-F383 HydrophobicContact SD-CD1 3.87Å; M368-F383 HydrophobicContact SD-CD2 4.5Å; M368-F383 HydrophobicContact SD-CG 3.87Å; M368-L384 HydrophobicContact CE-CD2 4.15Å; M368-L384 HydrophobicContact CE-CG 4.45Å
369	G	96.3	Very high	95.9	Very high	46 Å²	46	90.7 Å²	90.7	47%	0.474	50%	0.499	S	S	.	.	S	Bend	trans	87.5	169.1	-178.2	0	0	0	0	0	114.3	Q371 N372 S373	G369-Q371 VanDerWaalsContact C-N 3.33Å; G369-Q371 PolarHBondContact O-N 2.86Å; G369-N372 CarbonylContact O-C 3.5Å; G369-N372 PolarHBondContact O-N 3.3Å; G369-S373 PolarHBondContact O-N 2.88Å
370	V	96.7	Very high	95.9	Very high	135 Å²	135	90.1 Å²	90.1	82%	0.818	48%	0.475	S	S	*	.	G	3₁₀ helix	trans	-58.1	-41.6	-173.2	176.8	0	0	0	0	112	N372 S373	V370-N372 PolarHBondContact O-N 3.41Å; V370-S373 PolarHBondContact O-N 3.14Å; V370-S373 VanDerWaalsContact O-N 3.15Å; V370-S373 PolarHBondContact O-OG 3.49Å
371	Q	96.1	Very high	95.7	Very high	154 Å²	154	92.3 Å²	92.3	72%	0.72	48%	0.482	S	S	*	.	G	3₁₀ helix	trans	-62.1	-15.8	178.9	73	178.6	13.6	0	0	114.4	L365 G369	L365-Q371 PolarHBondContact O-NE2 2.88Å; G369-Q371 VanDerWaalsContact C-N 3.33Å; G369-Q371 PolarHBondContact O-N 2.86Å
372	N	95.4	Very high	95.7	Very high	2 Å²	2	95.1 Å²	95.1	1%	0.011	49%	0.492	C	S	.	.	G	3₁₀ helix	trans	-120.2	11.2	-178.1	-59.2	-51.9	0	0	0	112.3	L365 T366 Y367 M368 G369 V370 D374 K375	L365-N372 PolarHBondContact O-ND2 2.77Å; T366-N372 VanDerWaalsContact C-ND2 3.29Å; T366-N372 PolarHBondContact O-ND2 2.8Å; T366-N372 PolarHBondContact O-OD1 3.23Å; Y367-N372 PolarHBondContact N-ND2 3.43Å; M368-N372 PolarHBondContact O-ND2 2.8Å; G369-N372 CarbonylContact O-C 3.5Å; G369-N372 PolarHBondContact O-N 3.3Å; V370-N372 PolarHBondContact O-N 3.41Å; N372-D374 PolarHBondContact O-N 3.46Å; N372-K375 HydrophobicContact CB-CD 4.24Å; N372-K375 PolarHBondContact O-N 3.11Å; N372-K375 WeakPolarHBondContact OD1-CD 3.46Å; N372-K375 WeakPolarHBondContact OD1-CE 3.29Å; N372-K375 PolarHBondContact OD1-NZ 3.1Å
373	S	93.4	Very high	95.7	Very high	53 Å²	53	89.1 Å²	89.1	37%	0.371	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-32.1	-173.7	61	0	0	0	0	113.6	G369 V370	G369-S373 PolarHBondContact O-N 2.88Å; V370-S373 PolarHBondContact O-N 3.14Å; V370-S373 VanDerWaalsContact O-N 3.15Å; V370-S373 PolarHBondContact O-OG 3.49Å
374	D	92.9	Very high	95.7	Very high	152 Å²	152	87.7 Å²	87.7	81%	0.813	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	0.9	-173.4	-54.4	-14.8	0	0	0	112.3	N372	N372-D374 PolarHBondContact O-N 3.46Å
375	K	91.2	Very high	95.7	Very high	119 Å²	119	86.1 Å²	86.1	52%	0.517	45%	0.452	S	S	.	.			trans	-78.2	128	177.6	-70.3	-174	-177.4	169.1	0	109.9	N372 D377	N372-K375 HydrophobicContact CB-CD 4.24Å; N372-K375 PolarHBondContact O-N 3.11Å; N372-K375 WeakPolarHBondContact OD1-CD 3.46Å; N372-K375 WeakPolarHBondContact OD1-CE 3.29Å; N372-K375 PolarHBondContact OD1-NZ 3.1Å; K375-D377 PolarHBondContact O-N 2.99Å; K375-D377 VanDerWaalsContact O-N 3.12Å
376	E	92.8	Very high	95.8	Very high	204 Å²	204	85.2 Å²	85.2	95%	0.953	44%	0.441	S	S	*	.			trans	-77.5	93.5	169.9	-65	-171.6	175.2	0	0	109.3
377	D	95.6	Very high	95.8	Very high	37 Å²	37	84.8 Å²	84.8	20%	0.198	44%	0.438	C	S	.	.			trans	-127.5	120	176	-169.2	-45.8	0	0	0	109.8	K375 R379 R380	K375-D377 PolarHBondContact O-N 2.99Å; K375-D377 VanDerWaalsContact O-N 3.12Å; D377-R379 PolarHBondContact O-N 3.27Å; D377-R379 VanDerWaalsContact O-N 3.09Å; D377-R379 WeakPolarHBondContact OD1-CB 3.27Å; D377-R379 VanDerWaalsContact OD1-CG 3.28Å; D377-R379 WeakPolarHBondContact OD1-CG 3.49Å; D377-R379 IonicContact OD1-CZ 3.89Å; D377-R379 PolarHBondContact OD1-N 2.86Å; D377-R379 IonicContact OD1-NE 2.96Å; D377-R379 PolarHBondContact OD1-NE 3.35Å; D377-R379 IonicContact OD1-NH2 3.96Å; D377-R379 IonicContact OD2-CZ 3.31Å; D377-R379 VanDerWaalsContact OD2-CZ 3.31Å; D377-R379 IonicContact OD2-NE 3.16Å; D377-R379 PolarHBondContact OD2-NE 3.39Å; D377-R379 VanDerWaalsContact OD2-NE 3.16Å; D377-R379 IonicContact OD2-NH2 2.66Å; D377-R379 PolarHBondContact OD2-NH2 3.14Å; D377-R380 WeakPolarHBondContact O-CB 3.4Å; D377-R380 PolarHBondContact O-N 2.64Å
378	P	95.4	Very high	95.9	Very high	94 Å²	94	89 Å²	89	61%	0.61	46%	0.458	S	S	*	.	H	α-helix	trans	-61.3	-22.8	-176.8	25.1	-34.6	0	0	0	113.2	R380 E381 I382	P378-R380 PolarHBondContact O-N 3.48Å; P378-E381 PolarHBondContact O-N 3.13Å; P378-I382 PolarHBondContact O-N 2.87Å
379	R	96.8	Very high	95.9	Very high	107 Å²	107	94.2 Å²	94.2	40%	0.404	48%	0.48	S	S	.	.	H	α-helix	trans	-66.2	-26.6	176.3	-58.8	174.4	-68.2	171.5	2.5	112	Y367 D377 I382 F383	Y367-R379 HydrophobicContact CD1-CB 4.24Å; Y367-R379 VanDerWaalsContact CD1-CZ 3.42Å; Y367-R379 HydrophobicContact CD2-CB 3.95Å; Y367-R379 HydrophobicContact CE1-CB 4.1Å; Y367-R379 HydrophobicContact CE2-CB 3.86Å; Y367-R379 HydrophobicContact CG-CB 4.16Å; D377-R379 PolarHBondContact O-N 3.27Å; D377-R379 VanDerWaalsContact O-N 3.09Å; D377-R379 WeakPolarHBondContact OD1-CB 3.27Å; D377-R379 VanDerWaalsContact OD1-CG 3.28Å; D377-R379 WeakPolarHBondContact OD1-CG 3.49Å; D377-R379 IonicContact OD1-CZ 3.89Å; D377-R379 PolarHBondContact OD1-N 2.86Å; D377-R379 IonicContact OD1-NE 2.96Å; D377-R379 PolarHBondContact OD1-NE 3.35Å; D377-R379 IonicContact OD1-NH2 3.96Å; D377-R379 IonicContact OD2-CZ 3.31Å; D377-R379 VanDerWaalsContact OD2-CZ 3.31Å; D377-R379 IonicContact OD2-NE 3.16Å; D377-R379 PolarHBondContact OD2-NE 3.39Å; D377-R379 VanDerWaalsContact OD2-NE 3.16Å; D377-R379 IonicContact OD2-NH2 2.66Å; D377-R379 PolarHBondContact OD2-NH2 3.14Å; R379-I382 PolarHBondContact O-N 3.28Å; R379-F383 WeakPolarHBondContact O-CB 3.41Å; R379-F383 PolarHBondContact O-N 3.36Å
380	R	96.3	Very high	96	Very high	59 Å²	59	93.8 Å²	93.8	22%	0.223	47%	0.467	C	S	.	.	H	α-helix	trans	-65.7	-43.1	177.4	-172.4	176.4	173.1	83.6	4	111.4	Y367 M368 D377 P378 I382 F383 L384	Y367-R380 HydrophobicContact CD2-CB 4.48Å; Y367-R380 PolarHBondContact O-NH1 2.64Å; M368-R380 HydrophobicContact CE-CG 4.39Å; M368-R380 HydrophobicContact SD-CB 4.26Å; M368-R380 HydrophobicContact SD-CG 3.75Å; D377-R380 WeakPolarHBondContact O-CB 3.4Å; D377-R380 PolarHBondContact O-N 2.64Å; P378-R380 PolarHBondContact O-N 3.48Å; R380-I382 VanDerWaalsContact C-N 3.35Å; R380-F383 PolarHBondContact O-N 3.45Å; R380-L384 HydrophobicContact CG-CD1 4.24Å; R380-L384 WeakPolarHBondContact O-CG 3.27Å; R380-L384 PolarHBondContact O-N 2.79Å
381	E	95	Very high	96.1	Very high	150 Å²	150	92.5 Å²	92.5	70%	0.701	45%	0.454	S	S	*	.	H	α-helix	trans	-63.5	-42.5	176.7	-64.1	-175.5	166.5	0	0	111.3	P378 F383 L384 S385	P378-E381 PolarHBondContact O-N 3.13Å; E381-F383 PolarHBondContact O-N 3.01Å; E381-L384 PolarHBondContact O-N 3.36Å; E381-S385 WeakPolarHBondContact O-CB 3.34Å; E381-S385 PolarHBondContact O-N 2.85Å
382	I	96.8	Very high	96.2	Very high	123 Å²	123	91.7 Å²	91.7	63%	0.631	45%	0.448	S	S	*	.	H	α-helix	trans	-62.2	-44.6	176.2	-61.6	170	0	0	0	110.7	P378 R379 R380 S385 R386	P378-I382 PolarHBondContact O-N 2.87Å; R379-I382 PolarHBondContact O-N 3.28Å; R380-I382 VanDerWaalsContact C-N 3.35Å; I382-S385 PolarHBondContact O-N 2.98Å; I382-R386 PolarHBondContact O-N 2.9Å
383	F	97.5	Very high	96.3	Very high	32 Å²	32	95.2 Å²	95.2	14%	0.14	46%	0.464	C	S	.	.	H	α-helix	trans	-61.9	-48.4	178	-170.2	-76.3	0	0	0	111.5	L360 P361 Y364 Y367 M368 R379 R380 E381 S385 R386 V387	L360-F383 HydrophobicContact CD2-CE2 4.26Å; L360-F383 HydrophobicContact CD2-CZ 4.18Å; P361-F383 HydrophobicContact CG-CD2 4.22Å; P361-F383 HydrophobicContact CG-CE2 4.5Å; Y364-F383 HydrophobicContact CD2-CE2 4.15Å; Y364-F383 HydrophobicContact CD2-CZ 4.35Å; Y364-F383 HydrophobicContact CG-CE2 4.25Å; Y367-F383 HydrophobicContact CE2-CB 4.12Å; Y367-F383 HydrophobicContact CE2-CD2 4.16Å; Y367-F383 HydrophobicContact CE2-CG 4.42Å; M368-F383 HydrophobicContact CE-CD1 3.51Å; M368-F383 HydrophobicContact CE-CE1 3.9Å; M368-F383 HydrophobicContact CE-CG 4.15Å; M368-F383 HydrophobicContact CG-CD1 4.15Å; M368-F383 HydrophobicContact CG-CD2 4.1Å; M368-F383 HydrophobicContact CG-CE1 4.33Å; M368-F383 HydrophobicContact CG-CE2 4.27Å; M368-F383 HydrophobicContact CG-CG 4.04Å; M368-F383 HydrophobicContact CG-CZ 4.39Å; M368-F383 HydrophobicContact SD-CB 3.98Å; M368-F383 HydrophobicContact SD-CD1 3.87Å; M368-F383 HydrophobicContact SD-CD2 4.5Å; M368-F383 HydrophobicContact SD-CG 3.87Å; R379-F383 WeakPolarHBondContact O-CB 3.41Å; R379-F383 PolarHBondContact O-N 3.36Å; R380-F383 PolarHBondContact O-N 3.45Å; E381-F383 PolarHBondContact O-N 3.01Å; F383-S385 PolarHBondContact O-N 2.81Å; F383-R386 WeakPolarHBondContact O-CB 3.34Å; F383-R386 PolarHBondContact O-N 2.94Å; F383-V387 HydrophobicContact CD1-CG2 4.03Å; F383-V387 HydrophobicContact CE1-CG2 3.8Å; F383-V387 WeakPolarHBondContact O-CG2 3.4Å; F383-V387 PolarHBondContact O-N 2.98Å
384	L	96.6	Very high	96.5	Very high	85 Å²	85	93.9 Å²	93.9	45%	0.445	45%	0.452	S	S	.	.	H	α-helix	trans	-63.9	-40.1	178.1	-68.8	173.5	0	0	0	111.9	M368 R380 E381 R386 V387 E388	M368-L384 HydrophobicContact CE-CD2 4.15Å; M368-L384 HydrophobicContact CE-CG 4.45Å; R380-L384 HydrophobicContact CG-CD1 4.24Å; R380-L384 WeakPolarHBondContact O-CG 3.27Å; R380-L384 PolarHBondContact O-N 2.79Å; E381-L384 PolarHBondContact O-N 3.36Å; L384-R386 VanDerWaalsContact C-N 3.28Å; L384-R386 PolarHBondContact O-N 3.34Å; L384-V387 PolarHBondContact O-N 3.43Å; L384-E388 WeakPolarHBondContact O-CB 3.46Å; L384-E388 PolarHBondContact O-N 3.42Å
385	S	97.6	Very high	96.7	Very high	46 Å²	46	90.8 Å²	90.8	32%	0.322	44%	0.441	S	S	.	.	H	α-helix	trans	-62.1	-36.7	174.2	-176.2	0	0	0	0	112	E381 I382 F383 K389	E381-S385 WeakPolarHBondContact O-CB 3.34Å; E381-S385 PolarHBondContact O-N 2.85Å; I382-S385 PolarHBondContact O-N 2.98Å; F383-S385 PolarHBondContact O-N 2.81Å; S385-K389 WeakPolarHBondContact O-CB 3.11Å; S385-K389 VanDerWaalsContact O-CG 3.24Å; S385-K389 WeakPolarHBondContact O-CG 3.38Å; S385-K389 PolarHBondContact O-N 3.2Å
386	R	97.8	Very high	97	Very high	88 Å²	88	91.3 Å²	91.3	33%	0.332	45%	0.449	S	S	.	.	H	α-helix	trans	-65.5	-45.3	174.3	-178.1	63.1	178.6	-173.7	4.2	111.5	E355 I382 F383 L384 K389 L390	E355-R386 PolarHBondContact O-NH2 2.82Å; E355-R386 VanDerWaalsContact O-NH2 3.12Å; E355-R386 IonicContact OE2-CZ 3.49Å; E355-R386 IonicContact OE2-NH1 3.41Å; E355-R386 PolarHBondContact OE2-NH1 2.85Å; E355-R386 IonicContact OE2-NH2 3.2Å; E355-R386 PolarHBondContact OE2-NH2 2.83Å; I382-R386 PolarHBondContact O-N 2.9Å; F383-R386 WeakPolarHBondContact O-CB 3.34Å; F383-R386 PolarHBondContact O-N 2.94Å; L384-R386 VanDerWaalsContact C-N 3.28Å; L384-R386 PolarHBondContact O-N 3.34Å; R386-K389 PolarHBondContact O-N 3.29Å; R386-L390 WeakPolarHBondContact O-CG 3.44Å; R386-L390 PolarHBondContact O-N 3.31Å; R386-L390 VanDerWaalsContact O-N 3.1Å
387	V	98	Very high	97.3	Very high	60 Å²	60	82.8 Å²	82.8	36%	0.364	41%	0.409	S	S	.	.	H	α-helix	trans	-58.7	-48.4	175	172	0	0	0	0	110.7	F383 L384 K389 L390 I391	F383-V387 HydrophobicContact CD1-CG2 4.03Å; F383-V387 HydrophobicContact CE1-CG2 3.8Å; F383-V387 WeakPolarHBondContact O-CG2 3.4Å; F383-V387 PolarHBondContact O-N 2.98Å; L384-V387 PolarHBondContact O-N 3.43Å; V387-K389 VanDerWaalsContact C-N 3.33Å; V387-K389 PolarHBondContact O-N 2.95Å; V387-L390 PolarHBondContact O-N 3.13Å; V387-I391 HydrophobicContact CG1-CD1 3.66Å; V387-I391 HydrophobicContact CG1-CG1 4.3Å; V387-I391 WeakPolarHBondContact O-CG1 3.32Å; V387-I391 PolarHBondContact O-N 3.32Å
388	E	98.1	Very high	97.3	Very high	99 Å²	99	82.5 Å²	82.5	46%	0.463	41%	0.412	S	S	.	.	H	α-helix	trans	-59.9	-41.5	179	-171.1	-170.9	166.8	0	0	112.1	L384 I391 K392	L384-E388 WeakPolarHBondContact O-CB 3.46Å; L384-E388 PolarHBondContact O-N 3.42Å; E388-I391 PolarHBondContact O-N 2.81Å; E388-K392 HydrophobicContact CG-CD 4.37Å; E388-K392 WeakPolarHBondContact O-CB 3.41Å; E388-K392 VanDerWaalsContact O-CG 3.31Å; E388-K392 WeakPolarHBondContact O-CG 3.22Å; E388-K392 PolarHBondContact O-N 2.81Å; E388-K392 WeakPolarHBondContact OE1-CE 3.49Å; E388-K392 IonicContact OE1-NZ 2.66Å; E388-K392 PolarHBondContact OE1-NZ 3.46Å
389	K	98.2	Very high	97.3	Very high	133 Å²	133	79.8 Å²	79.8	58%	0.578	39%	0.394	S	S	*	.	H	α-helix	trans	-61.9	-42.5	176.1	-76	171.5	-174.9	178	0	112.3	S385 R386 V387 K392 K393	S385-K389 WeakPolarHBondContact O-CB 3.11Å; S385-K389 VanDerWaalsContact O-CG 3.24Å; S385-K389 WeakPolarHBondContact O-CG 3.38Å; S385-K389 PolarHBondContact O-N 3.2Å; R386-K389 PolarHBondContact O-N 3.29Å; V387-K389 VanDerWaalsContact C-N 3.33Å; V387-K389 PolarHBondContact O-N 2.95Å; K389-K392 PolarHBondContact O-N 3.05Å; K389-K393 PolarHBondContact O-N 3.31Å
390	L	98.4	Very high	97.3	Very high	38 Å²	38	78 Å²	78	20%	0.199	40%	0.395	C	S	.	.	H	α-helix	trans	-68.7	-43.6	177.9	-66.9	176.3	0	0	0	111.2	E355 F356 R386 V387 K392 K393 L394	E355-L390 HydrophobicContact CB-CD2 4.07Å; F356-L390 HydrophobicContact CD1-CD2 4.45Å; F356-L390 HydrophobicContact CD2-CD2 4.2Å; F356-L390 HydrophobicContact CE1-CB 4.01Å; F356-L390 HydrophobicContact CE1-CD2 4.38Å; F356-L390 HydrophobicContact CE2-CD2 4.12Å; F356-L390 HydrophobicContact CG-CD2 4.37Å; F356-L390 HydrophobicContact CZ-CB 4.23Å; F356-L390 HydrophobicContact CZ-CD2 4.22Å; F356-L390 WeakPolarHBondContact CZ-O 3.3Å; R386-L390 WeakPolarHBondContact O-CG 3.44Å; R386-L390 PolarHBondContact O-N 3.31Å; R386-L390 VanDerWaalsContact O-N 3.1Å; V387-L390 PolarHBondContact O-N 3.13Å; L390-K392 VanDerWaalsContact C-N 3.29Å; L390-K392 PolarHBondContact O-N 2.77Å; L390-K393 WeakPolarHBondContact O-CA 3.33Å; L390-K393 WeakPolarHBondContact O-CB 3.38Å; L390-K393 PolarHBondContact O-N 3.35Å; L390-L394 PolarHBondContact O-N 3.49Å
391	I	97.9	Very high	97.2	Very high	107 Å²	107	81.5 Å²	81.5	55%	0.549	42%	0.418	S	S	.	.	H	α-helix	trans	-59.2	-40.5	174.4	-68.8	172.6	0	0	0	111.1	V387 E388 K393 L394 P395	V387-I391 HydrophobicContact CG1-CD1 3.66Å; V387-I391 HydrophobicContact CG1-CG1 4.3Å; V387-I391 WeakPolarHBondContact O-CG1 3.32Å; V387-I391 PolarHBondContact O-N 3.32Å; E388-I391 PolarHBondContact O-N 2.81Å; I391-K393 PolarHBondContact O-N 2.96Å; I391-L394 WeakPolarHBondContact O-CB 3.29Å; I391-L394 PolarHBondContact O-N 2.92Å; I391-P395 VanDerWaalsContact O-CD 3.3Å; I391-P395 WeakPolarHBondContact O-CD 3.22Å
392	K	98	Very high	97.1	Very high	137 Å²	137	76.8 Å²	76.8	60%	0.596	41%	0.405	S	S	*	.	H	α-helix	trans	-65.8	-24.5	175.4	-76.7	175.7	-177.4	171.2	0	113.7	E388 K389 L390	E388-K392 HydrophobicContact CG-CD 4.37Å; E388-K392 WeakPolarHBondContact O-CB 3.41Å; E388-K392 VanDerWaalsContact O-CG 3.31Å; E388-K392 WeakPolarHBondContact O-CG 3.22Å; E388-K392 PolarHBondContact O-N 2.81Å; E388-K392 WeakPolarHBondContact OE1-CE 3.49Å; E388-K392 IonicContact OE1-NZ 2.66Å; E388-K392 PolarHBondContact OE1-NZ 3.46Å; K389-K392 PolarHBondContact O-N 3.05Å; L390-K392 VanDerWaalsContact C-N 3.29Å; L390-K392 PolarHBondContact O-N 2.77Å
393	K	98	Very high	97.1	Very high	76 Å²	76	71.1 Å²	71.1	33%	0.33	38%	0.377	S	S	.	.	H	α-helix	trans	-86.2	-26.3	177.6	-161.2	177.5	177.1	178	0	112.2	D353 F356 K389 L390 I391 N396 F397	D353-K393 VanDerWaalsContact CG-NZ 3.35Å; D353-K393 IonicContact OD1-NZ 2.74Å; D353-K393 WeakPolarHBondContact OD2-CD 3.4Å; D353-K393 WeakPolarHBondContact OD2-CE 3.26Å; D353-K393 IonicContact OD2-NZ 3.95Å; D353-K393 PolarHBondContact OD2-NZ 3.26Å; F356-K393 HydrophobicContact CE2-CB 4.31Å; F356-K393 HydrophobicContact CE2-CD 4.12Å; F356-K393 HydrophobicContact CE2-CG 4.38Å; F356-K393 HydrophobicContact CZ-CB 4.2Å; K389-K393 PolarHBondContact O-N 3.31Å; L390-K393 WeakPolarHBondContact O-CA 3.33Å; L390-K393 WeakPolarHBondContact O-CB 3.38Å; L390-K393 PolarHBondContact O-N 3.35Å; I391-K393 PolarHBondContact O-N 2.96Å; K393-N396 WeakPolarHBondContact O-CB 3.36Å; K393-N396 PolarHBondContact O-N 3.45Å; K393-N396 VanDerWaalsContact O-N 3.11Å; K393-F397 HydrophobicContact CD-CE2 4.4Å; K393-F397 HydrophobicContact CG-CE2 4.04Å
394	L	97.7	Very high	97	Very high	25 Å²	25	72.1 Å²	72.1	13%	0.131	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-52.3	-39.7	-176.6	-168.5	65.1	0	0	0	114.9	I342 A345 L346 A349 F356 L390 I391 N396 F397	I342-L394 HydrophobicContact CG2-CD2 4.22Å; A345-L394 HydrophobicContact CB-CD1 3.86Å; A345-L394 HydrophobicContact CB-CG 3.95Å; L346-L394 HydrophobicContact CB-CD1 4.27Å; L346-L394 HydrophobicContact CD1-CD1 4.47Å; A349-L394 HydrophobicContact CB-CD1 4.16Å; F356-L394 HydrophobicContact CE1-CD1 4.12Å; F356-L394 HydrophobicContact CZ-CD1 4.45Å; L390-L394 PolarHBondContact O-N 3.49Å; I391-L394 WeakPolarHBondContact O-CB 3.29Å; I391-L394 PolarHBondContact O-N 2.92Å; L394-N396 PolarHBondContact O-N 2.84Å; L394-N396 VanDerWaalsContact O-N 3.08Å; L394-F397 PolarHBondContact O-N 3.09Å
395	P	97.4	Very high	96.9	Very high	88 Å²	88	69.3 Å²	69.3	57%	0.571	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-59.1	-23.2	179.1	-26.8	36.1	0	0	0	114.7	I391 F397 A398	I391-P395 VanDerWaalsContact O-CD 3.3Å; I391-P395 WeakPolarHBondContact O-CD 3.22Å; P395-F397 PolarHBondContact O-N 3.37Å; P395-A398 WeakPolarHBondContact O-CB 3.42Å; P395-A398 PolarHBondContact O-N 3.07Å
396	N	97.7	Very high	96.7	Very high	129 Å²	129	70.4 Å²	70.4	69%	0.69	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-68.8	-14.9	177.9	-61.9	-23.7	0	0	0	113	K393 L394	K393-N396 WeakPolarHBondContact O-CB 3.36Å; K393-N396 PolarHBondContact O-N 3.45Å; K393-N396 VanDerWaalsContact O-N 3.11Å; L394-N396 PolarHBondContact O-N 2.84Å; L394-N396 VanDerWaalsContact O-N 3.08Å
397	F	97.8	Very high	96.6	Very high	25 Å²	25	68.3 Å²	68.3	11%	0.11	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-111.8	7.3	-178.6	-55.1	-79.1	0	0	0	112	A345 V348 A349 E352 D353 F356 K393 L394 P395 P399	A345-F397 WeakPolarHBondContact CA-O 3.43Å; V348-F397 HydrophobicContact CB-CB 4.24Å; V348-F397 HydrophobicContact CG1-CB 4.03Å; V348-F397 HydrophobicContact CG1-CD1 4.17Å; A349-F397 HydrophobicContact CB-CB 4.08Å; A349-F397 HydrophobicContact CB-CD1 4.3Å; A349-F397 HydrophobicContact CB-CD2 3.52Å; A349-F397 HydrophobicContact CB-CE2 3.94Å; A349-F397 HydrophobicContact CB-CG 3.71Å; A349-F397 HydrophobicContact CB-CZ 4.49Å; E352-F397 HydrophobicContact CB-CD1 4.43Å; E352-F397 HydrophobicContact CB-CE1 3.99Å; E352-F397 WeakPolarHBondContact OE2-CD1 3.23Å; D353-F397 HydrophobicContact CB-CE1 4.32Å; D353-F397 HydrophobicContact CB-CZ 3.75Å; F356-F397 HydrophobicContact CE2-CD2 4.45Å; F356-F397 AromaticContact CE2-CE2 3.81Å; F356-F397 HydrophobicContact CE2-CE2 3.81Å; F356-F397 HydrophobicContact CZ-CE2 4.33Å; K393-F397 HydrophobicContact CD-CE2 4.4Å; K393-F397 HydrophobicContact CG-CE2 4.04Å; L394-F397 PolarHBondContact O-N 3.09Å; P395-F397 PolarHBondContact O-N 3.37Å; F397-P399 WeakPolarHBondContact O-CD 3.48Å
398	A	96.8	Very high	96.4	Very high	32 Å²	32	66.1 Å²	66.1	26%	0.264	35%	0.352	S	S	.	.			trans	-74.4	112.7	-171.2	0	0	0	0	0	112.1	V341 A345 P395 V400	V341-A398 HydrophobicContact CG1-CB 3.83Å; A345-A398 HydrophobicContact CB-CB 4.23Å; P395-A398 WeakPolarHBondContact O-CB 3.42Å; P395-A398 PolarHBondContact O-N 3.07Å; A398-V400 VanDerWaalsContact C-N 3.27Å; A398-V400 HydrophobicContact CB-CG2 4.19Å; A398-V400 PolarHBondContact O-N 2.95Å
399	P	95.4	Very high	96.2	Very high	36 Å²	36	63.1 Å²	63.1	23%	0.234	34%	0.337	C	S	.	.			trans	-86.2	72.4	178.7	36.5	-32	0	0	0	109.2	A344 F397 D401 A402 A403	A344-P399 HydrophobicContact CB-CG 3.51Å; F397-P399 WeakPolarHBondContact O-CD 3.48Å; P399-D401 PolarHBondContact O-N 3.39Å; P399-A402 HydrophobicContact CB-CB 4.17Å; P399-A402 PolarHBondContact O-N 2.79Å; P399-A403 PolarHBondContact O-N 3.42Å
400	V	96.2	Very high	96.1	Very high	71 Å²	71	60.8 Å²	60.8	43%	0.43	33%	0.329	S	S	.	.	H	α-helix	trans	-60	-44	-171.3	178.1	0	0	0	0	111.7	A398 A403 V404	A398-V400 VanDerWaalsContact C-N 3.27Å; A398-V400 HydrophobicContact CB-CG2 4.19Å; A398-V400 PolarHBondContact O-N 2.95Å; V400-A403 PolarHBondContact O-N 2.93Å; V400-V404 HydrophobicContact CG1-CG2 4.43Å; V400-V404 WeakPolarHBondContact O-CG2 3.36Å; V400-V404 PolarHBondContact O-N 3.24Å
401	D	95.1	Very high	95.9	Very high	131 Å²	131	60.7 Å²	60.7	70%	0.701	33%	0.326	S	S	*	.	H	α-helix	trans	-64.4	-43.4	-178.9	-63.2	-43.3	0	0	0	111.9	P399 A403 V404 D405	P399-D401 PolarHBondContact O-N 3.39Å; D401-A403 VanDerWaalsContact C-N 3.31Å; D401-A403 PolarHBondContact O-N 2.89Å; D401-V404 WeakPolarHBondContact O-CB 2.81Å; D401-V404 PolarHBondContact O-N 2.7Å; D401-V404 VanDerWaalsContact O-N 3.14Å; D401-D405 PolarHBondContact O-N 3.05Å
402	A	92.9	Very high	95.9	Very high	52 Å²	52	56.3 Å²	56.3	43%	0.43	30%	0.304	S	S	.	.	H	α-helix	trans	-62.1	-39.3	175.3	0	0	0	0	0	111.9	P399 V404 D405 Q406	P399-A402 HydrophobicContact CB-CB 4.17Å; P399-A402 PolarHBondContact O-N 2.79Å; A402-V404 VanDerWaalsContact C-N 3.34Å; A402-D405 PolarHBondContact O-N 2.98Å; A402-Q406 WeakPolarHBondContact O-CG 3.33Å; A402-Q406 PolarHBondContact O-N 2.68Å
403	A	95.1	Very high	95.9	Very high	4 Å²	4	51.5 Å²	51.5	3%	0.033	28%	0.283	C	S	.	.	H	α-helix	trans	-66.2	-36.7	175.3	0	0	0	0	0	112.4	L337 K340 V341 P399 V400 D401 Q406 K407	L337-A403 HydrophobicContact CD1-CB 4.28Å; K340-A403 HydrophobicContact CB-CB 3.84Å; V341-A403 HydrophobicContact CB-CB 4.29Å; V341-A403 HydrophobicContact CG2-CB 3.44Å; V341-A403 VanDerWaalsContact CG2-CB 3.44Å; P399-A403 PolarHBondContact O-N 3.42Å; V400-A403 PolarHBondContact O-N 2.93Å; D401-A403 VanDerWaalsContact C-N 3.31Å; D401-A403 PolarHBondContact O-N 2.89Å; A403-Q406 PolarHBondContact O-N 3.4Å; A403-K407 PolarHBondContact O-N 3.28Å; A403-K407 VanDerWaalsContact O-N 3.1Å
404	V	96.1	Very high	95.8	Very high	52 Å²	52	49.8 Å²	49.8	32%	0.315	28%	0.277	S	S	.	.	H	α-helix	trans	-65.2	-40.8	172.6	170.2	0	0	0	0	110.6	L337 V400 D401 A402 Q406 K407 A408	L337-V404 HydrophobicContact CD1-CG2 3.92Å; L337-V404 HydrophobicContact CD2-CG2 4.49Å; V400-V404 HydrophobicContact CG1-CG2 4.43Å; V400-V404 WeakPolarHBondContact O-CG2 3.36Å; V400-V404 PolarHBondContact O-N 3.24Å; D401-V404 WeakPolarHBondContact O-CB 2.81Å; D401-V404 PolarHBondContact O-N 2.7Å; D401-V404 VanDerWaalsContact O-N 3.14Å; A402-V404 VanDerWaalsContact C-N 3.34Å; V404-Q406 PolarHBondContact O-N 3.37Å; V404-K407 CarbonylContact O-C 3.6Å; V404-K407 PolarHBondContact O-N 2.98Å; V404-A408 WeakPolarHBondContact O-CB 3.47Å; V404-A408 PolarHBondContact O-N 3Å
405	D	95.3	Very high	95.8	Very high	26 Å²	26	48.7 Å²	48.7	14%	0.139	27%	0.272	C	S	.	.	H	α-helix	trans	-62.7	-41.8	175.7	-80.2	-12	0	0	0	112.4	D401 A402 K407 A408 K409 R463 C465 G466	D401-D405 PolarHBondContact O-N 3.05Å; A402-D405 PolarHBondContact O-N 2.98Å; D405-K407 VanDerWaalsContact C-N 3.31Å; D405-K407 PolarHBondContact O-N 3.17Å; D405-A408 CarbonylContact O-C 3.59Å; D405-A408 WeakPolarHBondContact O-CB 3.43Å; D405-A408 PolarHBondContact O-N 3.32Å; D405-A408 VanDerWaalsContact O-N 3.11Å; D405-K409 WeakPolarHBondContact O-CG 3.33Å; D405-K409 PolarHBondContact O-N 3.18Å; D405-R463 IonicContact OD1-CZ 3.45Å; D405-R463 IonicContact OD1-NE 3.27Å; D405-R463 PolarHBondContact OD1-NE 2.69Å; D405-R463 IonicContact OD1-NH2 3.6Å; D405-R463 PolarHBondContact OD1-NH2 3.1Å; D405-C465 HydrophobicContact CB-CB 3.98Å; D405-G466 PolarHBondContact OD2-N 2.84Å; D405-G466 VanDerWaalsContact OD2-N 3.16Å
406	Q	93.8	Very high	95.9	Very high	70 Å²	70	44.7 Å²	44.7	33%	0.327	25%	0.246	S	C	.	.	H	α-helix	trans	-62.2	-40.4	174.9	-67.4	-64.9	-32.4	0	0	111.8	A402 A403 V404 A408 K409 E410	A402-Q406 WeakPolarHBondContact O-CG 3.33Å; A402-Q406 PolarHBondContact O-N 2.68Å; A403-Q406 PolarHBondContact O-N 3.4Å; V404-Q406 PolarHBondContact O-N 3.37Å; Q406-A408 VanDerWaalsContact C-N 3.31Å; Q406-K409 PolarHBondContact O-N 3.33Å; Q406-E410 PolarHBondContact O-N 3.06Å
407	K	94.4	Very high	95.8	Very high	44 Å²	44	39 Å²	39	19%	0.191	22%	0.216	C	C	.	.	H	α-helix	trans	-66.5	-35.6	173.3	-174.3	170.6	174	58.6	0	112.1	K331 N332 A403 V404 D405 E410 F411	K331-K407 PolarHBondContact O-NZ 3.4Å; N332-K407 WeakPolarHBondContact OD1-CE 3.38Å; N332-K407 PolarHBondContact OD1-NZ 3.02Å; A403-K407 PolarHBondContact O-N 3.28Å; A403-K407 VanDerWaalsContact O-N 3.1Å; V404-K407 CarbonylContact O-C 3.6Å; V404-K407 PolarHBondContact O-N 2.98Å; D405-K407 VanDerWaalsContact C-N 3.31Å; D405-K407 PolarHBondContact O-N 3.17Å; K407-E410 PolarHBondContact O-N 3.06Å; K407-F411 PolarHBondContact O-N 2.86Å
408	A	94.6	Very high	95.8	Very high	13 Å²	13	38.9 Å²	38.9	11%	0.107	22%	0.218	C	C	.	.	H	α-helix	trans	-69.4	-37.6	177.1	0	0	0	0	0	111.9	V404 D405 Q406 E410 F411 F412 R463	V404-A408 WeakPolarHBondContact O-CB 3.47Å; V404-A408 PolarHBondContact O-N 3Å; D405-A408 CarbonylContact O-C 3.59Å; D405-A408 WeakPolarHBondContact O-CB 3.43Å; D405-A408 PolarHBondContact O-N 3.32Å; D405-A408 VanDerWaalsContact O-N 3.11Å; Q406-A408 VanDerWaalsContact C-N 3.31Å; A408-E410 VanDerWaalsContact C-N 3.32Å; A408-E410 PolarHBondContact O-N 3.27Å; A408-F411 PolarHBondContact O-N 3.24Å; A408-F412 WeakPolarHBondContact O-CB 3.44Å; A408-F412 WeakPolarHBondContact O-CD2 3.44Å; A408-F412 PolarHBondContact O-N 3.12Å; A408-R463 VanDerWaalsContact CB-NE 3.35Å
409	K	94.6	Very high	95.8	Very high	36 Å²	36	39 Å²	39	16%	0.157	22%	0.215	C	C	.	.	H	α-helix	trans	-55.5	-47.1	171.7	-71.4	-179.8	-177.3	172	0	111.2	D405 Q406 F412 H413 C465 G466 D467	D405-K409 WeakPolarHBondContact O-CG 3.33Å; D405-K409 PolarHBondContact O-N 3.18Å; Q406-K409 PolarHBondContact O-N 3.33Å; K409-F412 PolarHBondContact O-N 2.9Å; K409-H413 PolarHBondContact O-N 2.7Å; K409-C465 HydrophobicContact CD-CB 4.33Å; K409-C465 VanDerWaalsContact CE-CB 3.43Å; K409-C465 HydrophobicContact CG-CB 3.98Å; K409-G466 PolarHBondContact NZ-O 3.47Å; K409-D467 VanDerWaalsContact NZ-CG 3.31Å; K409-D467 IonicContact NZ-OD2 2.98Å; K409-D467 PolarHBondContact NZ-OD2 3.48Å
410	E	94.7	Very high	95.9	Very high	85 Å²	85	38.7 Å²	38.7	40%	0.397	21%	0.211	S	C	.	.	H	α-helix	trans	-60.9	-50.3	175.8	-67.5	173	169.8	0	0	111.1	K340 Q406 K407 A408 F412 H413 D414	K340-E410 VanDerWaalsContact CE-OE1 3.27Å; K340-E410 WeakPolarHBondContact CE-OE1 3.49Å; K340-E410 IonicContact NZ-OE1 3.17Å; K340-E410 PolarHBondContact NZ-OE1 2.65Å; K340-E410 IonicContact NZ-OE2 3.14Å; Q406-E410 PolarHBondContact O-N 3.06Å; K407-E410 PolarHBondContact O-N 3.06Å; A408-E410 VanDerWaalsContact C-N 3.32Å; A408-E410 PolarHBondContact O-N 3.27Å; E410-F412 VanDerWaalsContact C-N 3.31Å; E410-F412 PolarHBondContact O-N 3.36Å; E410-H413 WeakPolarHBondContact O-CB 3.24Å; E410-H413 PolarHBondContact O-N 2.99Å; E410-D414 PolarHBondContact O-N 3.26Å
411	F	95.4	Very high	95.9	Very high	35 Å²	35	35.9 Å²	35.9	15%	0.154	19%	0.194	C	C	.	.	H	α-helix	trans	-58.5	-40.8	177.9	167.4	-121.6	0	0	0	113.1	S227 K407 A408 H413 D414 C415	S227-F411 VanDerWaalsContact N-CE2 3.3Å; K407-F411 PolarHBondContact O-N 2.86Å; A408-F411 PolarHBondContact O-N 3.24Å; F411-H413 VanDerWaalsContact C-N 3.27Å; F411-H413 PolarHBondContact O-N 3.05Å; F411-D414 WeakPolarHBondContact O-CB 3.22Å; F411-D414 PolarHBondContact O-N 3.46Å; F411-D414 VanDerWaalsContact O-N 3.13Å; F411-C415 WeakPolarHBondContact CE2-SG 3.36Å; F411-C415 WeakPolarHBondContact CZ-SG 3.41Å; F411-C415 PolarHBondContact O-N 3.24Å; F411-C415 PolarHBondContact O-SG 3.24Å
412	F	97	Very high	95.9	Very high	16 Å²	16	33.8 Å²	33.8	7%	0.07	19%	0.188	C	C	.	.	H	α-helix	trans	-65.2	-31.1	178	-91.9	-116.5	0	0	0	112.3	A408 K409 E410 R463 C474 T476 N479	A408-F412 WeakPolarHBondContact O-CB 3.44Å; A408-F412 WeakPolarHBondContact O-CD2 3.44Å; A408-F412 PolarHBondContact O-N 3.12Å; K409-F412 PolarHBondContact O-N 2.9Å; E410-F412 VanDerWaalsContact C-N 3.31Å; E410-F412 PolarHBondContact O-N 3.36Å; F412-R463 HydrophobicContact CE1-CB 3.89Å; F412-R463 HydrophobicContact CE2-CB 3.77Å; F412-R463 HydrophobicContact CZ-CB 3.38Å; F412-C474 HydrophobicContact CB-CB 4.37Å; F412-C474 HydrophobicContact CD1-CB 4Å; F412-C474 WeakPolarHBondContact CE1-O 3.43Å; F412-C474 HydrophobicContact CG-CB 4.28Å; F412-T476 HydrophobicContact CB-CG2 4.36Å; F412-T476 HydrophobicContact CD1-CG2 3.6Å; F412-T476 HydrophobicContact CE1-CG2 4.03Å; F412-T476 HydrophobicContact CG-CG2 4.07Å; F412-N479 PolarHBondContact O-ND2 3.35Å
413	H	97.3	Very high	96	Very high	36 Å²	36	37 Å²	37	17%	0.167	20%	0.198	C	C	.	.	H	α-helix	trans	-71.9	-34.3	171.9	-175.3	-153.7	0	0	0	112.4	K409 E410 F411 C415 H484 E486 P488	K409-H413 PolarHBondContact O-N 2.7Å; E410-H413 WeakPolarHBondContact O-CB 3.24Å; E410-H413 PolarHBondContact O-N 2.99Å; F411-H413 VanDerWaalsContact C-N 3.27Å; F411-H413 PolarHBondContact O-N 3.05Å; H413-C415 VanDerWaalsContact C-N 3.34Å; H413-H484 AromaticContact CD2-CD2 3.86Å; H413-H484 AromaticContact CE1-CD2 3.53Å; H413-H484 AromaticContact CE1-CE1 3.82Å; H413-H484 AromaticContact CE1-CG 3.57Å; H413-H484 AromaticContact CE1-ND1 3.79Å; H413-H484 AromaticContact CE1-NE2 3.71Å; H413-H484 AromaticContact CG-CD2 3.82Å; H413-H484 AromaticContact CG-NE2 3.69Å; H413-H484 AromaticContact ND1-CD2 3.64Å; H413-H484 AromaticContact ND1-CE1 3.59Å; H413-H484 AromaticContact ND1-NE2 3.36Å; H413-H484 PolarHBondContact ND1-NE2 3.32Å; H413-H484 AromaticContact NE2-CD2 3.68Å; H413-H484 AromaticContact NE2-CG 3.91Å; H413-E486 PolarHBondContact NE2-O 3.29Å; H413-P488 HydrophobicContact CB-CB 4.32Å; H413-P488 HydrophobicContact CB-CG 4.27Å
414	D	97.3	Very high	96.1	Very high	39 Å²	39	37 Å²	37	21%	0.209	20%	0.197	C	C	.	.	H	α-helix	trans	-72.6	-25.5	178.5	-58	-19.4	0	0	0	113.4	M228 E410 F411 Y483 H484	M228-D414 HydrophobicContact CB-CB 3.98Å; M228-D414 HydrophobicContact CG-CB 4.28Å; M228-D414 HydrophobicContact SD-CB 4.27Å; E410-D414 PolarHBondContact O-N 3.26Å; F411-D414 WeakPolarHBondContact O-CB 3.22Å; F411-D414 PolarHBondContact O-N 3.46Å; F411-D414 VanDerWaalsContact O-N 3.13Å; D414-Y483 HydrophobicContact CB-CE2 3.97Å; D414-Y483 PolarHBondContact OD1-OH 2.95Å; D414-H484 IonicContact OD1-CD2 2.86Å; D414-H484 IonicContact OD1-CE1 2.7Å; D414-H484 PolarHBondContact OD1-CE1 2.84Å; D414-H484 IonicContact OD1-NE2 3.25Å; D414-H484 PolarHBondContact OD1-NE2 3.27Å
415	C	97.3	Very high	96.1	Very high	3 Å²	3	38.2 Å²	38.2	2%	0.02	20%	0.201	C	C	.	.	S	Bend	trans	-61.5	142.2	-173.1	-81.6	0	0	0	0	113.5	F411 H413 T476 N479	F411-C415 WeakPolarHBondContact CE2-SG 3.36Å; F411-C415 WeakPolarHBondContact CZ-SG 3.41Å; F411-C415 PolarHBondContact O-N 3.24Å; F411-C415 PolarHBondContact O-SG 3.24Å; H413-C415 VanDerWaalsContact C-N 3.34Å; C415-T476 HydrophobicContact CB-CG2 3.56Å; C415-N479 WeakPolarHBondContact O-CB 3.26Å; C415-N479 PolarHBondContact O-ND2 3.31Å
416	L	98.4	Very high	96.1	Very high	4 Å²	4	39.1 Å²	39.1	2%	0.021	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-69	148.4	162	-65.3	166.6	0	0	0	109.8	Q208 L218 Q222	Q208-L416 HydrophobicContact CB-CD1 4.45Å; Q208-L416 HydrophobicContact CG-CD1 4.08Å; Q208-L416 HydrophobicContact CG-CD2 3.76Å; L218-L416 HydrophobicContact CB-CD1 3.47Å; L218-L416 VanDerWaalsContact CB-CD1 3.47Å; L218-L416 HydrophobicContact CD1-CD1 4.2Å; Q222-L416 PolarHBondContact NE2-O 2.7Å
417	P	97.6	Very high	96.2	Very high	10 Å²	10	36.4 Å²	36.4	7%	0.065	20%	0.201	C	C	.	.	P	Polyproline II helix	trans	-63.6	151.5	168.9	30.3	-37.3	0	0	0	110.2	W215 T476 N479 R481	W215-P417 HydrophobicContact CZ2-CB 4.39Å; W215-P417 HydrophobicContact CZ2-CG 3.83Å; W215-P417 PolarHBondContact NE1-O 3.44Å; P417-T476 WeakPolarHBondContact CA-O 3.47Å; P417-N479 HydrophobicContact CB-CB 4.47Å; P417-N479 WeakPolarHBondContact CB-O 3.44Å; P417-N479 WeakPolarHBondContact CD-O 3.28Å; P417-N479 WeakPolarHBondContact CG-O 3.48Å; P417-R481 HydrophobicContact CG-CG 4.17Å
418	P	97.1	Very high	96.2	Very high	22 Å²	22	34.4 Å²	34.4	14%	0.143	19%	0.192	C	C	.	.	P	Polyproline II helix	trans	-70	144.7	178.7	29.2	-32.6	0	0	0	111.6	L420 L457 R458 V477	P418-L420 HydrophobicContact CB-CD2 4.42Å; P418-L420 HydrophobicContact CG-CD2 4.21Å; P418-L457 HydrophobicContact CG-CD2 4.16Å; P418-R458 HydrophobicContact CB-CG 4.05Å; P418-V477 HydrophobicContact CG-CG1 4Å
419	V	97.1	Very high	96.2	Very high	33 Å²	33	36.1 Å²	36.1	20%	0.2	20%	0.201	C	C	.	.			trans	-86.6	115	164.3	-179.1	0	0	0	0	108.7	W215 N216 R458	W215-V419 HydrophobicContact CD2-CG2 3.42Å; W215-V419 VanDerWaalsContact CD2-CG2 3.42Å; W215-V419 HydrophobicContact CE3-CG2 3.72Å; W215-V419 HydrophobicContact CG-CG2 3.91Å; W215-V419 HydrophobicContact CH2-CG2 3.95Å; W215-V419 HydrophobicContact CZ2-CG2 3.65Å; W215-V419 HydrophobicContact CZ3-CG2 3.98Å; N216-V419 HydrophobicContact CB-CB 4.18Å; N216-V419 HydrophobicContact CB-CG1 4.28Å; N216-V419 HydrophobicContact CB-CG2 3.87Å; V419-R458 PolarHBondContact O-NH2 3.11Å
420	L	96.6	Very high	96.2	Very high	30 Å²	30	40.1 Å²	40.1	16%	0.157	22%	0.221	C	C	.	.			trans	-72.3	141.7	-177.4	-52.7	-169	0	0	0	111	P418 E424 L425 L457	P418-L420 HydrophobicContact CB-CD2 4.42Å; P418-L420 HydrophobicContact CG-CD2 4.21Å; L420-E424 WeakPolarHBondContact CA-OE2 3.33Å; L420-E424 HydrophobicContact CB-CB 4.12Å; L420-L425 HydrophobicContact CB-CB 4.25Å; L420-L425 HydrophobicContact CD1-CD1 4.28Å; L420-L457 HydrophobicContact CD2-CD1 4.08Å; L420-L457 HydrophobicContact CD2-CD2 3.41Å; L420-L457 VanDerWaalsContact CD2-CD2 3.41Å; L420-L457 HydrophobicContact CD2-CG 3.95Å
421	T	96.1	Very high	96.1	Very high	12 Å²	12	37.7 Å²	37.7	7%	0.074	22%	0.218	C	C	.	.			trans	-69.9	162.7	165.4	63.4	0	0	0	0	109.9	T99 D423 E424 L425	T99-T421 HydrophobicContact CG2-CG2 4.14Å; T421-D423 PolarHBondContact O-N 3.38Å; T421-E424 PolarHBondContact N-OE2 2.86Å; T421-E424 VanDerWaalsContact N-OE2 3.09Å; T421-E424 PolarHBondContact O-N 2.97Å; T421-E424 WeakPolarHBondContact OG1-CB 3.26Å; T421-E424 VanDerWaalsContact OG1-CD 3.32Å; T421-E424 VanDerWaalsContact OG1-CG 3.24Å; T421-E424 WeakPolarHBondContact OG1-CG 3.39Å; T421-E424 PolarHBondContact OG1-N 3.21Å; T421-E424 VanDerWaalsContact OG1-N 3.16Å; T421-L425 WeakPolarHBondContact O-CB 3.48Å; T421-L425 PolarHBondContact O-N 3.17Å
422	P	95.3	Very high	95.9	Very high	88 Å²	88	37.5 Å²	37.5	57%	0.571	22%	0.223	S	C	*	.	H	α-helix	trans	-52.2	-41.7	173.4	-28.8	36.9	0	0	0	113.2	L425 A426	P422-L425 PolarHBondContact O-N 3.41Å; P422-A426 WeakPolarHBondContact O-CB 3.27Å; P422-A426 PolarHBondContact O-N 2.83Å
423	D	94.9	Very high	95.5	Very high	118 Å²	118	38.6 Å²	38.6	63%	0.631	23%	0.232	S	C	*	.	H	α-helix	trans	-68.4	-44.1	179	-64.7	-10.9	0	0	0	112.2	T421 L425 A426 T427	T421-D423 PolarHBondContact O-N 3.38Å; D423-L425 VanDerWaalsContact C-N 3.33Å; D423-L425 PolarHBondContact O-N 3.48Å; D423-A426 PolarHBondContact O-N 2.96Å; D423-T427 WeakPolarHBondContact O-CB 3.41Å; D423-T427 WeakPolarHBondContact O-CG2 3.27Å; D423-T427 PolarHBondContact O-N 2.93Å; D423-T427 VanDerWaalsContact O-N 3.07Å; D423-T427 PolarHBondContact O-OG1 2.62Å
424	E	96.8	Very high	95.2	Very high	5 Å²	5	39.6 Å²	39.6	2%	0.023	25%	0.246	C	C	.	.	H	α-helix	trans	-64.4	-38.3	176.2	-73.5	164.6	-168.8	0	0	111.8	R107 L420 T421 S428 L457 R458	R107-E424 IonicContact CZ-OE1 3.93Å; R107-E424 VanDerWaalsContact CZ-OE1 3.22Å; R107-E424 IonicContact NH1-OE1 3.56Å; R107-E424 PolarHBondContact NH1-OE1 3.2Å; R107-E424 IonicContact NH2-OE1 2.64Å; R107-E424 PolarHBondContact NH2-OE1 3.26Å; L420-E424 WeakPolarHBondContact CA-OE2 3.33Å; L420-E424 HydrophobicContact CB-CB 4.12Å; T421-E424 PolarHBondContact N-OE2 2.86Å; T421-E424 VanDerWaalsContact N-OE2 3.09Å; T421-E424 PolarHBondContact O-N 2.97Å; T421-E424 WeakPolarHBondContact OG1-CB 3.26Å; T421-E424 VanDerWaalsContact OG1-CD 3.32Å; T421-E424 VanDerWaalsContact OG1-CG 3.24Å; T421-E424 WeakPolarHBondContact OG1-CG 3.39Å; T421-E424 PolarHBondContact OG1-N 3.21Å; T421-E424 VanDerWaalsContact OG1-N 3.16Å; E424-S428 WeakPolarHBondContact O-CB 3.39Å; E424-S428 PolarHBondContact O-N 3.23Å; E424-S428 VanDerWaalsContact O-N 3.1Å; E424-S428 PolarHBondContact O-OG 2.96Å; E424-L457 HydrophobicContact CB-CD1 4.22Å; E424-R458 VanDerWaalsContact CD-NE 3.32Å; E424-R458 VanDerWaalsContact CD-NH2 3.34Å; E424-R458 IonicContact OE1-CZ 3.41Å; E424-R458 VanDerWaalsContact OE1-CZ 3.23Å; E424-R458 IonicContact OE1-NE 3.85Å; E424-R458 PolarHBondContact OE1-NE 3.01Å; E424-R458 IonicContact OE1-NH2 3.48Å; E424-R458 PolarHBondContact OE1-NH2 2.94Å; E424-R458 IonicContact OE2-CZ 2.78Å; E424-R458 IonicContact OE2-NE 3.19Å; E424-R458 PolarHBondContact OE2-NE 3.08Å; E424-R458 IonicContact OE2-NH2 3.66Å; E424-R458 PolarHBondContact OE2-NH2 3.07Å
425	L	96.2	Very high	94.9	Very high	77 Å²	77	42.9 Å²	42.9	40%	0.403	26%	0.256	S	S	.	.	H	α-helix	trans	-61.2	-52	174.2	179.2	66.1	0	0	0	109.9	L420 T421 P422 D423 T427 S428 Q430 G431	L420-L425 HydrophobicContact CB-CB 4.25Å; L420-L425 HydrophobicContact CD1-CD1 4.28Å; T421-L425 WeakPolarHBondContact O-CB 3.48Å; T421-L425 PolarHBondContact O-N 3.17Å; P422-L425 PolarHBondContact O-N 3.41Å; D423-L425 VanDerWaalsContact C-N 3.33Å; D423-L425 PolarHBondContact O-N 3.48Å; L425-T427 PolarHBondContact O-N 3.06Å; L425-S428 PolarHBondContact O-N 3.46Å; L425-S428 PolarHBondContact O-OG 2.92Å; L425-Q430 HydrophobicContact CD1-CB 3.68Å; L425-G431 WeakPolarHBondContact O-CA 3.48Å; L425-G431 PolarHBondContact O-N 3.13Å
426	A	95.4	Very high	94.7	Very high	45 Å²	45	51.4 Å²	51.4	37%	0.372	29%	0.288	S	S	.	.	H	α-helix	trans	-64.1	-24.7	-176.9	0	0	0	0	0	114.2	P422 D423	P422-A426 WeakPolarHBondContact O-CB 3.27Å; P422-A426 PolarHBondContact O-N 2.83Å; D423-A426 PolarHBondContact O-N 2.96Å
427	T	95.9	Very high	94.4	Very high	13 Å²	13	54.7 Å²	54.7	8%	0.08	30%	0.303	C	S	.	.	H	α-helix	trans	-109.1	4.3	-175.4	55.7	0	0	0	0	114	D423 L425 H539 T540 P543	D423-T427 WeakPolarHBondContact O-CB 3.41Å; D423-T427 WeakPolarHBondContact O-CG2 3.27Å; D423-T427 PolarHBondContact O-N 2.93Å; D423-T427 VanDerWaalsContact O-N 3.07Å; D423-T427 PolarHBondContact O-OG1 2.62Å; L425-T427 PolarHBondContact O-N 3.06Å; T427-H539 WeakPolarHBondContact O-CA 3.39Å; T427-H539 WeakPolarHBondContact O-CB 3.43Å; T427-H539 PolarHBondContact OG1-ND1 3.31Å; T427-T540 VanDerWaalsContact CB-O 3.25Å; T427-T540 WeakPolarHBondContact CB-O 3.2Å; T427-T540 PolarHBondContact O-N 2.93Å; T427-T540 PolarHBondContact O-OG1 3.37Å; T427-P543 HydrophobicContact CG2-CG 4.11Å
428	S	95.7	Very high	94.2	Very high	2 Å²	2	61.1 Å²	61.1	1%	0.014	34%	0.336	C	S	.	.	S	Bend	trans	-107	174.9	175.4	65.4	0	0	0	0	111.3	E424 L425 Q430 G431 A432 F533	E424-S428 WeakPolarHBondContact O-CB 3.39Å; E424-S428 PolarHBondContact O-N 3.23Å; E424-S428 VanDerWaalsContact O-N 3.1Å; E424-S428 PolarHBondContact O-OG 2.96Å; L425-S428 PolarHBondContact O-N 3.46Å; L425-S428 PolarHBondContact O-OG 2.92Å; S428-Q430 PolarHBondContact O-N 3.39Å; S428-Q430 VanDerWaalsContact O-N 3.14Å; S428-G431 PolarHBondContact O-N 3.28Å; S428-A432 PolarHBondContact O-N 3.39Å; S428-F533 VanDerWaalsContact C-CZ 3.48Å
429	V	94.6	Very high	94.1	Very high	49 Å²	49	62.4 Å²	62.4	30%	0.297	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-56.1	-29.2	176.1	66.6	0	0	0	0	113.3	G431 A432 F533	V429-G431 VanDerWaalsContact C-N 3.27Å; V429-G431 PolarHBondContact O-N 3.35Å; V429-A432 VanDerWaalsContact O-CB 3.24Å; V429-A432 WeakPolarHBondContact O-CB 3.36Å; V429-A432 PolarHBondContact O-N 2.97Å; V429-F533 HydrophobicContact CB-CD1 4.15Å; V429-F533 HydrophobicContact CB-CE1 3.85Å; V429-F533 HydrophobicContact CB-CZ 4.25Å; V429-F533 VanDerWaalsContact CB-O 3.26Å; V429-F533 WeakPolarHBondContact CB-O 3.32Å; V429-F533 WeakPolarHBondContact CG1-O 3.4Å; V429-F533 HydrophobicContact CG2-CE1 4.22Å; V429-F533 VanDerWaalsContact N-CZ 3.35Å
430	Q	93.6	Very high	94	Very high	121 Å²	121	67.7 Å²	67.7	57%	0.565	37%	0.374	S	S	*	.	G	3₁₀ helix	trans	-68.6	-26.7	178.5	-66.5	-173.1	29.8	0	0	112.9	L425 S428	L425-Q430 HydrophobicContact CD1-CB 3.68Å; S428-Q430 PolarHBondContact O-N 3.39Å; S428-Q430 VanDerWaalsContact O-N 3.14Å
431	G	92.9	Very high	93.8	Very high	34 Å²	34	70.8 Å²	70.8	35%	0.351	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-96.4	6.1	174.2	0	0	0	0	0	114.1	L425 S428 V429	L425-G431 WeakPolarHBondContact O-CA 3.48Å; L425-G431 PolarHBondContact O-N 3.13Å; S428-G431 PolarHBondContact O-N 3.28Å; V429-G431 VanDerWaalsContact C-N 3.27Å; V429-G431 PolarHBondContact O-N 3.35Å
432	A	90.9	Very high	93.4	Very high	31 Å²	31	74.3 Å²	74.3	26%	0.256	41%	0.408	S	S	.	.			trans	-59.3	142.8	-177.7	0	0	0	0	0	111.4	S428 V429 A434 V446	S428-A432 PolarHBondContact O-N 3.39Å; V429-A432 VanDerWaalsContact O-CB 3.24Å; V429-A432 WeakPolarHBondContact O-CB 3.36Å; V429-A432 PolarHBondContact O-N 2.97Å; A432-A434 PolarHBondContact O-N 3.3Å; A432-A434 VanDerWaalsContact O-N 3.11Å; A432-V446 HydrophobicContact CB-CG2 4.35Å
433	P	88.8	Confident	92.8	Very high	39 Å²	39	72.5 Å²	72.5	25%	0.253	39%	0.394	S	S	.	.			trans	-74.4	-4.5	-170.8	30.6	-37.5	0	0	0	114.4	R435 N443	P433-R435 PolarHBondContact O-N 2.93Å; P433-R435 PolarHBondContact O-NH1 2.92Å; P433-N443 HydrophobicContact CB-CB 3.92Å; P433-N443 HydrophobicContact CG-CB 4.02Å; P433-N443 WeakPolarHBondContact O-CB 3.32Å; P433-N443 PolarHBondContact O-ND2 2.94Å
434	A	90.1	Very high	92.1	Very high	56 Å²	56	71.2 Å²	71.2	46%	0.463	39%	0.39	S	S	.	.			trans	-60	123	-177.5	0	0	0	0	0	110.7	A432 K442 N443	A432-A434 PolarHBondContact O-N 3.3Å; A432-A434 VanDerWaalsContact O-N 3.11Å; A434-K442 WeakPolarHBondContact CA-O 3.27Å; A434-N443 WeakPolarHBondContact CA-O 3.41Å; A434-N443 WeakPolarHBondContact CB-O 3.37Å
435	R	91.5	Very high	90.8	Very high	109 Å²	109	72.9 Å²	72.9	41%	0.411	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	163.3	-175.5	65.7	178.7	-179.1	-84.4	-6.5	112.9	P433 E437 K442 N443	P433-R435 PolarHBondContact O-N 2.93Å; P433-R435 PolarHBondContact O-NH1 2.92Å; R435-E437 HydrophobicContact CG-CB 4.36Å; R435-E437 IonicContact CZ-OE1 2.67Å; R435-E437 IonicContact CZ-OE2 2.83Å; R435-E437 VanDerWaalsContact NE-CD 3.29Å; R435-E437 IonicContact NE-OE1 3.19Å; R435-E437 PolarHBondContact NE-OE1 3.05Å; R435-E437 IonicContact NE-OE2 3.41Å; R435-E437 PolarHBondContact NE-OE2 2.85Å; R435-E437 IonicContact NH2-OE1 3.34Å; R435-E437 PolarHBondContact NH2-OE1 3.13Å; R435-E437 IonicContact NH2-OE2 3.81Å; R435-E437 PolarHBondContact NH2-OE2 3.43Å; R435-K442 HydrophobicContact CG-CB 4.33Å; R435-K442 PolarHBondContact N-O 3.07Å; R435-K442 VanDerWaalsContact N-O 3.08Å; R435-K442 PolarHBondContact O-N 3.27Å; R435-N443 VanDerWaalsContact CZ-ND2 3.32Å; R435-N443 PolarHBondContact NH1-ND2 3.47Å
436	W	92.8	Very high	89.4	Confident	182 Å²	182	70.7 Å²	70.7	69%	0.689	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92	120.3	165.5	-178.9	-96	0	0	0	109.8	G439 V441	W436-G439 VanDerWaalsContact CH2-C 3.42Å; W436-G439 WeakPolarHBondContact CH2-O 3.39Å; W436-G439 VanDerWaalsContact CZ2-CA 3.41Å; W436-G439 WeakPolarHBondContact CZ2-O 3.29Å; W436-V441 HydrophobicContact CE3-CG2 3.99Å; W436-V441 HydrophobicContact CZ3-CG2 4.04Å
437	E	93.6	Very high	88.8	Confident	72 Å²	72	74.2 Å²	74.2	34%	0.336	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	135	-177.9	-177.7	172.7	-99	0	0	109.5	R435 G439 K440 K442	R435-E437 HydrophobicContact CG-CB 4.36Å; R435-E437 IonicContact CZ-OE1 2.67Å; R435-E437 IonicContact CZ-OE2 2.83Å; R435-E437 VanDerWaalsContact NE-CD 3.29Å; R435-E437 IonicContact NE-OE1 3.19Å; R435-E437 PolarHBondContact NE-OE1 3.05Å; R435-E437 IonicContact NE-OE2 3.41Å; R435-E437 PolarHBondContact NE-OE2 2.85Å; R435-E437 IonicContact NH2-OE1 3.34Å; R435-E437 PolarHBondContact NH2-OE1 3.13Å; R435-E437 IonicContact NH2-OE2 3.81Å; R435-E437 PolarHBondContact NH2-OE2 3.43Å; E437-G439 PolarHBondContact O-N 3.47Å; E437-G439 VanDerWaalsContact O-N 3.16Å; E437-K440 PolarHBondContact N-O 3.32Å; E437-K440 PolarHBondContact O-N 3.33Å; E437-K442 HydrophobicContact CB-CG 4.08Å
438	D	93.2	Very high	88.6	Confident	145 Å²	145	74 Å²	74	78%	0.775	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.6	40.2	179.7	-56.9	-36.3	0	0	0	114.5	K440	D438-K440 VanDerWaalsContact C-N 3.26Å; D438-K440 PolarHBondContact O-N 3.45Å
439	G	94.1	Very high	88.6	Confident	49 Å²	49	76.9 Å²	76.9	51%	0.505	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.6	11.9	176.8	0	0	0	0	0	114.8	W436 E437	W436-G439 VanDerWaalsContact CH2-C 3.42Å; W436-G439 WeakPolarHBondContact CH2-O 3.39Å; W436-G439 VanDerWaalsContact CZ2-CA 3.41Å; W436-G439 WeakPolarHBondContact CZ2-O 3.29Å; E437-G439 PolarHBondContact O-N 3.47Å; E437-G439 VanDerWaalsContact O-N 3.16Å
440	K	95	Very high	88.7	Confident	145 Å²	145	76.4 Å²	76.4	63%	0.63	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.7	155	179.4	-63.7	-179.5	-178.5	178.9	0	110.7	E437 D438	E437-K440 PolarHBondContact N-O 3.32Å; E437-K440 PolarHBondContact O-N 3.33Å; D438-K440 VanDerWaalsContact C-N 3.26Å; D438-K440 PolarHBondContact O-N 3.45Å
441	V	91.6	Very high	88.8	Confident	94 Å²	94	77.5 Å²	77.5	57%	0.57	43%	0.425	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.2	131.9	168.3	-158.3	0	0	0	0	108.4	W436 V444	W436-V441 HydrophobicContact CE3-CG2 3.99Å; W436-V441 HydrophobicContact CZ3-CG2 4.04Å; V441-V444 HydrophobicContact CB-CG2 3.96Å; V441-V444 HydrophobicContact CG1-CG2 3.18Å
442	K	88.4	Confident	89	Confident	87 Å²	87	76.9 Å²	76.9	38%	0.378	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	151.9	180	-66.2	-71.9	-171.6	163.2	0	109.8	A434 R435 E437 V444	A434-K442 WeakPolarHBondContact CA-O 3.27Å; R435-K442 HydrophobicContact CG-CB 4.33Å; R435-K442 PolarHBondContact N-O 3.07Å; R435-K442 VanDerWaalsContact N-O 3.08Å; R435-K442 PolarHBondContact O-N 3.27Å; E437-K442 HydrophobicContact CB-CG 4.08Å; K442-V444 PolarHBondContact O-N 3.45Å
443	N	83.8	Confident	89.4	Confident	49 Å²	49	80.5 Å²	80.5	26%	0.262	42%	0.424	S	S	.	.	S	Bend	trans	56.3	36.9	172.5	-51.5	-38.5	0	0	0	114.1	P433 A434 R435 A546	P433-N443 HydrophobicContact CB-CB 3.92Å; P433-N443 HydrophobicContact CG-CB 4.02Å; P433-N443 WeakPolarHBondContact O-CB 3.32Å; P433-N443 PolarHBondContact O-ND2 2.94Å; A434-N443 WeakPolarHBondContact CA-O 3.41Å; A434-N443 WeakPolarHBondContact CB-O 3.37Å; R435-N443 VanDerWaalsContact CZ-ND2 3.32Å; R435-N443 PolarHBondContact NH1-ND2 3.47Å; N443-A546 HydrophobicContact CB-CB 3.66Å; N443-A546 VanDerWaalsContact OD1-CB 3.23Å; N443-A546 WeakPolarHBondContact OD1-CB 3.4Å
444	V	80.3	Confident	89.8	Confident	92 Å²	92	78.7 Å²	78.7	56%	0.558	41%	0.412	S	S	*	.			trans	-81.7	147.1	170.9	-170.4	0	0	0	0	108.5	V441 K442	V441-V444 HydrophobicContact CB-CG2 3.96Å; V441-V444 HydrophobicContact CG1-CG2 3.18Å; K442-V444 PolarHBondContact O-N 3.45Å
445	G	68.3	Low	90.2	Very high	39 Å²	39	76.1 Å²	76.1	40%	0.402	39%	0.391	S	S	.	.			trans	90.1	53.1	173.7	0	0	0	0	0	113.3	H447 P547	G445-H447 PolarHBondContact O-N 3.38Å; G445-H447 PolarHBondContact O-ND1 3.33Å; G445-P547 WeakPolarHBondContact O-CD 3.28Å; G445-P547 VanDerWaalsContact O-CG 3.22Å; G445-P547 WeakPolarHBondContact O-CG 3.41Å
446	V	67.9	Low	90.5	Very high	31 Å²	31	71.2 Å²	71.2	19%	0.188	37%	0.373	C	S	.	.			trans	-46.7	121.1	166.6	164.3	0	0	0	0	110.2	A432 F533 L544	A432-V446 HydrophobicContact CB-CG2 4.35Å; V446-F533 HydrophobicContact CG1-CE1 4.03Å; V446-F533 HydrophobicContact CG1-CZ 4.49Å; V446-L544 HydrophobicContact CG1-CB 3.59Å; V446-L544 HydrophobicContact CG1-CD1 3.08Å; V446-L544 HydrophobicContact CG1-CD2 4.45Å; V446-L544 HydrophobicContact CG1-CG 3.83Å; V446-L544 HydrophobicContact CG2-CB 4.42Å
447	H	81.9	Confident	90.8	Very high	120 Å²	120	62.7 Å²	62.7	56%	0.556	34%	0.341	S	S	*	.			trans	-97.3	106.8	-177.2	-85.5	29.1	0	0	0	111.5	G445	G445-H447 PolarHBondContact O-N 3.38Å; G445-H447 PolarHBondContact O-ND1 3.33Å
448	I	92.4	Very high	90.9	Very high	8 Å²	8	60.1 Å²	60.1	4%	0.041	33%	0.328	C	S	.	.			trans	-88.3	128.8	165.7	-67.6	176.8	0	0	0	108	T452 V514 I526 A529 E530 F533 L544	I448-T452 HydrophobicContact CG2-CG2 4.31Å; I448-V514 HydrophobicContact CG2-CG2 3.79Å; I448-I526 WeakPolarHBondContact O-CG2 3.31Å; I448-A529 HydrophobicContact CD1-CB 4.47Å; I448-A529 HydrophobicContact CG2-CB 3.85Å; I448-E530 HydrophobicContact CB-CG 4.05Å; I448-E530 HydrophobicContact CD1-CG 4.16Å; I448-E530 HydrophobicContact CG1-CG 4.45Å; I448-F533 HydrophobicContact CD1-CB 3.77Å; I448-F533 HydrophobicContact CD1-CD2 4.48Å; I448-F533 HydrophobicContact CD1-CG 4.04Å; I448-L544 HydrophobicContact CD1-CD1 4.38Å; I448-L544 HydrophobicContact CG1-CD1 4Å
449	T	94.9	Very high	91	Very high	63 Å²	63	53.9 Å²	53.9	39%	0.387	30%	0.298	S	S	.	.			trans	-118.1	171.3	179.3	72.4	0	0	0	0	109.9	Q451 T452 V514	T449-Q451 PolarHBondContact O-N 3.04Å; T449-Q451 VanDerWaalsContact O-N 3.09Å; T449-Q451 PolarHBondContact OG1-N 3.09Å; T449-T452 PolarHBondContact N-OG1 3.5Å; T449-T452 WeakPolarHBondContact O-CB 3.34Å; T449-T452 PolarHBondContact O-N 2.77Å; T449-T452 PolarHBondContact O-OG1 3.32Å; T449-T452 PolarHBondContact OG1-N 3.08Å; T449-T452 PolarHBondContact OG1-OG1 2.8Å; T449-V514 WeakPolarHBondContact O-CB 3.41Å
450	T	96.4	Very high	91	Very high	39 Å²	39	52.9 Å²	52.9	24%	0.239	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-18.3	172.8	55.6	0	0	0	0	113.7	T513 G515 I522 I526	T450-T513 WeakPolarHBondContact O-CG2 3.5Å; T450-G515 WeakPolarHBondContact O-CA 3.47Å; T450-G515 PolarHBondContact O-N 3.11Å; T450-I522 HydrophobicContact CG2-CG2 3.54Å; T450-I526 HydrophobicContact CG2-CD1 4.17Å; T450-I526 HydrophobicContact CG2-CG1 4.37Å
451	Q	96.8	Very high	91.1	Very high	143 Å²	143	46 Å²	46	67%	0.668	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-14.3	177.5	-59.8	-56.7	-31.3	0	0	113.2	T449 K453	T449-Q451 PolarHBondContact O-N 3.04Å; T449-Q451 VanDerWaalsContact O-N 3.09Å; T449-Q451 PolarHBondContact OG1-N 3.09Å; Q451-K453 PolarHBondContact O-N 2.97Å
452	T	97.2	Very high	91.4	Very high	21 Å²	21	41.9 Å²	41.9	13%	0.129	23%	0.234	C	C	.	.			trans	-60.8	132	178.8	-57.4	0	0	0	0	109.4	I448 T449 I454 V514 T540 L544	I448-T452 HydrophobicContact CG2-CG2 4.31Å; T449-T452 PolarHBondContact N-OG1 3.5Å; T449-T452 WeakPolarHBondContact O-CB 3.34Å; T449-T452 PolarHBondContact O-N 2.77Å; T449-T452 PolarHBondContact O-OG1 3.32Å; T449-T452 PolarHBondContact OG1-N 3.08Å; T449-T452 PolarHBondContact OG1-OG1 2.8Å; T452-I454 HydrophobicContact CG2-CG2 4.17Å; T452-V514 WeakPolarHBondContact O-CG2 3.39Å; T452-V514 PolarHBondContact O-N 3.17Å; T452-T540 HydrophobicContact CG2-CG2 3.58Å; T452-L544 HydrophobicContact CG2-CD2 4.28Å
453	K	98.3	Very high	91.8	Very high	108 Å²	108	42 Å²	42	47%	0.47	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	124.6	175.3	-69.6	177.7	-174.9	172.8	0	109.4	Q451 F511 V512 T540 S541	Q451-K453 PolarHBondContact O-N 2.97Å; K453-F511 HydrophobicContact CB-CB 4.21Å; K453-F511 HydrophobicContact CB-CD1 4.27Å; K453-V512 CarbonylContact C-O 3.53Å; K453-V512 VanDerWaalsContact CA-O 3.31Å; K453-V512 WeakPolarHBondContact CA-O 3.3Å; K453-T540 CarbonylContact O-C 3.54Å; K453-T540 VanDerWaalsContact O-CA 3.27Å; K453-T540 WeakPolarHBondContact O-CA 3.46Å; K453-S541 PolarHBondContact O-N 3.29Å
454	I	98.3	Very high	92.4	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	156.2	-177.1	58.9	165.3	0	0	0	111.1	T452 L504 F511 V512 V514 L517 A529 I538 H539 T540	T452-I454 HydrophobicContact CG2-CG2 4.17Å; I454-L504 HydrophobicContact CD1-CD1 4.25Å; I454-L504 HydrophobicContact CD1-CD2 4.4Å; I454-L504 HydrophobicContact CG1-CD1 4.34Å; I454-F511 WeakPolarHBondContact O-CA 3.38Å; I454-V512 HydrophobicContact CG1-CG2 4.04Å; I454-V512 PolarHBondContact N-O 3.4Å; I454-V512 PolarHBondContact O-N 2.83Å; I454-V514 HydrophobicContact CD1-CG2 3.96Å; I454-V514 HydrophobicContact CG1-CG2 4.03Å; I454-V514 HydrophobicContact CG2-CG2 3.89Å; I454-L517 HydrophobicContact CD1-CD1 4.26Å; I454-A529 HydrophobicContact CD1-CB 4.1Å; I454-I538 HydrophobicContact CB-CD1 4Å; I454-I538 HydrophobicContact CD1-CD1 3.93Å; I454-I538 HydrophobicContact CG2-CD1 3.89Å; I454-H539 WeakPolarHBondContact CA-O 3.49Å; I454-T540 HydrophobicContact CG2-CG2 4.13Å
455	K	97.7	Very high	93.2	Very high	3 Å²	3	36.8 Å²	36.8	1%	0.013	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	149.1	175.4	-175.7	-173.9	55.8	164.1	0	108.7	N102 L457 Y508 P509 F511 I538 H539	N102-K455 PolarHBondContact OD1-NZ 3.08Å; K455-L457 PolarHBondContact O-N 2.78Å; K455-Y508 HydrophobicContact CD-CD2 4.31Å; K455-Y508 HydrophobicContact CD-CE2 4.29Å; K455-Y508 HydrophobicContact CG-CD2 4.05Å; K455-Y508 HydrophobicContact CG-CE2 4.4Å; K455-P509 WeakPolarHBondContact CD-O 3.17Å; K455-F511 HydrophobicContact CB-CD1 3.58Å; K455-F511 HydrophobicContact CB-CE1 3.63Å; K455-F511 HydrophobicContact CB-CG 4.09Å; K455-F511 HydrophobicContact CB-CZ 4.23Å; K455-F511 HydrophobicContact CD-CD2 4.43Å; K455-F511 HydrophobicContact CD-CE2 4.33Å; K455-F511 HydrophobicContact CD-CZ 4.44Å; K455-I538 CarbonylContact O-C 3.54Å; K455-I538 WeakPolarHBondContact O-CA 3.41Å; K455-I538 VanDerWaalsContact O-CB 3.31Å; K455-I538 WeakPolarHBondContact O-CB 3.37Å; K455-H539 WeakPolarHBondContact CE-NE2 3.22Å; K455-H539 PolarHBondContact N-O 3.44Å; K455-H539 PolarHBondContact NZ-NE2 2.68Å; K455-H539 PolarHBondContact O-N 3.21Å
456	L	98.1	Very high	94.2	Very high	6 Å²	6	36.4 Å²	36.4	3%	0.031	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.9	140.5	166.2	-74.3	-177	0	0	0	110.6	R458 A462 L504 I505 Y508 I537 I538	L456-R458 VanDerWaalsContact C-N 3.32Å; L456-R458 PolarHBondContact O-N 3.32Å; L456-A462 HydrophobicContact CD2-CB 4.2Å; L456-L504 HydrophobicContact CD2-CD2 4.13Å; L456-L504 HydrophobicContact CD2-CG 4.29Å; L456-L504 HydrophobicContact CG-CG 4.18Å; L456-I505 HydrophobicContact CD1-CB 4.25Å; L456-I505 HydrophobicContact CD1-CG1 3.89Å; L456-Y508 HydrophobicContact CB-CD2 3.86Å; L456-Y508 WeakPolarHBondContact O-CE2 3.3Å; L456-I537 HydrophobicContact CD2-CG2 3.8Å; L456-I538 HydrophobicContact CD2-CG2 4.12Å
457	L	97.8	Very high	94.9	Very high	3 Å²	3	39 Å²	39	2%	0.016	21%	0.209	C	C	.	.	S	Bend	trans	-58.1	-47.4	179	-168.6	72.5	0	0	0	110.7	P418 L420 E424 K455 V477 G536 I537 H539	P418-L457 HydrophobicContact CG-CD2 4.16Å; L420-L457 HydrophobicContact CD2-CD1 4.08Å; L420-L457 HydrophobicContact CD2-CD2 3.41Å; L420-L457 VanDerWaalsContact CD2-CD2 3.41Å; L420-L457 HydrophobicContact CD2-CG 3.95Å; E424-L457 HydrophobicContact CB-CD1 4.22Å; K455-L457 PolarHBondContact O-N 2.78Å; L457-V477 HydrophobicContact CD2-CG1 3.75Å; L457-G536 WeakPolarHBondContact CD2-O 3.46Å; L457-I537 WeakPolarHBondContact CB-O 3.48Å; L457-I537 PolarHBondContact N-O 3.42Å; L457-H539 HydrophobicContact CD1-CB 4.01Å
458	R	97.2	Very high	94.9	Very high	17 Å²	17	37 Å²	37	6%	0.064	22%	0.221	C	C	.	.			trans	-143.3	152.7	176.8	-59.6	-65.9	178.5	127.6	4.1	110.8	S104 P418 V419 E424 L456 G460 C461	S104-R458 VanDerWaalsContact CB-CD 3.49Å; P418-R458 HydrophobicContact CB-CG 4.05Å; V419-R458 PolarHBondContact O-NH2 3.11Å; E424-R458 VanDerWaalsContact CD-NE 3.32Å; E424-R458 VanDerWaalsContact CD-NH2 3.34Å; E424-R458 IonicContact OE1-CZ 3.41Å; E424-R458 VanDerWaalsContact OE1-CZ 3.23Å; E424-R458 IonicContact OE1-NE 3.85Å; E424-R458 PolarHBondContact OE1-NE 3.01Å; E424-R458 IonicContact OE1-NH2 3.48Å; E424-R458 PolarHBondContact OE1-NH2 2.94Å; E424-R458 IonicContact OE2-CZ 2.78Å; E424-R458 IonicContact OE2-NE 3.19Å; E424-R458 PolarHBondContact OE2-NE 3.08Å; E424-R458 IonicContact OE2-NH2 3.66Å; E424-R458 PolarHBondContact OE2-NH2 3.07Å; L456-R458 VanDerWaalsContact C-N 3.32Å; L456-R458 PolarHBondContact O-N 3.32Å; R458-G460 PolarHBondContact O-N 2.93Å; R458-C461 HydrophobicContact CB-CB 3.97Å; R458-C461 PolarHBondContact N-SG 3.24Å; R458-C461 PolarHBondContact O-N 2.81Å; R458-C461 PolarHBondContact O-SG 3.24Å
459	G	95.8	Very high	94.5	Very high	14 Å²	14	45.2 Å²	45.2	14%	0.144	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-14.9	-178.7	0	0	0	0	0	114.7	S104 K105 Y508	S104-G459 PolarHBondContact OG-N 3.41Å; K105-G459 WeakPolarHBondContact CE-O 3.36Å; G459-Y508 VanDerWaalsContact CA-CE1 3.45Å; G459-Y508 VanDerWaalsContact N-CZ 3.29Å
460	G	93.6	Very high	94.3	Very high	28 Å²	28	43.4 Å²	43.4	29%	0.289	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.2	15.9	177.4	0	0	0	0	0	114.8	E223 R458	E223-G460 PolarHBondContact OE1-N 3.05Å; R458-G460 PolarHBondContact O-N 2.93Å
461	C	96.2	Very high	94.2	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.007	26%	0.258	C	S	.	.	S	Bend	trans	-94	-6.5	-178.9	70.3	0	0	0	0	114.9	R458 Y475 T476 V477	R458-C461 HydrophobicContact CB-CB 3.97Å; R458-C461 PolarHBondContact N-SG 3.24Å; R458-C461 PolarHBondContact O-N 2.81Å; R458-C461 PolarHBondContact O-SG 3.24Å; C461-Y475 CarbonylContact O-C 3.52Å; C461-Y475 WeakPolarHBondContact O-CA 3.17Å; C461-Y475 WeakPolarHBondContact O-CB 3.22Å; C461-T476 WeakPolarHBondContact CA-OG1 3.45Å; C461-T476 PolarHBondContact O-N 3.08Å; C461-V477 HydrophobicContact CB-CG1 4.11Å
462	A	97.5	Very high	94.2	Very high	8 Å²	8	38.8 Å²	38.8	7%	0.066	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	141.4	-176.8	0	0	0	0	0	111.1	L456 L473 C474 I537	L456-A462 HydrophobicContact CD2-CB 4.2Å; A462-L473 HydrophobicContact CB-CD1 4.19Å; A462-C474 CarbonylContact C-O 3.59Å; A462-C474 VanDerWaalsContact CA-O 3.29Å; A462-C474 WeakPolarHBondContact CA-O 3.29Å; A462-I537 HydrophobicContact CB-CG2 3.75Å
463	R	97.3	Very high	94.2	Very high	89 Å²	89	37.9 Å²	37.9	34%	0.336	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	135.8	175.7	-179.4	-177.5	179.6	92.2	4.1	111.2	D405 A408 F412 C474	D405-R463 IonicContact OD1-CZ 3.45Å; D405-R463 IonicContact OD1-NE 3.27Å; D405-R463 PolarHBondContact OD1-NE 2.69Å; D405-R463 IonicContact OD1-NH2 3.6Å; D405-R463 PolarHBondContact OD1-NH2 3.1Å; A408-R463 VanDerWaalsContact CB-NE 3.35Å; F412-R463 HydrophobicContact CE1-CB 3.89Å; F412-R463 HydrophobicContact CE2-CB 3.77Å; F412-R463 HydrophobicContact CZ-CB 3.38Å; R463-C474 PolarHBondContact N-O 2.94Å; R463-C474 PolarHBondContact O-N 2.91Å
464	L	97.3	Very high	94.2	Very high	31 Å²	31	33 Å²	33	16%	0.162	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	131.3	167.3	-68.4	171.6	0	0	0	109.9	V471 H472 L473 I493 T498 V501 E502 I505	L464-V471 HydrophobicContact CB-CG1 4.25Å; L464-V471 HydrophobicContact CD2-CG1 3.8Å; L464-H472 CarbonylContact C-O 3.58Å; L464-H472 WeakPolarHBondContact CA-O 3.24Å; L464-L473 HydrophobicContact CD2-CB 4.28Å; L464-L473 HydrophobicContact CD2-CD1 3.96Å; L464-L473 HydrophobicContact CG-CD1 4.26Å; L464-I493 HydrophobicContact CD2-CG1 4.06Å; L464-T498 HydrophobicContact CD1-CG2 4.38Å; L464-V501 HydrophobicContact CD1-CB 4.22Å; L464-V501 HydrophobicContact CD1-CG1 4.04Å; L464-V501 HydrophobicContact CD2-CB 4.24Å; L464-V501 HydrophobicContact CD2-CG1 3.74Å; L464-V501 HydrophobicContact CG-CG1 3.91Å; L464-E502 HydrophobicContact CD1-CB 4.07Å; L464-I505 HydrophobicContact CD1-CD1 4.24Å; L464-I505 HydrophobicContact CG-CD1 3.95Å
465	C	95.8	Very high	94.2	Very high	1 Å²	1	33.6 Å²	33.6	1%	0.007	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	133.2	178.3	-66.8	0	0	0	0	110.5	D405 K409 H472	D405-C465 HydrophobicContact CB-CB 3.98Å; K409-C465 HydrophobicContact CD-CB 4.33Å; K409-C465 VanDerWaalsContact CE-CB 3.43Å; K409-C465 HydrophobicContact CG-CB 3.98Å; C465-H472 PolarHBondContact N-O 3.14Å; C465-H472 PolarHBondContact O-N 3.32Å
466	G	90.8	Very high	94.2	Very high	31 Å²	31	33.7 Å²	33.7	32%	0.32	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	144.8	172.8	0	0	0	0	0	113	D405 K409	D405-G466 PolarHBondContact OD2-N 2.84Å; D405-G466 VanDerWaalsContact OD2-N 3.16Å; K409-G466 PolarHBondContact NZ-O 3.47Å
467	D	82.4	Confident	94.1	Very high	84 Å²	84	34 Å²	34	45%	0.449	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	90	169.2	-148.9	-26.4	0	0	0	110.7	K409 D469 A470	K409-D467 VanDerWaalsContact NZ-CG 3.31Å; K409-D467 IonicContact NZ-OD2 2.98Å; K409-D467 PolarHBondContact NZ-OD2 3.48Å; D467-D469 PolarHBondContact O-N 3.19Å; D467-A470 PolarHBondContact N-O 3Å; D467-A470 PolarHBondContact O-N 3.3Å
468	G	81.6	Confident	93.9	Very high	78 Å²	78	37.8 Å²	37.8	80%	0.804	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	60	-121.3	-168.1	0	0	0	0	0	110.5
469	D	83.3	Confident	94	Very high	181 Å²	181	37.7 Å²	37.7	97%	0.968	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-7.2	178.7	-60.8	-35.2	0	0	0	113.4	D467	D467-D469 PolarHBondContact O-N 3.19Å
470	A	90.9	Very high	94.1	Very high	25 Å²	25	38.3 Å²	38.3	21%	0.207	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	148.7	-178.7	0	0	0	0	0	111.8	D467 E492	D467-A470 PolarHBondContact N-O 3Å; D467-A470 PolarHBondContact O-N 3.3Å; A470-E492 HydrophobicContact CB-CG 4.38Å
471	V	94.8	Very high	94.3	Very high	44 Å²	44	40.3 Å²	40.3	27%	0.267	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	123.2	172.1	-178.2	0	0	0	0	108.5	L464 I493 T498	L464-V471 HydrophobicContact CB-CG1 4.25Å; L464-V471 HydrophobicContact CD2-CG1 3.8Å; V471-I493 PolarHBondContact O-N 3.17Å; V471-T498 HydrophobicContact CG1-CG2 4.38Å
472	H	96.4	Very high	94.3	Very high	42 Å²	42	43.1 Å²	43.1	19%	0.194	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	140.6	177.3	-73.2	-101.2	0	0	0	110.8	L464 C465 F491	L464-H472 CarbonylContact C-O 3.58Å; L464-H472 WeakPolarHBondContact CA-O 3.24Å; C465-H472 PolarHBondContact N-O 3.14Å; C465-H472 PolarHBondContact O-N 3.32Å; H472-F491 CarbonylContact C-O 3.59Å; H472-F491 WeakPolarHBondContact CA-O 3.37Å
473	L	97.8	Very high	94.3	Very high	1 Å²	1	48.1 Å²	48.1	1%	0.005	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	109.8	165.8	-174.8	68.3	0	0	0	109.6	A462 L464 S490 F491 I493 V501 I505 L532 I537	A462-L473 HydrophobicContact CB-CD1 4.19Å; L464-L473 HydrophobicContact CD2-CB 4.28Å; L464-L473 HydrophobicContact CD2-CD1 3.96Å; L464-L473 HydrophobicContact CG-CD1 4.26Å; L473-S490 WeakPolarHBondContact O-CA 3.5Å; L473-S490 WeakPolarHBondContact O-CB 3.4Å; L473-F491 HydrophobicContact CB-CZ 4.39Å; L473-F491 HydrophobicContact CD2-CE1 4.22Å; L473-F491 HydrophobicContact CD2-CZ 3.82Å; L473-F491 PolarHBondContact N-O 3.17Å; L473-F491 PolarHBondContact O-N 2.69Å; L473-I493 HydrophobicContact CB-CD1 3.9Å; L473-I493 HydrophobicContact CB-CG1 3.66Å; L473-I493 HydrophobicContact CD2-CD1 4.35Å; L473-V501 HydrophobicContact CD1-CG1 3.86Å; L473-V501 HydrophobicContact CD2-CG1 4.3Å; L473-I505 HydrophobicContact CD1-CD1 4.47Å; L473-L532 HydrophobicContact CD2-CD2 3.59Å; L473-I537 HydrophobicContact CD2-CD1 3.81Å
474	C	97.8	Very high	94.3	Very high	7 Å²	7	47.6 Å²	47.6	5%	0.047	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	141	172.2	-64.1	0	0	0	0	110	F412 A462 R463 K489	F412-C474 HydrophobicContact CB-CB 4.37Å; F412-C474 HydrophobicContact CD1-CB 4Å; F412-C474 WeakPolarHBondContact CE1-O 3.43Å; F412-C474 HydrophobicContact CG-CB 4.28Å; A462-C474 CarbonylContact C-O 3.59Å; A462-C474 VanDerWaalsContact CA-O 3.29Å; A462-C474 WeakPolarHBondContact CA-O 3.29Å; R463-C474 PolarHBondContact N-O 2.94Å; R463-C474 PolarHBondContact O-N 2.91Å; C474-K489 WeakPolarHBondContact CA-O 3.48Å
475	Y	97.9	Very high	94.3	Very high	12 Å²	12	52.9 Å²	52.9	5%	0.047	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	161.1	-177.9	59	-82.1	0	0	0	112.9	C461 V477 D478 K489 F491 I537	C461-Y475 CarbonylContact O-C 3.52Å; C461-Y475 WeakPolarHBondContact O-CA 3.17Å; C461-Y475 WeakPolarHBondContact O-CB 3.22Å; Y475-V477 HydrophobicContact CD2-CG2 3.65Å; Y475-V477 HydrophobicContact CE2-CG2 4.25Å; Y475-D478 HydrophobicContact CE2-CB 4.21Å; Y475-K489 HydrophobicContact CD1-CB 4.3Å; Y475-K489 HydrophobicContact CD2-CB 3.95Å; Y475-K489 HydrophobicContact CE1-CB 3.94Å; Y475-K489 HydrophobicContact CE2-CB 3.65Å; Y475-K489 HydrophobicContact CE2-CG 4.32Å; Y475-K489 HydrophobicContact CG-CB 4.3Å; Y475-K489 PolarHBondContact N-O 3.45Å; Y475-K489 VanDerWaalsContact N-O 3.1Å; Y475-F491 HydrophobicContact CD1-CD1 4.25Å; Y475-F491 HydrophobicContact CD1-CE1 4.13Å; Y475-F491 AromaticContact CE1-CD1 3.64Å; Y475-F491 HydrophobicContact CE1-CD1 3.64Å; Y475-F491 AromaticContact CE1-CE1 3.86Å; Y475-F491 HydrophobicContact CE1-CE1 3.86Å; Y475-I537 HydrophobicContact CD1-CD1 3.94Å; Y475-I537 HydrophobicContact CD2-CD1 4.4Å; Y475-I537 HydrophobicContact CD2-CG1 4.43Å; Y475-I537 HydrophobicContact CG-CD1 3.84Å; Y475-I537 HydrophobicContact CG-CG1 4.18Å
476	T	97.4	Very high	94.2	Very high	4 Å²	4	56.7 Å²	56.7	3%	0.025	31%	0.312	C	S	.	.			trans	-113.6	-8.9	-173.6	64.6	0	0	0	0	114.4	F412 C415 P417 C461 D478 N479	F412-T476 HydrophobicContact CB-CG2 4.36Å; F412-T476 HydrophobicContact CD1-CG2 3.6Å; F412-T476 HydrophobicContact CE1-CG2 4.03Å; F412-T476 HydrophobicContact CG-CG2 4.07Å; C415-T476 HydrophobicContact CB-CG2 3.56Å; P417-T476 WeakPolarHBondContact CA-O 3.47Å; C461-T476 WeakPolarHBondContact CA-OG1 3.45Å; C461-T476 PolarHBondContact O-N 3.08Å; T476-D478 VanDerWaalsContact C-N 3.25Å; T476-D478 PolarHBondContact O-N 2.91Å; T476-N479 VanDerWaalsContact O-CB 3.3Å; T476-N479 WeakPolarHBondContact O-CB 3.48Å; T476-N479 PolarHBondContact O-N 3.45Å
477	V	96.4	Very high	94.5	Very high	12 Å²	12	62.3 Å²	62.3	7%	0.073	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-28.6	-168.6	-64.7	0	0	0	0	114.1	P418 L457 C461 Y475 K535 I537	P418-V477 HydrophobicContact CG-CG1 4Å; L457-V477 HydrophobicContact CD2-CG1 3.75Å; C461-V477 HydrophobicContact CB-CG1 4.11Å; Y475-V477 HydrophobicContact CD2-CG2 3.65Å; Y475-V477 HydrophobicContact CE2-CG2 4.25Å; V477-K535 WeakPolarHBondContact CG2-O 3.47Å; V477-I537 HydrophobicContact CG2-CG1 4.35Å
478	D	94.8	Very high	95.1	Very high	84 Å²	84	61.5 Å²	61.5	45%	0.449	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	12.5	178.1	-71.5	-22.7	0	0	0	113.3	Y475 T476 K489	Y475-D478 HydrophobicContact CE2-CB 4.21Å; T476-D478 VanDerWaalsContact C-N 3.25Å; T476-D478 PolarHBondContact O-N 2.91Å; D478-K489 HydrophobicContact CB-CD 4.37Å; D478-K489 HydrophobicContact CB-CG 4.23Å; D478-K489 WeakPolarHBondContact O-CE 3.39Å
479	N	97.9	Very high	95.8	Very high	15 Å²	15	60 Å²	60	8%	0.08	30%	0.3	C	S	.	.			trans	-68.6	152.9	175.5	-73.2	2.8	0	0	0	110.9	F412 C415 P417 T476	F412-N479 PolarHBondContact O-ND2 3.35Å; C415-N479 WeakPolarHBondContact O-CB 3.26Å; C415-N479 PolarHBondContact O-ND2 3.31Å; P417-N479 HydrophobicContact CB-CB 4.47Å; P417-N479 WeakPolarHBondContact CB-O 3.44Å; P417-N479 WeakPolarHBondContact CD-O 3.28Å; P417-N479 WeakPolarHBondContact CG-O 3.48Å; T476-N479 VanDerWaalsContact O-CB 3.3Å; T476-N479 WeakPolarHBondContact O-CB 3.48Å; T476-N479 PolarHBondContact O-N 3.45Å
480	S	97.5	Very high	96.5	Very high	26 Å²	26	54 Å²	54	18%	0.182	27%	0.272	C	S	.	.			trans	-80.2	149.9	171.1	154.4	0	0	0	0	111.2	V482 K485	S480-V482 PolarHBondContact O-N 2.9Å; S480-V482 WeakPolarHBondContact OG-CA 3.43Å; S480-V482 WeakPolarHBondContact OG-CB 3.14Å; S480-V482 PolarHBondContact OG-N 2.59Å; S480-V482 PolarHBondContact OG-O 3.34Å; S480-K485 WeakPolarHBondContact OG-CB 3.4Å
481	R	97.9	Very high	96.7	Very high	71 Å²	71	54.6 Å²	54.6	27%	0.268	27%	0.27	S	S	.	.	S	Bend	trans	-67.3	-18.3	168.8	-68.6	165.4	59.7	-167.3	2.6	113.2	Q208 A209 S211 W215 P417	Q208-R481 PolarHBondContact O-NE 2.97Å; Q208-R481 PolarHBondContact O-NH2 3.2Å; A209-R481 PolarHBondContact O-NH2 2.99Å; A209-R481 VanDerWaalsContact O-NH2 3.16Å; S211-R481 PolarHBondContact O-NH2 3.21Å; W215-R481 HydrophobicContact CD2-CG 3.94Å; W215-R481 HydrophobicContact CE3-CG 4.46Å; W215-R481 HydrophobicContact CG-CG 4.14Å; W215-R481 HydrophobicContact CZ2-CG 4.45Å; P417-R481 HydrophobicContact CG-CG 4.17Å
482	V	97.8	Very high	96.8	Very high	59 Å²	59	57.3 Å²	57.3	36%	0.358	28%	0.28	S	S	.	.	S	Bend	trans	-93	122.7	170.8	-178.3	0	0	0	0	108.4	A209 S480 H484 K485	A209-V482 HydrophobicContact CB-CG2 3.91Å; S480-V482 PolarHBondContact O-N 2.9Å; S480-V482 WeakPolarHBondContact OG-CA 3.43Å; S480-V482 WeakPolarHBondContact OG-CB 3.14Å; S480-V482 PolarHBondContact OG-N 2.59Å; S480-V482 PolarHBondContact OG-O 3.34Å; V482-H484 PolarHBondContact O-N 3.12Å; V482-K485 HydrophobicContact CB-CB 3.99Å; V482-K485 HydrophobicContact CB-CD 4.25Å; V482-K485 HydrophobicContact CG1-CB 4.18Å; V482-K485 WeakPolarHBondContact O-CB 3.48Å; V482-K485 PolarHBondContact O-N 3.28Å
483	Y	97.4	Very high	96.8	Very high	113 Å²	113	55.7 Å²	55.7	44%	0.443	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.7	126.3	-178.9	179.6	-100.7	0	0	0	111.8	M228 D414 K485	M228-Y483 HydrophobicContact CE-CD2 3.46Å; M228-Y483 VanDerWaalsContact CE-CD2 3.46Å; M228-Y483 HydrophobicContact CE-CE2 4.13Å; M228-Y483 HydrophobicContact CE-CG 4.19Å; M228-Y483 HydrophobicContact SD-CD2 3.52Å; M228-Y483 VanDerWaalsContact SD-CD2 3.52Å; M228-Y483 HydrophobicContact SD-CE2 3.53Å; M228-Y483 VanDerWaalsContact SD-CE2 3.53Å; D414-Y483 HydrophobicContact CB-CE2 3.97Å; D414-Y483 PolarHBondContact OD1-OH 2.95Å; Y483-K485 PolarHBondContact O-N 3.04Å
484	H	96.6	Very high	96.6	Very high	78 Å²	78	60.1 Å²	60.1	36%	0.361	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.4	25.7	177.5	-66.8	-169.7	0	0	0	115.1	H413 D414 V482 E486	H413-H484 AromaticContact CD2-CD2 3.86Å; H413-H484 AromaticContact CE1-CD2 3.53Å; H413-H484 AromaticContact CE1-CE1 3.82Å; H413-H484 AromaticContact CE1-CG 3.57Å; H413-H484 AromaticContact CE1-ND1 3.79Å; H413-H484 AromaticContact CE1-NE2 3.71Å; H413-H484 AromaticContact CG-CD2 3.82Å; H413-H484 AromaticContact CG-NE2 3.69Å; H413-H484 AromaticContact ND1-CD2 3.64Å; H413-H484 AromaticContact ND1-CE1 3.59Å; H413-H484 AromaticContact ND1-NE2 3.36Å; H413-H484 PolarHBondContact ND1-NE2 3.32Å; H413-H484 AromaticContact NE2-CD2 3.68Å; H413-H484 AromaticContact NE2-CG 3.91Å; D414-H484 IonicContact OD1-CD2 2.86Å; D414-H484 IonicContact OD1-CE1 2.7Å; D414-H484 PolarHBondContact OD1-CE1 2.84Å; D414-H484 IonicContact OD1-NE2 3.25Å; D414-H484 PolarHBondContact OD1-NE2 3.27Å; V482-H484 PolarHBondContact O-N 3.12Å; H484-E486 PolarHBondContact O-N 2.98Å
485	K	96.5	Very high	96.2	Very high	143 Å²	143	63.8 Å²	63.8	62%	0.622	32%	0.324	S	S	*	.	S	Bend	trans	-65.6	-31.3	171.6	-179.6	-175.9	172.8	-165.8	0	111.7	S480 V482 Y483	S480-K485 WeakPolarHBondContact OG-CB 3.4Å; V482-K485 HydrophobicContact CB-CB 3.99Å; V482-K485 HydrophobicContact CB-CD 4.25Å; V482-K485 HydrophobicContact CG1-CB 4.18Å; V482-K485 WeakPolarHBondContact O-CB 3.48Å; V482-K485 PolarHBondContact O-N 3.28Å; Y483-K485 PolarHBondContact O-N 3.04Å
486	E	94.5	Very high	95.8	Very high	81 Å²	81	68.3 Å²	68.3	38%	0.379	35%	0.346	S	S	.	.	S	Bend	trans	-111.5	153.8	-179	-59.4	-64.9	148.7	0	0	109.7	H413 H484 K489	H413-E486 PolarHBondContact NE2-O 3.29Å; H484-E486 PolarHBondContact O-N 2.98Å; E486-K489 IonicContact OE2-NZ 2.7Å
487	E	96.4	Very high	95.7	Very high	148 Å²	148	69.5 Å²	69.5	69%	0.692	35%	0.351	S	S	*	.			trans	-65.2	155.2	170.4	-66.2	-59.5	145.3	0	0	112	K489	E487-K489 WeakPolarHBondContact O-CD 3.35Å; E487-K489 WeakPolarHBondContact O-CE 3.38Å
488	P	96.2	Very high	95.6	Very high	67 Å²	67	70.2 Å²	70.2	44%	0.435	36%	0.356	S	S	.	.			trans	-51.5	139.3	174.6	-23.6	30.8	0	0	0	112.6	H413	H413-P488 HydrophobicContact CB-CB 4.32Å; H413-P488 HydrophobicContact CB-CG 4.27Å
489	K	96.4	Very high	95.7	Very high	47 Å²	47	71.1 Å²	71.1	20%	0.204	36%	0.36	C	S	.	.			trans	-101.3	112.2	-178.4	-52.8	-58.3	-179.4	-167.4	0	110.8	C474 Y475 D478 E486 E487	C474-K489 WeakPolarHBondContact CA-O 3.48Å; Y475-K489 HydrophobicContact CD1-CB 4.3Å; Y475-K489 HydrophobicContact CD2-CB 3.95Å; Y475-K489 HydrophobicContact CE1-CB 3.94Å; Y475-K489 HydrophobicContact CE2-CB 3.65Å; Y475-K489 HydrophobicContact CE2-CG 4.32Å; Y475-K489 HydrophobicContact CG-CB 4.3Å; Y475-K489 PolarHBondContact N-O 3.45Å; Y475-K489 VanDerWaalsContact N-O 3.1Å; D478-K489 HydrophobicContact CB-CD 4.37Å; D478-K489 HydrophobicContact CB-CG 4.23Å; D478-K489 WeakPolarHBondContact O-CE 3.39Å; E486-K489 IonicContact OE2-NZ 2.7Å; E487-K489 WeakPolarHBondContact O-CD 3.35Å; E487-K489 WeakPolarHBondContact O-CE 3.38Å
490	S	96.6	Very high	95.7	Very high	55 Å²	55	70.4 Å²	70.4	39%	0.385	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	163.3	172.6	67.1	0	0	0	0	111.9	L473	L473-S490 WeakPolarHBondContact O-CA 3.5Å; L473-S490 WeakPolarHBondContact O-CB 3.4Å
491	F	96.4	Very high	95.8	Very high	37 Å²	37	69.3 Å²	69.3	16%	0.162	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	156.4	164.8	59.3	-86	0	0	0	109.7	H472 L473 Y475 I493 L531 L532 K535 I537	H472-F491 CarbonylContact C-O 3.59Å; H472-F491 WeakPolarHBondContact CA-O 3.37Å; L473-F491 HydrophobicContact CB-CZ 4.39Å; L473-F491 HydrophobicContact CD2-CE1 4.22Å; L473-F491 HydrophobicContact CD2-CZ 3.82Å; L473-F491 PolarHBondContact N-O 3.17Å; L473-F491 PolarHBondContact O-N 2.69Å; Y475-F491 HydrophobicContact CD1-CD1 4.25Å; Y475-F491 HydrophobicContact CD1-CE1 4.13Å; Y475-F491 AromaticContact CE1-CD1 3.64Å; Y475-F491 HydrophobicContact CE1-CD1 3.64Å; Y475-F491 AromaticContact CE1-CE1 3.86Å; Y475-F491 HydrophobicContact CE1-CE1 3.86Å; F491-I493 HydrophobicContact CD2-CD1 3.93Å; F491-I493 HydrophobicContact CE2-CD1 3.35Å; F491-I493 HydrophobicContact CZ-CD1 4.11Å; F491-L531 HydrophobicContact CD2-CD2 4.42Å; F491-L531 HydrophobicContact CE2-CD2 3.74Å; F491-L531 HydrophobicContact CE2-CG 4.23Å; F491-L531 HydrophobicContact CZ-CD2 4.39Å; F491-L531 HydrophobicContact CZ-CG 4.42Å; F491-L532 HydrophobicContact CZ-CD2 4.14Å; F491-K535 HydrophobicContact CE1-CD 4.44Å; F491-K535 HydrophobicContact CE1-CG 4.02Å; F491-K535 HydrophobicContact CZ-CG 4.43Å; F491-I537 HydrophobicContact CE1-CD1 3.8Å; F491-I537 HydrophobicContact CZ-CD1 4.18Å
492	E	96.5	Very high	95.7	Very high	102 Å²	102	70.2 Å²	70.2	48%	0.477	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	136	178.9	-171	-179.1	151.8	0	0	110.8	A470	A470-E492 HydrophobicContact CB-CG 4.38Å
493	I	96.3	Very high	95.8	Very high	7 Å²	7	70.9 Å²	70.9	4%	0.036	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	123.6	172.4	-62	-62.1	0	0	0	107.7	L464 V471 L473 F491 H497 V501	L464-I493 HydrophobicContact CD2-CG1 4.06Å; V471-I493 PolarHBondContact O-N 3.17Å; L473-I493 HydrophobicContact CB-CD1 3.9Å; L473-I493 HydrophobicContact CB-CG1 3.66Å; L473-I493 HydrophobicContact CD2-CD1 4.35Å; F491-I493 HydrophobicContact CD2-CD1 3.93Å; F491-I493 HydrophobicContact CE2-CD1 3.35Å; F491-I493 HydrophobicContact CZ-CD1 4.11Å; I493-H497 HydrophobicContact CG2-CB 3.76Å; I493-V501 HydrophobicContact CD1-CG2 4.25Å; I493-V501 HydrophobicContact CG2-CG2 4.25Å
494	Q	93.1	Very high	95.8	Very high	94 Å²	94	65.6 Å²	65.6	44%	0.439	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-62.6	147.1	174.4	-61.4	-56.4	-46.2	0	0	110.3	E496 H497 T498	Q494-E496 HydrophobicContact CB-CG 4.1Å; Q494-E496 PolarHBondContact O-N 3.22Å; Q494-E496 VanDerWaalsContact O-N 3.13Å; Q494-H497 PolarHBondContact O-N 3.1Å; Q494-T498 PolarHBondContact O-N 3.19Å; Q494-T498 PolarHBondContact O-OG1 3.38Å
495	A	89.7	Confident	95.8	Very high	84 Å²	84	64 Å²	64	69%	0.694	33%	0.327	S	S	*	.	H	α-helix	trans	-54.4	-37.6	-174.7	0	0	0	0	0	113	H497 T498	A495-H497 PolarHBondContact O-N 3.38Å; A495-T498 PolarHBondContact O-N 3.44Å
496	E	90.3	Very high	95.9	Very high	108 Å²	108	63.6 Å²	63.6	51%	0.505	33%	0.328	S	S	.	.	H	α-helix	trans	-64.5	-17.1	175.9	63	-135.7	-133.6	0	0	115.1	Q494	Q494-E496 HydrophobicContact CB-CG 4.1Å; Q494-E496 PolarHBondContact O-N 3.22Å; Q494-E496 VanDerWaalsContact O-N 3.13Å
497	H	95.1	Very high	96.1	Very high	28 Å²	28	60.7 Å²	60.7	13%	0.13	32%	0.316	C	S	.	.	H	α-helix	trans	-104.1	-12.4	179.5	-64.7	147.3	0	0	0	113.4	I493 Q494 A495 D499 A500 V501 L528	I493-H497 HydrophobicContact CG2-CB 3.76Å; Q494-H497 PolarHBondContact O-N 3.1Å; A495-H497 PolarHBondContact O-N 3.38Å; H497-D499 PolarHBondContact O-N 2.88Å; H497-A500 PolarHBondContact O-N 3.18Å; H497-A500 VanDerWaalsContact O-N 3.16Å; H497-V501 WeakPolarHBondContact O-CG2 3.49Å; H497-V501 PolarHBondContact O-N 3.1Å; H497-L528 HydrophobicContact CB-CD1 4.13Å; H497-L528 HydrophobicContact CB-CD2 4.06Å
498	T	94.9	Very high	96.2	Very high	28 Å²	28	54.8 Å²	54.8	17%	0.172	29%	0.288	C	S	.	.	H	α-helix	trans	-58.9	-50.4	-173.8	-59.7	0	0	0	0	112.2	L464 V471 Q494 A495 A500 V501 E502	L464-T498 HydrophobicContact CD1-CG2 4.38Å; V471-T498 HydrophobicContact CG1-CG2 4.38Å; Q494-T498 PolarHBondContact O-N 3.19Å; Q494-T498 PolarHBondContact O-OG1 3.38Å; A495-T498 PolarHBondContact O-N 3.44Å; T498-A500 PolarHBondContact O-N 3.37Å; T498-V501 PolarHBondContact O-N 3.33Å; T498-E502 WeakPolarHBondContact O-CB 3.2Å; T498-E502 PolarHBondContact O-N 3Å
499	D	96.6	Very high	96.2	Very high	102 Å²	102	53 Å²	53	55%	0.545	28%	0.276	S	S	.	.	H	α-helix	trans	-60.9	-33.3	179.5	-70	1.7	0	0	0	111.8	H497 F503 P518	H497-D499 PolarHBondContact O-N 2.88Å; D499-F503 WeakPolarHBondContact O-CB 3.25Å; D499-F503 PolarHBondContact O-N 3.01Å; D499-P518 HydrophobicContact CB-CG 4.18Å; D499-P518 WeakPolarHBondContact O-CG 3.35Å
500	A	97.8	Very high	96.3	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-73.2	-39.4	179.4	0	0	0	0	0	112.9	H497 T498 L504 L517 P518 C519 L528	H497-A500 PolarHBondContact O-N 3.18Å; H497-A500 VanDerWaalsContact O-N 3.16Å; T498-A500 PolarHBondContact O-N 3.37Å; A500-L504 WeakPolarHBondContact O-CB 3.39Å; A500-L504 PolarHBondContact O-N 2.71Å; A500-L517 HydrophobicContact CB-CB 4.22Å; A500-P518 HydrophobicContact CB-CG 4.13Å; A500-C519 WeakPolarHBondContact CB-SG 3.45Å; A500-L528 HydrophobicContact CB-CD2 3.53Å
501	V	97.9	Very high	96.4	Very high	3 Å²	3	56.7 Å²	56.7	2%	0.018	29%	0.29	C	S	.	.	H	α-helix	trans	-68.2	-41.4	173.3	179.6	0	0	0	0	110.6	L464 L473 I493 H497 T498 L504 I505 L528	L464-V501 HydrophobicContact CD1-CB 4.22Å; L464-V501 HydrophobicContact CD1-CG1 4.04Å; L464-V501 HydrophobicContact CD2-CB 4.24Å; L464-V501 HydrophobicContact CD2-CG1 3.74Å; L464-V501 HydrophobicContact CG-CG1 3.91Å; L473-V501 HydrophobicContact CD1-CG1 3.86Å; L473-V501 HydrophobicContact CD2-CG1 4.3Å; I493-V501 HydrophobicContact CD1-CG2 4.25Å; I493-V501 HydrophobicContact CG2-CG2 4.25Å; H497-V501 WeakPolarHBondContact O-CG2 3.49Å; H497-V501 PolarHBondContact O-N 3.1Å; T498-V501 PolarHBondContact O-N 3.33Å; V501-L504 PolarHBondContact O-N 3.39Å; V501-I505 HydrophobicContact CG1-CD1 3.94Å; V501-I505 HydrophobicContact CG1-CG1 4.5Å; V501-I505 WeakPolarHBondContact O-CG1 3.37Å; V501-I505 PolarHBondContact O-N 3.25Å; V501-L528 HydrophobicContact CG2-CD1 3.96Å; V501-L528 HydrophobicContact CG2-CD2 4.1Å
502	E	97.6	Very high	96.5	Very high	90 Å²	90	55.6 Å²	55.6	42%	0.421	29%	0.287	S	S	.	.	H	α-helix	trans	-60.2	-47.4	174.4	-177.7	176.1	-154.5	0	0	111.5	L464 T498 L504 I505 H506	L464-E502 HydrophobicContact CD1-CB 4.07Å; T498-E502 WeakPolarHBondContact O-CB 3.2Å; T498-E502 PolarHBondContact O-N 3Å; E502-L504 VanDerWaalsContact C-N 3.29Å; E502-L504 PolarHBondContact O-N 2.64Å; E502-I505 PolarHBondContact O-N 3.42Å; E502-H506 VanDerWaalsContact CG-CE1 3.41Å; E502-H506 WeakPolarHBondContact CG-CE1 3.07Å; E502-H506 VanDerWaalsContact CG-ND1 3.26Å; E502-H506 WeakPolarHBondContact CG-ND1 3.47Å; E502-H506 PolarHBondContact O-N 3.38Å; E502-H506 PolarHBondContact O-ND1 3.43Å; E502-H506 IonicContact OE1-CE1 2.84Å; E502-H506 PolarHBondContact OE1-CE1 3.02Å; E502-H506 IonicContact OE1-ND1 3.81Å
503	F	98.2	Very high	96.6	Very high	73 Å²	73	52.4 Å²	52.4	32%	0.32	27%	0.274	S	S	.	.	H	α-helix	trans	-56.6	-43.3	175.2	170.3	-101	0	0	0	111.7	D499 H506 S507 V512 L517 P518	D499-F503 WeakPolarHBondContact O-CB 3.25Å; D499-F503 PolarHBondContact O-N 3.01Å; F503-H506 PolarHBondContact O-N 2.67Å; F503-S507 VanDerWaalsContact O-CB 3.24Å; F503-S507 WeakPolarHBondContact O-CB 3.08Å; F503-S507 PolarHBondContact O-N 3.34Å; F503-S507 PolarHBondContact O-OG 3.09Å; F503-V512 HydrophobicContact CE1-CB 3.96Å; F503-V512 HydrophobicContact CE1-CG1 3.82Å; F503-V512 HydrophobicContact CE1-CG2 4.06Å; F503-V512 HydrophobicContact CZ-CB 4.4Å; F503-V512 HydrophobicContact CZ-CG1 3.93Å; F503-L517 HydrophobicContact CD1-CD2 4Å; F503-L517 HydrophobicContact CE1-CD2 4.36Å; F503-P518 HydrophobicContact CB-CG 3.86Å; F503-P518 HydrophobicContact CG-CG 4.29Å
504	L	98	Very high	96.7	Very high	3 Å²	3	52.1 Å²	52.1	2%	0.016	27%	0.273	C	S	.	.	H	α-helix	trans	-67.1	-41.7	179.2	-173.7	64.6	0	0	0	112.4	I454 L456 A500 V501 E502 S507 Y508 V512 L532 I538	I454-L504 HydrophobicContact CD1-CD1 4.25Å; I454-L504 HydrophobicContact CD1-CD2 4.4Å; I454-L504 HydrophobicContact CG1-CD1 4.34Å; L456-L504 HydrophobicContact CD2-CD2 4.13Å; L456-L504 HydrophobicContact CD2-CG 4.29Å; L456-L504 HydrophobicContact CG-CG 4.18Å; A500-L504 WeakPolarHBondContact O-CB 3.39Å; A500-L504 PolarHBondContact O-N 2.71Å; V501-L504 PolarHBondContact O-N 3.39Å; E502-L504 VanDerWaalsContact C-N 3.29Å; E502-L504 PolarHBondContact O-N 2.64Å; L504-S507 PolarHBondContact O-N 3.09Å; L504-Y508 PolarHBondContact O-N 3.28Å; L504-V512 HydrophobicContact CD1-CG2 3.59Å; L504-L532 HydrophobicContact CD2-CD1 3.85Å; L504-I538 HydrophobicContact CD2-CG2 3.54Å
505	I	97.8	Very high	96.9	Very high	44 Å²	44	49 Å²	49	23%	0.226	27%	0.265	C	S	.	.	H	α-helix	trans	-59.6	-47.2	174.9	-70.6	164.2	0	0	0	110.8	L456 L464 L473 V501 E502 S507 Y508	L456-I505 HydrophobicContact CD1-CB 4.25Å; L456-I505 HydrophobicContact CD1-CG1 3.89Å; L464-I505 HydrophobicContact CD1-CD1 4.24Å; L464-I505 HydrophobicContact CG-CD1 3.95Å; L473-I505 HydrophobicContact CD1-CD1 4.47Å; V501-I505 HydrophobicContact CG1-CD1 3.94Å; V501-I505 HydrophobicContact CG1-CG1 4.5Å; V501-I505 WeakPolarHBondContact O-CG1 3.37Å; V501-I505 PolarHBondContact O-N 3.25Å; E502-I505 PolarHBondContact O-N 3.42Å; I505-S507 VanDerWaalsContact C-N 3.32Å; I505-S507 PolarHBondContact O-N 3.38Å; I505-Y508 WeakPolarHBondContact O-CB 3.09Å; I505-Y508 PolarHBondContact O-N 3.46Å
506	H	97.8	Very high	97.2	Very high	135 Å²	135	48.7 Å²	48.7	63%	0.625	26%	0.255	S	S	*	.	H	α-helix	trans	-74.5	-20.6	-179.1	-69.3	119.2	0	0	0	114	E502 F503 Y508	E502-H506 VanDerWaalsContact CG-CE1 3.41Å; E502-H506 WeakPolarHBondContact CG-CE1 3.07Å; E502-H506 VanDerWaalsContact CG-ND1 3.26Å; E502-H506 WeakPolarHBondContact CG-ND1 3.47Å; E502-H506 PolarHBondContact O-N 3.38Å; E502-H506 PolarHBondContact O-ND1 3.43Å; E502-H506 IonicContact OE1-CE1 2.84Å; E502-H506 PolarHBondContact OE1-CE1 3.02Å; E502-H506 IonicContact OE1-ND1 3.81Å; F503-H506 PolarHBondContact O-N 2.67Å; H506-Y508 VanDerWaalsContact C-N 3.35Å
507	S	98.1	Very high	97.6	Very high	19 Å²	19	43.7 Å²	43.7	13%	0.133	23%	0.232	C	C	.	.	H	α-helix	trans	-78.6	-18.2	177.5	-65.4	0	0	0	0	113.4	F503 L504 I505 N510	F503-S507 VanDerWaalsContact O-CB 3.24Å; F503-S507 WeakPolarHBondContact O-CB 3.08Å; F503-S507 PolarHBondContact O-N 3.34Å; F503-S507 PolarHBondContact O-OG 3.09Å; L504-S507 PolarHBondContact O-N 3.09Å; I505-S507 VanDerWaalsContact C-N 3.32Å; I505-S507 PolarHBondContact O-N 3.38Å; S507-N510 WeakPolarHBondContact O-CB 3.5Å; S507-N510 PolarHBondContact O-N 3.16Å; S507-N510 PolarHBondContact O-ND2 2.63Å
508	Y	98.2	Very high	97.7	Very high	25 Å²	25	45.1 Å²	45.1	10%	0.098	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	132.1	177	-174.2	-92	0	0	0	111.5	N103 S104 K455 L456 G459 L504 I505 H506	N103-Y508 WeakPolarHBondContact OD1-CE1 3.31Å; S104-Y508 VanDerWaalsContact CB-OH 3.32Å; S104-Y508 WeakPolarHBondContact CB-OH 3.12Å; S104-Y508 PolarHBondContact N-OH 3.38Å; S104-Y508 PolarHBondContact OG-OH 2.85Å; K455-Y508 HydrophobicContact CD-CD2 4.31Å; K455-Y508 HydrophobicContact CD-CE2 4.29Å; K455-Y508 HydrophobicContact CG-CD2 4.05Å; K455-Y508 HydrophobicContact CG-CE2 4.4Å; L456-Y508 HydrophobicContact CB-CD2 3.86Å; L456-Y508 WeakPolarHBondContact O-CE2 3.3Å; G459-Y508 VanDerWaalsContact CA-CE1 3.45Å; G459-Y508 VanDerWaalsContact N-CZ 3.29Å; L504-Y508 PolarHBondContact O-N 3.28Å; I505-Y508 WeakPolarHBondContact O-CB 3.09Å; I505-Y508 PolarHBondContact O-N 3.46Å; H506-Y508 VanDerWaalsContact C-N 3.35Å
509	P	97.6	Very high	97.7	Very high	30 Å²	30	44.3 Å²	44.3	20%	0.195	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	cis	-99	20.8	15.3	41	-39.2	0	0	0	114.6	N102 N103 K455	N102-P509 PolarHBondContact ND2-O 3.35Å; N102-P509 VanDerWaalsContact ND2-O 3.1Å; N103-P509 HydrophobicContact CB-CB 3.87Å; N103-P509 HydrophobicContact CB-CG 3.95Å; K455-P509 WeakPolarHBondContact CD-O 3.17Å
510	N	98.1	Very high	97.6	Very high	105 Å²	105	46.3 Å²	46.3	56%	0.561	25%	0.25	S	C	*	.	S	Bend	trans	-86.5	144.8	-177.5	-55.8	-58.2	0	0	0	111.1	S507	S507-N510 WeakPolarHBondContact O-CB 3.5Å; S507-N510 PolarHBondContact O-N 3.16Å; S507-N510 PolarHBondContact O-ND2 2.63Å
511	F	98.3	Very high	97.4	Very high	73 Å²	73	52.6 Å²	52.6	32%	0.32	28%	0.277	S	S	.	.			trans	-70.8	139.2	165	-77.1	-81.6	0	0	0	110.1	K453 I454 K455 H539 T540 S541	K453-F511 HydrophobicContact CB-CB 4.21Å; K453-F511 HydrophobicContact CB-CD1 4.27Å; I454-F511 WeakPolarHBondContact O-CA 3.38Å; K455-F511 HydrophobicContact CB-CD1 3.58Å; K455-F511 HydrophobicContact CB-CE1 3.63Å; K455-F511 HydrophobicContact CB-CG 4.09Å; K455-F511 HydrophobicContact CB-CZ 4.23Å; K455-F511 HydrophobicContact CD-CD2 4.43Å; K455-F511 HydrophobicContact CD-CE2 4.33Å; K455-F511 HydrophobicContact CD-CZ 4.44Å; F511-H539 AromaticContact CZ-CE1 3.71Å; F511-H539 AromaticContact CZ-NE2 3.96Å; F511-T540 VanDerWaalsContact CE1-C 3.44Å; F511-S541 VanDerWaalsContact CE1-CA 3.49Å; F511-S541 VanDerWaalsContact CE1-N 3.32Å
512	V	98.3	Very high	97.3	Very high	15 Å²	15	57.3 Å²	57.3	9%	0.091	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	150.3	171.4	-60.8	0	0	0	0	109.4	K453 I454 F503 L504	K453-V512 CarbonylContact C-O 3.53Å; K453-V512 VanDerWaalsContact CA-O 3.31Å; K453-V512 WeakPolarHBondContact CA-O 3.3Å; I454-V512 HydrophobicContact CG1-CG2 4.04Å; I454-V512 PolarHBondContact N-O 3.4Å; I454-V512 PolarHBondContact O-N 2.83Å; F503-V512 HydrophobicContact CE1-CB 3.96Å; F503-V512 HydrophobicContact CE1-CG1 3.82Å; F503-V512 HydrophobicContact CE1-CG2 4.06Å; F503-V512 HydrophobicContact CZ-CB 4.4Å; F503-V512 HydrophobicContact CZ-CG1 3.93Å; L504-V512 HydrophobicContact CD1-CG2 3.59Å
513	T	98.4	Very high	97.1	Very high	35 Å²	35	59.6 Å²	59.6	22%	0.215	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	135.7	178	-64.5	0	0	0	0	109.2	T450 G515 T516	T450-T513 WeakPolarHBondContact O-CG2 3.5Å; T513-G515 PolarHBondContact O-N 2.88Å; T513-G515 VanDerWaalsContact O-N 3.11Å; T513-T516 PolarHBondContact O-N 3.42Å; T513-T516 PolarHBondContact O-OG1 2.93Å
514	V	98.1	Very high	96.9	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-53.2	-38.4	-178.4	168.9	0	0	0	0	112.1	I448 T449 T452 I454 T516 L517 K525 I526 A529	I448-V514 HydrophobicContact CG2-CG2 3.79Å; T449-V514 WeakPolarHBondContact O-CB 3.41Å; T452-V514 WeakPolarHBondContact O-CG2 3.39Å; T452-V514 PolarHBondContact O-N 3.17Å; I454-V514 HydrophobicContact CD1-CG2 3.96Å; I454-V514 HydrophobicContact CG1-CG2 4.03Å; I454-V514 HydrophobicContact CG2-CG2 3.89Å; V514-T516 PolarHBondContact O-N 3.24Å; V514-T516 VanDerWaalsContact O-N 3.1Å; V514-L517 HydrophobicContact CG1-CD1 4.41Å; V514-L517 WeakPolarHBondContact O-CB 3.38Å; V514-L517 WeakPolarHBondContact O-CG 3.5Å; V514-L517 PolarHBondContact O-N 2.96Å; V514-L517 VanDerWaalsContact O-N 3.09Å; V514-K525 HydrophobicContact CG1-CB 4.03Å; V514-I526 HydrophobicContact CG1-CG1 4.23Å; V514-A529 HydrophobicContact CG1-CB 4.21Å; V514-A529 HydrophobicContact CG2-CB 3.82Å
515	G	97.4	Very high	96.8	Very high	28 Å²	28	59.3 Å²	59.3	29%	0.289	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-60.2	-20.5	176.7	0	0	0	0	0	115	T450 T513 K525	T450-G515 WeakPolarHBondContact O-CA 3.47Å; T450-G515 PolarHBondContact O-N 3.11Å; T513-G515 PolarHBondContact O-N 2.88Å; T513-G515 VanDerWaalsContact O-N 3.11Å; G515-K525 PolarHBondContact O-NZ 3.48Å
516	T	97.5	Very high	96.7	Very high	78 Å²	78	59.1 Å²	59.1	48%	0.479	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-90.1	-4.5	178.5	69.4	0	0	0	0	113.6	T513 V514	T513-T516 PolarHBondContact O-N 3.42Å; T513-T516 PolarHBondContact O-OG1 2.93Å; V514-T516 PolarHBondContact O-N 3.24Å; V514-T516 VanDerWaalsContact O-N 3.1Å
517	L	97.8	Very high	96.6	Very high	3 Å²	3	55 Å²	55	2%	0.016	30%	0.3	C	S	.	.	S	Bend	trans	-59	133.3	175.2	-67.8	178	0	0	0	109.9	I454 A500 F503 V514 C519 K525	I454-L517 HydrophobicContact CD1-CD1 4.26Å; A500-L517 HydrophobicContact CB-CB 4.22Å; F503-L517 HydrophobicContact CD1-CD2 4Å; F503-L517 HydrophobicContact CE1-CD2 4.36Å; V514-L517 HydrophobicContact CG1-CD1 4.41Å; V514-L517 WeakPolarHBondContact O-CB 3.38Å; V514-L517 WeakPolarHBondContact O-CG 3.5Å; V514-L517 PolarHBondContact O-N 2.96Å; V514-L517 VanDerWaalsContact O-N 3.09Å; L517-C519 PolarHBondContact O-N 2.92Å; L517-K525 HydrophobicContact CB-CB 4.27Å; L517-K525 HydrophobicContact CB-CD 4.25Å; L517-K525 HydrophobicContact CB-CG 4.04Å; L517-K525 HydrophobicContact CD1-CB 4.34Å; L517-K525 WeakPolarHBondContact O-CD 3.49Å; L517-K525 WeakPolarHBondContact O-CE 3.02Å; L517-K525 PolarHBondContact O-NZ 3.32Å
518	P	97.1	Very high	96.5	Very high	58 Å²	58	54.1 Å²	54.1	38%	0.377	30%	0.295	S	S	.	.	S	Bend	trans	-75.2	72.4	178.3	32.2	-37.4	0	0	0	111.1	D499 A500 F503	D499-P518 HydrophobicContact CB-CG 4.18Å; D499-P518 WeakPolarHBondContact O-CG 3.35Å; A500-P518 HydrophobicContact CB-CG 4.13Å; F503-P518 HydrophobicContact CB-CG 3.86Å; F503-P518 HydrophobicContact CG-CG 4.29Å
519	C	95.7	Very high	96.5	Very high	11 Å²	11	53 Å²	53	7%	0.074	29%	0.29	C	S	.	.			trans	-119.4	153.7	166.1	-48.9	0	0	0	0	109.3	A500 L517 D524 K525	A500-C519 WeakPolarHBondContact CB-SG 3.45Å; L517-C519 PolarHBondContact O-N 2.92Å; C519-D524 HydrophobicContact CB-CB 3.97Å; C519-K525 HydrophobicContact CB-CG 3.67Å; C519-K525 WeakPolarHBondContact O-CE 3.13Å
520	D	93	Very high	96.4	Very high	145 Å²	145	54.9 Å²	54.9	78%	0.775	30%	0.296	S	S	*	.	S	Bend	trans	-68.8	-41.9	-177.3	-70.2	-28	0	0	0	112.5
521	F	95	Very high	96.2	Very high	132 Å²	132	52.9 Å²	52.9	58%	0.579	29%	0.285	S	S	*	.	S	Bend	trans	-111	150.2	-177.9	-54.2	-78.1	0	0	0	112.6	Q523 D524 K525	F521-Q523 VanDerWaalsContact C-N 3.27Å; F521-Q523 PolarHBondContact O-N 3.34Å; F521-D524 WeakPolarHBondContact CB-OD2 3.44Å; F521-D524 VanDerWaalsContact CD2-OD2 3.3Å; F521-D524 WeakPolarHBondContact CD2-OD2 3.49Å; F521-D524 PolarHBondContact O-N 3.21Å; F521-K525 PolarHBondContact O-N 2.86Å
522	I	94.4	Very high	96.2	Very high	102 Å²	102	49.6 Å²	49.6	52%	0.523	27%	0.271	S	S	.	.	H	α-helix	trans	-62.3	-38.4	178.7	-71.7	172.7	0	0	0	111	T450 D524 K525 I526	T450-I522 HydrophobicContact CG2-CG2 3.54Å; I522-D524 VanDerWaalsContact C-N 3.32Å; I522-D524 PolarHBondContact O-N 3.04Å; I522-K525 PolarHBondContact O-N 2.85Å; I522-I526 HydrophobicContact CG2-CD1 4.05Å; I522-I526 PolarHBondContact O-N 2.99Å
523	Q	93.8	Very high	96.1	Very high	137 Å²	137	49.3 Å²	49.3	64%	0.64	27%	0.269	S	S	*	.	H	α-helix	trans	-60.5	-42.5	-179.9	-72.3	75.9	2.9	0	0	111.2	F521 K525 I526 A527	F521-Q523 VanDerWaalsContact C-N 3.27Å; F521-Q523 PolarHBondContact O-N 3.34Å; Q523-K525 VanDerWaalsContact C-N 3.35Å; Q523-K525 PolarHBondContact O-N 3.42Å; Q523-I526 PolarHBondContact O-N 3.11Å; Q523-A527 WeakPolarHBondContact O-CB 3.44Å; Q523-A527 PolarHBondContact O-N 3.11Å
524	D	94.6	Very high	95.9	Very high	37 Å²	37	54.2 Å²	54.2	20%	0.198	29%	0.289	C	S	.	.	H	α-helix	trans	-64.5	-40.3	179.7	-55.5	-18.5	0	0	0	111.6	C519 F521 I522 I526 A527 L528	C519-D524 HydrophobicContact CB-CB 3.97Å; F521-D524 WeakPolarHBondContact CB-OD2 3.44Å; F521-D524 VanDerWaalsContact CD2-OD2 3.3Å; F521-D524 WeakPolarHBondContact CD2-OD2 3.49Å; F521-D524 PolarHBondContact O-N 3.21Å; I522-D524 VanDerWaalsContact C-N 3.32Å; I522-D524 PolarHBondContact O-N 3.04Å; D524-I526 VanDerWaalsContact C-N 3.32Å; D524-I526 PolarHBondContact O-N 3.14Å; D524-A527 PolarHBondContact O-N 3.21Å; D524-L528 VanDerWaalsContact O-CB 3.23Å; D524-L528 WeakPolarHBondContact O-CB 3.37Å; D524-L528 PolarHBondContact O-N 3.29Å
525	K	96.7	Very high	95.8	Very high	33 Å²	33	57.8 Å²	57.8	14%	0.143	30%	0.304	C	S	.	.	H	α-helix	trans	-59.6	-44.6	176.1	-57.4	-176.4	-166.3	-146.4	0	111.6	V514 G515 L517 C519 F521 I522 Q523 A529	V514-K525 HydrophobicContact CG1-CB 4.03Å; G515-K525 PolarHBondContact O-NZ 3.48Å; L517-K525 HydrophobicContact CB-CB 4.27Å; L517-K525 HydrophobicContact CB-CD 4.25Å; L517-K525 HydrophobicContact CB-CG 4.04Å; L517-K525 HydrophobicContact CD1-CB 4.34Å; L517-K525 WeakPolarHBondContact O-CD 3.49Å; L517-K525 WeakPolarHBondContact O-CE 3.02Å; L517-K525 PolarHBondContact O-NZ 3.32Å; C519-K525 HydrophobicContact CB-CG 3.67Å; C519-K525 WeakPolarHBondContact O-CE 3.13Å; F521-K525 PolarHBondContact O-N 2.86Å; I522-K525 PolarHBondContact O-N 2.85Å; Q523-K525 VanDerWaalsContact C-N 3.35Å; Q523-K525 PolarHBondContact O-N 3.42Å; K525-A529 WeakPolarHBondContact O-CB 3.45Å; K525-A529 PolarHBondContact O-N 3.36Å; K525-A529 VanDerWaalsContact O-N 3.16Å
526	I	95.6	Very high	95.8	Very high	40 Å²	40	56.8 Å²	56.8	21%	0.205	29%	0.294	C	S	.	.	H	α-helix	trans	-68.9	-49.9	179.7	-65.6	171.8	0	0	0	109.7	I448 T450 V514 I522 Q523 D524 L528 A529 E530	I448-I526 WeakPolarHBondContact O-CG2 3.31Å; T450-I526 HydrophobicContact CG2-CD1 4.17Å; T450-I526 HydrophobicContact CG2-CG1 4.37Å; V514-I526 HydrophobicContact CG1-CG1 4.23Å; I522-I526 HydrophobicContact CG2-CD1 4.05Å; I522-I526 PolarHBondContact O-N 2.99Å; Q523-I526 PolarHBondContact O-N 3.11Å; D524-I526 VanDerWaalsContact C-N 3.32Å; D524-I526 PolarHBondContact O-N 3.14Å; I526-L528 VanDerWaalsContact C-N 3.33Å; I526-L528 PolarHBondContact O-N 3.25Å; I526-A529 PolarHBondContact O-N 3.17Å; I526-A529 VanDerWaalsContact O-N 3.1Å; I526-E530 HydrophobicContact CG2-CG 4.25Å; I526-E530 WeakPolarHBondContact O-CG 3.5Å; I526-E530 PolarHBondContact O-N 3.18Å
527	A	94.7	Very high	95.8	Very high	48 Å²	48	53 Å²	53	40%	0.397	27%	0.271	S	S	.	.	H	α-helix	trans	-60.2	-41.2	-178.9	0	0	0	0	0	112.4	Q523 D524 E530 L531	Q523-A527 WeakPolarHBondContact O-CB 3.44Å; Q523-A527 PolarHBondContact O-N 3.11Å; D524-A527 PolarHBondContact O-N 3.21Å; A527-E530 PolarHBondContact O-N 3.28Å; A527-L531 WeakPolarHBondContact O-CB 3.47Å; A527-L531 PolarHBondContact O-N 3.04Å
528	L	96.4	Very high	95.8	Very high	2 Å²	2	52.9 Å²	52.9	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-63.5	-44.7	174.5	178.6	61.2	0	0	0	111.4	H497 A500 V501 D524 I526 L531 L532	H497-L528 HydrophobicContact CB-CD1 4.13Å; H497-L528 HydrophobicContact CB-CD2 4.06Å; A500-L528 HydrophobicContact CB-CD2 3.53Å; V501-L528 HydrophobicContact CG2-CD1 3.96Å; V501-L528 HydrophobicContact CG2-CD2 4.1Å; D524-L528 VanDerWaalsContact O-CB 3.23Å; D524-L528 WeakPolarHBondContact O-CB 3.37Å; D524-L528 PolarHBondContact O-N 3.29Å; I526-L528 VanDerWaalsContact C-N 3.33Å; I526-L528 PolarHBondContact O-N 3.25Å; L528-L531 PolarHBondContact O-N 3.44Å; L528-L532 HydrophobicContact CD1-CD1 4.09Å; L528-L532 HydrophobicContact CD1-CG 4.14Å; L528-L532 HydrophobicContact CG-CD1 4.1Å; L528-L532 WeakPolarHBondContact O-CB 3.49Å; L528-L532 VanDerWaalsContact O-CG 3.26Å; L528-L532 WeakPolarHBondContact O-CG 3.46Å; L528-L532 PolarHBondContact O-N 3.5Å
529	A	97.3	Very high	95.8	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-63.9	-41.6	177.9	0	0	0	0	0	111.9	I448 I454 V514 K525 I526 L532 F533 I538	I448-A529 HydrophobicContact CD1-CB 4.47Å; I448-A529 HydrophobicContact CG2-CB 3.85Å; I454-A529 HydrophobicContact CD1-CB 4.1Å; V514-A529 HydrophobicContact CG1-CB 4.21Å; V514-A529 HydrophobicContact CG2-CB 3.82Å; K525-A529 WeakPolarHBondContact O-CB 3.45Å; K525-A529 PolarHBondContact O-N 3.36Å; K525-A529 VanDerWaalsContact O-N 3.16Å; I526-A529 PolarHBondContact O-N 3.17Å; I526-A529 VanDerWaalsContact O-N 3.1Å; A529-L532 PolarHBondContact O-N 3.42Å; A529-F533 VanDerWaalsContact O-CB 3.27Å; A529-F533 WeakPolarHBondContact O-CB 3.48Å; A529-F533 PolarHBondContact O-N 3.2Å; A529-I538 HydrophobicContact CB-CD1 4.45Å; A529-I538 VanDerWaalsContact O-CD1 3.27Å; A529-I538 WeakPolarHBondContact O-CD1 3.45Å
530	E	95.3	Very high	95.9	Very high	70 Å²	70	50.1 Å²	50.1	33%	0.327	25%	0.252	S	S	.	.	H	α-helix	trans	-60.5	-49.9	173.9	-71.9	174.9	161	0	0	111.4	I448 I526 A527 L532 F533 E534	I448-E530 HydrophobicContact CB-CG 4.05Å; I448-E530 HydrophobicContact CD1-CG 4.16Å; I448-E530 HydrophobicContact CG1-CG 4.45Å; I526-E530 HydrophobicContact CG2-CG 4.25Å; I526-E530 WeakPolarHBondContact O-CG 3.5Å; I526-E530 PolarHBondContact O-N 3.18Å; A527-E530 PolarHBondContact O-N 3.28Å; E530-L532 PolarHBondContact O-N 3.22Å; E530-F533 PolarHBondContact O-N 3.49Å; E530-F533 VanDerWaalsContact O-N 3.13Å; E530-E534 WeakPolarHBondContact O-CB 3.32Å; E530-E534 WeakPolarHBondContact O-CG 3.42Å; E530-E534 PolarHBondContact O-N 3.33Å
531	L	95.9	Very high	96.1	Very high	63 Å²	63	45.8 Å²	45.8	33%	0.33	23%	0.232	S	C	.	.	H	α-helix	trans	-56.4	-48.3	177.6	174.8	62	0	0	0	112	F491 A527 L528 F533 K535	F491-L531 HydrophobicContact CD2-CD2 4.42Å; F491-L531 HydrophobicContact CE2-CD2 3.74Å; F491-L531 HydrophobicContact CE2-CG 4.23Å; F491-L531 HydrophobicContact CZ-CD2 4.39Å; F491-L531 HydrophobicContact CZ-CG 4.42Å; A527-L531 WeakPolarHBondContact O-CB 3.47Å; A527-L531 PolarHBondContact O-N 3.04Å; L528-L531 PolarHBondContact O-N 3.44Å; L531-F533 VanDerWaalsContact C-N 3.32Å; L531-F533 PolarHBondContact O-N 3.43Å; L531-K535 HydrophobicContact CD1-CG 4.38Å; L531-K535 WeakPolarHBondContact O-CB 3.38Å; L531-K535 VanDerWaalsContact O-CG 3.25Å; L531-K535 WeakPolarHBondContact O-CG 3.36Å; L531-K535 PolarHBondContact O-N 3.15Å; L531-K535 VanDerWaalsContact O-N 3.08Å
532	L	97.4	Very high	96	Very high	4 Å²	4	46.2 Å²	46.2	2%	0.021	24%	0.236	C	C	.	.	H	α-helix	trans	-66.7	-35	179.6	-67.5	176.1	0	0	0	111.9	L473 F491 L504 L528 A529 E530 G536 I537 I538	L473-L532 HydrophobicContact CD2-CD2 3.59Å; F491-L532 HydrophobicContact CZ-CD2 4.14Å; L504-L532 HydrophobicContact CD2-CD1 3.85Å; L528-L532 HydrophobicContact CD1-CD1 4.09Å; L528-L532 HydrophobicContact CD1-CG 4.14Å; L528-L532 HydrophobicContact CG-CD1 4.1Å; L528-L532 WeakPolarHBondContact O-CB 3.49Å; L528-L532 VanDerWaalsContact O-CG 3.26Å; L528-L532 WeakPolarHBondContact O-CG 3.46Å; L528-L532 PolarHBondContact O-N 3.5Å; A529-L532 PolarHBondContact O-N 3.42Å; E530-L532 PolarHBondContact O-N 3.22Å; L532-G536 PolarHBondContact O-N 3.24Å; L532-I537 HydrophobicContact CD2-CB 4.38Å; L532-I537 HydrophobicContact CD2-CD1 4.14Å; L532-I537 HydrophobicContact CD2-CG2 4.23Å; L532-I537 PolarHBondContact O-N 3.03Å; L532-I538 HydrophobicContact CB-CB 4.49Å; L532-I538 HydrophobicContact CB-CD1 3.89Å; L532-I538 HydrophobicContact CB-CG1 3.86Å; L532-I538 HydrophobicContact CB-CG2 3.89Å; L532-I538 HydrophobicContact CD1-CG2 4.23Å; L532-I538 PolarHBondContact O-N 2.8Å
533	F	96.5	Very high	95.9	Very high	10 Å²	10	45.2 Å²	45.2	4%	0.044	24%	0.236	C	C	.	.	H	α-helix	trans	-68.4	-48	177.6	-179.4	-93.3	0	0	0	110.7	S428 V429 V446 I448 A529 E530 L531 K535 G536 I538 T540 L544	S428-F533 VanDerWaalsContact C-CZ 3.48Å; V429-F533 HydrophobicContact CB-CD1 4.15Å; V429-F533 HydrophobicContact CB-CE1 3.85Å; V429-F533 HydrophobicContact CB-CZ 4.25Å; V429-F533 VanDerWaalsContact CB-O 3.26Å; V429-F533 WeakPolarHBondContact CB-O 3.32Å; V429-F533 WeakPolarHBondContact CG1-O 3.4Å; V429-F533 HydrophobicContact CG2-CE1 4.22Å; V429-F533 VanDerWaalsContact N-CZ 3.35Å; V446-F533 HydrophobicContact CG1-CE1 4.03Å; V446-F533 HydrophobicContact CG1-CZ 4.49Å; I448-F533 HydrophobicContact CD1-CB 3.77Å; I448-F533 HydrophobicContact CD1-CD2 4.48Å; I448-F533 HydrophobicContact CD1-CG 4.04Å; A529-F533 VanDerWaalsContact O-CB 3.27Å; A529-F533 WeakPolarHBondContact O-CB 3.48Å; A529-F533 PolarHBondContact O-N 3.2Å; E530-F533 PolarHBondContact O-N 3.49Å; E530-F533 VanDerWaalsContact O-N 3.13Å; L531-F533 VanDerWaalsContact C-N 3.32Å; L531-F533 PolarHBondContact O-N 3.43Å; F533-K535 PolarHBondContact O-N 3.41Å; F533-G536 WeakPolarHBondContact O-CA 3.24Å; F533-G536 PolarHBondContact O-N 3.35Å; F533-I538 HydrophobicContact CB-CD1 4.12Å; F533-I538 HydrophobicContact CB-CG1 3.92Å; F533-T540 HydrophobicContact CE2-CG2 4.45Å; F533-L544 HydrophobicContact CD1-CD1 4.48Å; F533-L544 HydrophobicContact CD2-CD1 4.14Å; F533-L544 HydrophobicContact CE1-CD1 4.01Å; F533-L544 HydrophobicContact CE2-CD1 3.62Å; F533-L544 HydrophobicContact CZ-CD1 3.56Å
534	E	94.4	Very high	95.6	Very high	138 Å²	138	39.9 Å²	39.9	65%	0.645	21%	0.212	S	C	*	.	H	α-helix	trans	-58.5	-36.3	176.7	-73.5	179.6	177.9	0	0	112.4	E530 G536	E530-E534 WeakPolarHBondContact O-CB 3.32Å; E530-E534 WeakPolarHBondContact O-CG 3.42Å; E530-E534 PolarHBondContact O-N 3.33Å; E534-G536 PolarHBondContact O-N 2.98Å
535	K	96.1	Very high	94.7	Very high	74 Å²	74	46.1 Å²	46.1	32%	0.322	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-3.9	172.9	-68.1	-67.4	-178.2	-171.3	0	113.9	V477 F491 L531 F533 I537	V477-K535 WeakPolarHBondContact CG2-O 3.47Å; F491-K535 HydrophobicContact CE1-CD 4.44Å; F491-K535 HydrophobicContact CE1-CG 4.02Å; F491-K535 HydrophobicContact CZ-CG 4.43Å; L531-K535 HydrophobicContact CD1-CG 4.38Å; L531-K535 WeakPolarHBondContact O-CB 3.38Å; L531-K535 VanDerWaalsContact O-CG 3.25Å; L531-K535 WeakPolarHBondContact O-CG 3.36Å; L531-K535 PolarHBondContact O-N 3.15Å; L531-K535 VanDerWaalsContact O-N 3.08Å; F533-K535 PolarHBondContact O-N 3.41Å; K535-I537 HydrophobicContact CB-CD1 3.75Å; K535-I537 HydrophobicContact CB-CG1 3.91Å; K535-I537 PolarHBondContact O-N 3.3Å
536	G	96.6	Very high	93.3	Very high	7 Å²	7	46 Å²	46	7%	0.072	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	68	15	-176.9	0	0	0	0	0	114.1	L457 L532 F533 E534	L457-G536 WeakPolarHBondContact CD2-O 3.46Å; L532-G536 PolarHBondContact O-N 3.24Å; F533-G536 WeakPolarHBondContact O-CA 3.24Å; F533-G536 PolarHBondContact O-N 3.35Å; E534-G536 PolarHBondContact O-N 2.98Å
537	I	98.1	Very high	91.7	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.25	C	S	.	.	S	Bend	trans	-78.8	-27.2	-177.2	-66.2	170.6	0	0	0	111.1	L456 L457 A462 L473 Y475 V477 F491 L532 K535	L456-I537 HydrophobicContact CD2-CG2 3.8Å; L457-I537 WeakPolarHBondContact CB-O 3.48Å; L457-I537 PolarHBondContact N-O 3.42Å; A462-I537 HydrophobicContact CB-CG2 3.75Å; L473-I537 HydrophobicContact CD2-CD1 3.81Å; Y475-I537 HydrophobicContact CD1-CD1 3.94Å; Y475-I537 HydrophobicContact CD2-CD1 4.4Å; Y475-I537 HydrophobicContact CD2-CG1 4.43Å; Y475-I537 HydrophobicContact CG-CD1 3.84Å; Y475-I537 HydrophobicContact CG-CG1 4.18Å; V477-I537 HydrophobicContact CG2-CG1 4.35Å; F491-I537 HydrophobicContact CE1-CD1 3.8Å; F491-I537 HydrophobicContact CZ-CD1 4.18Å; L532-I537 HydrophobicContact CD2-CB 4.38Å; L532-I537 HydrophobicContact CD2-CD1 4.14Å; L532-I537 HydrophobicContact CD2-CG2 4.23Å; L532-I537 PolarHBondContact O-N 3.03Å; K535-I537 HydrophobicContact CB-CD1 3.75Å; K535-I537 HydrophobicContact CB-CG1 3.91Å; K535-I537 PolarHBondContact O-N 3.3Å
538	I	98.1	Very high	90	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	165	177.3	67.3	170.3	0	0	0	110.9	I454 K455 L456 L504 A529 L532 F533	I454-I538 HydrophobicContact CB-CD1 4Å; I454-I538 HydrophobicContact CD1-CD1 3.93Å; I454-I538 HydrophobicContact CG2-CD1 3.89Å; K455-I538 CarbonylContact O-C 3.54Å; K455-I538 WeakPolarHBondContact O-CA 3.41Å; K455-I538 VanDerWaalsContact O-CB 3.31Å; K455-I538 WeakPolarHBondContact O-CB 3.37Å; L456-I538 HydrophobicContact CD2-CG2 4.12Å; L504-I538 HydrophobicContact CD2-CG2 3.54Å; A529-I538 HydrophobicContact CB-CD1 4.45Å; A529-I538 VanDerWaalsContact O-CD1 3.27Å; A529-I538 WeakPolarHBondContact O-CD1 3.45Å; L532-I538 HydrophobicContact CB-CB 4.49Å; L532-I538 HydrophobicContact CB-CD1 3.89Å; L532-I538 HydrophobicContact CB-CG1 3.86Å; L532-I538 HydrophobicContact CB-CG2 3.89Å; L532-I538 HydrophobicContact CD1-CG2 4.23Å; L532-I538 PolarHBondContact O-N 2.8Å; F533-I538 HydrophobicContact CB-CD1 4.12Å; F533-I538 HydrophobicContact CB-CG1 3.92Å
539	H	97.2	Very high	88.1	Confident	9 Å²	9	54 Å²	54	4%	0.042	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	163.3	169.5	80.3	115.8	0	0	0	110.1	T427 I454 K455 L457 F511	T427-H539 WeakPolarHBondContact O-CA 3.39Å; T427-H539 WeakPolarHBondContact O-CB 3.43Å; T427-H539 PolarHBondContact OG1-ND1 3.31Å; I454-H539 WeakPolarHBondContact CA-O 3.49Å; K455-H539 WeakPolarHBondContact CE-NE2 3.22Å; K455-H539 PolarHBondContact N-O 3.44Å; K455-H539 PolarHBondContact NZ-NE2 2.68Å; K455-H539 PolarHBondContact O-N 3.21Å; L457-H539 HydrophobicContact CD1-CB 4.01Å; F511-H539 AromaticContact CZ-CE1 3.71Å; F511-H539 AromaticContact CZ-NE2 3.96Å
540	T	97.1	Very high	86	Confident	2 Å²	2	60.8 Å²	60.8	1%	0.012	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	164.5	-177.1	48.9	0	0	0	0	112.8	T427 T452 K453 I454 F511 F533 E542 L544	T427-T540 VanDerWaalsContact CB-O 3.25Å; T427-T540 WeakPolarHBondContact CB-O 3.2Å; T427-T540 PolarHBondContact O-N 2.93Å; T427-T540 PolarHBondContact O-OG1 3.37Å; T452-T540 HydrophobicContact CG2-CG2 3.58Å; K453-T540 CarbonylContact O-C 3.54Å; K453-T540 VanDerWaalsContact O-CA 3.27Å; K453-T540 WeakPolarHBondContact O-CA 3.46Å; I454-T540 HydrophobicContact CG2-CG2 4.13Å; F511-T540 VanDerWaalsContact CE1-C 3.44Å; F533-T540 HydrophobicContact CE2-CG2 4.45Å; T540-E542 VanDerWaalsContact CB-O 3.32Å; T540-E542 WeakPolarHBondContact CB-O 3.34Å; T540-E542 PolarHBondContact O-N 3.45Å; T540-E542 PolarHBondContact OG1-O 3.4Å; T540-L544 HydrophobicContact CG2-CD1 3.74Å; T540-L544 HydrophobicContact CG2-CD2 4.01Å; T540-L544 HydrophobicContact CG2-CG 3.94Å
541	S	96.1	Very high	83.4	Confident	53 Å²	53	65.8 Å²	65.8	37%	0.371	37%	0.368	S	S	.	.	S	Bend	trans	-70.1	-24.8	176	63.2	0	0	0	0	113.3	K453 F511	K453-S541 PolarHBondContact O-N 3.29Å; F511-S541 VanDerWaalsContact CE1-CA 3.49Å; F511-S541 VanDerWaalsContact CE1-N 3.32Å
542	E	93.7	Very high	80.8	Confident	142 Å²	142	68.2 Å²	68.2	66%	0.664	39%	0.39	S	S	*	.	S	Bend	trans	-137.5	149.2	-179.9	-65.3	176	-174.6	0	0	108.5	T540 L544	T540-E542 VanDerWaalsContact CB-O 3.32Å; T540-E542 WeakPolarHBondContact CB-O 3.34Å; T540-E542 PolarHBondContact O-N 3.45Å; T540-E542 PolarHBondContact OG1-O 3.4Å; E542-L544 PolarHBondContact O-N 3.4Å
543	P	92	Very high	77.9	Confident	80 Å²	80	80.6 Å²	80.6	52%	0.519	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-55.8	136.1	175.9	-24.7	34.9	0	0	0	110.8	T427 E545	T427-P543 HydrophobicContact CG2-CG 4.11Å; P543-E545 PolarHBondContact O-N 3.12Å
544	L	86.9	Confident	76.9	Confident	26 Å²	26	84.1 Å²	84.1	14%	0.136	47%	0.468	C	S	.	.	P	Polyproline II helix	trans	-75.9	123.9	179.3	-68.1	165.9	0	0	0	110	V446 I448 T452 F533 T540 E542	V446-L544 HydrophobicContact CG1-CB 3.59Å; V446-L544 HydrophobicContact CG1-CD1 3.08Å; V446-L544 HydrophobicContact CG1-CD2 4.45Å; V446-L544 HydrophobicContact CG1-CG 3.83Å; V446-L544 HydrophobicContact CG2-CB 4.42Å; I448-L544 HydrophobicContact CD1-CD1 4.38Å; I448-L544 HydrophobicContact CG1-CD1 4Å; T452-L544 HydrophobicContact CG2-CD2 4.28Å; F533-L544 HydrophobicContact CD1-CD1 4.48Å; F533-L544 HydrophobicContact CD2-CD1 4.14Å; F533-L544 HydrophobicContact CE1-CD1 4.01Å; F533-L544 HydrophobicContact CE2-CD1 3.62Å; F533-L544 HydrophobicContact CZ-CD1 3.56Å; T540-L544 HydrophobicContact CG2-CD1 3.74Å; T540-L544 HydrophobicContact CG2-CD2 4.01Å; T540-L544 HydrophobicContact CG2-CG 3.94Å; E542-L544 PolarHBondContact O-N 3.4Å
545	E	77.1	Confident	76	Confident	167 Å²	167	81.3 Å²	81.3	78%	0.78	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-82.4	151.9	178.3	-62.4	-172.6	168.8	0	0	111.2	P543	P543-E545 PolarHBondContact O-N 3.12Å
546	A	66.8	Low	74.9	Confident	30 Å²	30	81.7 Å²	81.7	25%	0.248	47%	0.466	C	S	.	.	P	Polyproline II helix	trans	-65	146.4	170.8	0	0	0	0	0	109.8	N443	N443-A546 HydrophobicContact CB-CB 3.66Å; N443-A546 VanDerWaalsContact OD1-CB 3.23Å; N443-A546 WeakPolarHBondContact OD1-CB 3.4Å
547	P	63.2	Low	73.6	Confident	49 Å²	49	86.1 Å²	86.1	32%	0.318	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-54.4	140	169.2	-18	29	0	0	0	109.3	G445 A549	G445-P547 WeakPolarHBondContact O-CD 3.28Å; G445-P547 VanDerWaalsContact O-CG 3.22Å; G445-P547 WeakPolarHBondContact O-CG 3.41Å; P547-A549 PolarHBondContact O-N 2.66Å
548	P	57.3	Low	72.1	Confident	118 Å²	118	91.4 Å²	91.4	77%	0.766	52%	0.52	S	S	*	.	P	Polyproline II helix	trans	-53.9	135.8	172.9	21.2	-30.1	0	0	0	108.7	V550	P548-V550 PolarHBondContact O-N 3.09Å
549	A	58.1	Low	70.4	Confident	92 Å²	92	97.5 Å²	97.5	76%	0.76	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-54.4	120.4	178.6	0	0	0	0	0	108.3	P547 E551	P547-A549 PolarHBondContact O-N 2.66Å; A549-E551 VanDerWaalsContact C-N 3.32Å; A549-E551 PolarHBondContact O-N 3.16Å
550	V	52.1	Low	68.4	Low	142 Å²	142	103.9 Å²	103.9	86%	0.861	59%	0.592	S	S	*	*			trans	-65.4	102.3	167.8	-175.4	0	0	0	0	105.1	P548 S552	P548-V550 PolarHBondContact O-N 3.09Å; V550-S552 PolarHBondContact O-N 2.96Å
551	E	40.4	Very low	66.2	Low	176 Å²	176	111.7 Å²	111.7	82%	0.822	64%	0.636	S	S	*	*			trans	-58.6	110.8	166.9	-72.7	-174.1	167	0	0	106	A549 E553	A549-E551 VanDerWaalsContact C-N 3.32Å; A549-E551 PolarHBondContact O-N 3.16Å; E551-E553 PolarHBondContact O-N 2.92Å
552	S	41.3	Very low	63.8	Low	113 Å²	113	116.6 Å²	116.6	79%	0.79	66%	0.658	S	S	*	*			trans	-64.3	104.3	170.1	50.9	0	0	0	0	107.2	V550	V550-S552 PolarHBondContact O-N 2.96Å
553	E	36.4	Very low	61	Low	264 Å²	264	114.3 Å²	114.3	100%	1.234	66%	0.658	S	S	*	*			trans	-57.4	0	167.9	-75.3	-172.5	157.9	0	0	112.3	E551	E551-E553 PolarHBondContact O-N 2.92Å

Retrieved 553 of 553 residues in 212.4 ms (Link to these results)

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