A0A087XZJ7_POEFO Loading...

Vav guanine nucleotide exchange factor 2

AlphaFold DB , UniProt , Accession A0A087XZJ7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 924 aa.

						>A0A087XZJ7_POEFO|A0A087XZJ7
MIKDTQSAKEADQSACPCAEKRSSPPAVKQFQGSVSFARRVSGAEMEEWRQCGRWLIDCKVLPPNHRVVWPSAVVFDLAQALRDGVLLCQMLHNLSPGSVDLKEINFRPQMSQFLCLKNIRTFLKVCHDKFGLRNSELFDPFDLFDVRDFGKVISALSRISHHSIAQIKGIRPFPSEDTALNEDDVYRSLEELADEHDLGEDDIYDCVPCEDDGDDIYEDIIKVEVRQPMIRYMQKMGMTEDDKRNCCLVEIQETESKYYKTLEDIEKNYMIPLKQVLSSQEMEAIFVNLEDIIRVHFALLRAIDMNMLSGGSGLGKIFLDFKERLLIYGQYCSHMENAQKTLDGLIATREDMKIKVEECTMKVQEGKFKLQDLLVVPMQRVLKYHLLLKELLSHSTDRPERQQLKEALAAMEDLAMYINEVKRDNETLKKISEFQSSIENLQVKLEEYGRPKIDGELKVSSIVNRTKQDRYIFLFDKVVIVCKRKGYSYELKEIIELQLYKMSDDPMNNRDMKKSSGKMWSYGFYLIHLQGKQGFQFFCKTEENKRKWMEQFEMAMSNIKPERATANQHNFQMHTFDKNTNCRACKMLLRGIFYQGYYCSRCGTGAHKECLEVITICKINPHDMEPGMSPGPKMVAVRNYHGTPTPPGKTPLCFQTGDFIELLKGDPDTPWWEGKLIQTQKSGFFPSSCVKPYLDPKPFQSLSSRQSSREADYYGYPWFAGNMERQQADNLLKSHCSGTYLIRERTAEAERFAISIKFNDEVKHIKVIEKDNWIHITEAKKFESLLELVEYYQSHSLKESFKLLDTTLRHPYKSRERSLTRASTRSPAATCASYNFSFLSPQGLNFSSQSSAPFWSVFTPRVVSTAVARYNFAARDMRELSLREGDIVKIYSKIGGDQGWWKGEANGRIGWFPSTYVDEEGVQ
					

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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	30.4	Very low	29.7	Very low	232 Å²	232	141.1 Å²	141.1	100%	1.143	76%	0.763	S	S	*	*				0	138.1	0	-82.8	176.8	163.7	0	0	108
2	I	30.6	Very low	29.6	Very low	154 Å²	154	140.9 Å²	140.9	79%	0.79	76%	0.761	S	S	*	*			trans	63.6	126.8	153.8	-60.8	169.2	0	0	0	116.5
3	K	28.9	Very low	29.5	Very low	161 Å²	161	142.9 Å²	142.9	70%	0.7	76%	0.763	S	S	*	*			cis	-161.7	154.7	-9.9	-112.7	-161.7	172.5	-157	0	110.9
4	D	32.7	Very low	29.3	Very low	110 Å²	110	140.4 Å²	140.4	59%	0.588	76%	0.762	S	S	*	*				25	149.2	120.9	-45.2	-10.8	0	0	0	120.1
5	T	32.6	Very low	29.2	Very low	110 Å²	110	137.2 Å²	137.2	68%	0.675	76%	0.762	S	S	*	*			cis	-172.8	-174.6	-12.7	34.3	0	0	0	0	107.9
6	Q	28.4	Very low	28.7	Very low	183 Å²	183	136.4 Å²	136.4	86%	0.855	77%	0.767	S	S	*	*			trans	77.3	159.6	154.7	-65.7	172.6	17.1	0	0	118.4
7	S	29.1	Very low	29.6	Very low	109 Å²	109	134.6 Å²	134.6	76%	0.762	76%	0.762	S	S	*	*			cis	-175.9	164.7	-34.6	-165.1	0	0	0	0	109.7
8	A	30.1	Very low	29.3	Very low	76 Å²	76	134.1 Å²	134.1	63%	0.628	77%	0.767	S	S	*	*			trans	73	124.5	157.6	0	0	0	0	0	117.2
9	K	28.2	Very low	29.4	Very low	170 Å²	170	131.2 Å²	131.2	74%	0.739	76%	0.761	S	S	*	*				81.7	149.4	86.5	-74.6	-175.2	166.7	-78	0	113.4
10	E	27.5	Very low	29.4	Very low	148 Å²	148	132.4 Å²	132.4	69%	0.692	76%	0.759	S	S	*	*			cis	-169.8	163.1	-18.3	-113.4	161.1	-171.6	0	0	108
11	A	28.6	Very low	29.4	Very low	99 Å²	99	133 Å²	133	82%	0.818	75%	0.753	S	S	*	*			trans	62.4	138.5	174.9	0	0	0	0	0	117
12	D	27.8	Very low	29.2	Very low	139 Å²	139	132.3 Å²	132.3	74%	0.743	74%	0.738	S	S	*	*			cis	103.9	147.6	17.5	-167.5	39.2	0	0	0	115.1
13	Q	28	Very low	29	Very low	167 Å²	167	130.1 Å²	130.1	78%	0.78	74%	0.736	S	S	*	*			trans	73.6	145.1	178.6	-51.3	178.4	15.8	0	0	116.9
14	S	27.5	Very low	28.9	Very low	108 Å²	108	127.8 Å²	127.8	76%	0.755	74%	0.74	S	S	*	*			cis	-165	166	-22	57.2	0	0	0	0	112.3
15	A	27.1	Very low	28.9	Very low	92 Å²	92	128.1 Å²	128.1	76%	0.76	75%	0.748	S	S	*	*			trans	53.7	104.3	154.3	0	0	0	0	0	123.3
16	C	20.9	Very low	29.2	Very low	125 Å²	125	128.3 Å²	128.3	85%	0.845	75%	0.752	S	S	*	*				3.6	170.7	117.1	-107.4	0	0	0	0	121.7
17	P	44.5	Very low	29.1	Very low	105 Å²	105	124.2 Å²	124.2	68%	0.682	75%	0.749	S	S	*	*			cis	-145.3	-179.7	5.8	41.9	-22.1	0	0	0	118.8
18	C	24.9	Very low	29	Very low	126 Å²	126	125.3 Å²	125.3	85%	0.851	75%	0.751	S	S	*	*			trans	65.5	157.2	147.3	-74.3	0	0	0	0	122.1
19	A	30.5	Very low	28.9	Very low	79 Å²	79	130.9 Å²	130.9	65%	0.653	76%	0.761	S	S	*	*			cis	-173	173.2	-23.8	0	0	0	0	0	112
20	E	29.5	Very low	28.9	Very low	154 Å²	154	132.1 Å²	132.1	72%	0.72	77%	0.769	S	S	*	*			trans	75	148.3	163.3	-52.2	-152.9	136.6	0	0	118.1
21	K	28.7	Very low	28.7	Very low	147 Å²	147	134.8 Å²	134.8	64%	0.639	78%	0.779	S	S	*	*			cis	-159	-175.4	-1.8	-117	165.4	-169.9	148.6	0	107
22	R	27.7	Very low	28.7	Very low	216 Å²	216	139.4 Å²	139.4	82%	0.815	78%	0.784	S	S	*	*			cis	-164.4	176.5	10.4	-139.8	171.7	-177.8	161.3	-0.5	109.9
23	S	25.3	Very low	28.5	Very low	108 Å²	108	136 Å²	136	76%	0.755	78%	0.781	S	S	*	*			trans	61.6	142.7	158.8	51.9	0	0	0	0	120.7
24	S	26.6	Very low	28.6	Very low	112 Å²	112	133.9 Å²	133.9	78%	0.783	78%	0.784	S	S	*	*			cis	-160.5	165	-10.1	-92.5	0	0	0	0	111.7
25	P	33.3	Very low	28.7	Very low	118 Å²	118	135.7 Å²	135.7	77%	0.766	79%	0.791	S	S	*	*			trans	-107.9	-165.4	-165.4	45.8	-38.9	0	0	0	113.6
26	P	39	Very low	28.7	Very low	114 Å²	114	136.9 Å²	136.9	74%	0.74	79%	0.793	S	S	*	*			cis	-144	169.5	4.6	43.8	-24.6	0	0	0	120.4
27	A	26.5	Very low	29.1	Very low	96 Å²	96	141 Å²	141	79%	0.793	80%	0.798	S	S	*	*			trans	65.8	155.2	152	0	0	0	0	0	119.8
28	V	26.1	Very low	28.5	Very low	133 Å²	133	140.6 Å²	140.6	81%	0.806	80%	0.803	S	S	*	*			cis	-137.2	137.4	20.2	174.9	0	0	0	0	113.7
29	K	28.6	Very low	28.6	Very low	192 Å²	192	146.4 Å²	146.4	84%	0.835	81%	0.807	S	S	*	*			trans	6.8	126.3	160.6	-59.3	177.9	178.1	179.3	0	121.9
30	Q	27.2	Very low	28.4	Very low	197 Å²	197	154.1 Å²	154.1	92%	0.921	82%	0.819	S	S	*	*				-144.8	170.9	121.7	-124.8	175.8	2.9	0	0	110.7
31	F	25.2	Very low	28.5	Very low	204 Å²	204	153.2 Å²	153.2	90%	0.895	82%	0.823	S	S	*	*			trans	-83.9	155	-164	-101.2	-112.1	0	0	0	114.9
32	Q	27.5	Very low	28.5	Very low	196 Å²	196	151.5 Å²	151.5	92%	0.916	83%	0.83	S	S	*	*			trans	-84.1	149.8	174.3	-64.4	173.2	-67.8	0	0	112.3
33	G	24.5	Very low	28.6	Very low	67 Å²	67	144.9 Å²	144.9	69%	0.691	83%	0.829	S	S	*	*			trans	173.5	131.3	164.8	0	0	0	0	0	111.6
34	S	29.1	Very low	29.1	Very low	122 Å²	122	143.4 Å²	143.4	85%	0.853	82%	0.823	S	S	*	*			trans	61.5	113.9	169.1	-54.8	0	0	0	0	118.6
35	V	30.7	Very low	29.8	Very low	146 Å²	146	145.8 Å²	145.8	89%	0.885	82%	0.822	S	S	*	*				161.8	92.9	129.3	169.5	0	0	0	0	108.2
36	S	26.8	Very low	30.9	Very low	117 Å²	117	143 Å²	143	82%	0.818	80%	0.799	S	S	*	*			trans	-164.6	50.5	169.7	65.4	0	0	0	0	113.3
37	F	28.1	Very low	32.6	Very low	213 Å²	213	141.3 Å²	141.3	93%	0.934	78%	0.782	S	S	*	*			trans	-136.7	52.7	175.9	-146.5	-87.2	0	0	0	112.5
38	A	32.3	Very low	35.3	Very low	95 Å²	95	138.7 Å²	138.7	79%	0.785	75%	0.753	S	S	*	*			trans	-153.9	57.8	-175.8	0	0	0	0	0	113.9
39	R	27.3	Very low	38.2	Very low	249 Å²	249	132.5 Å²	132.5	94%	0.94	72%	0.715	S	S	*	*			trans	-174.5	90.7	155.4	-110.9	167.7	178.4	178.2	-0.5	114.3
40	R	26.9	Very low	41	Very low	241 Å²	241	126.1 Å²	126.1	91%	0.909	69%	0.686	S	S	*	*			trans	178.9	102.5	141.5	-101.8	168.5	-173.3	-173.8	1.6	108.5
41	V	31.1	Very low	43.9	Very low	134 Å²	134	117.8 Å²	117.8	81%	0.812	65%	0.647	S	S	*	*			trans	-134	106.1	168.4	178.8	0	0	0	0	106.4
42	S	29.1	Very low	47.1	Very low	111 Å²	111	108 Å²	108	78%	0.776	60%	0.604	S	S	*	*	S	Bend	trans	-165.8	95.6	-179.9	54.5	0	0	0	0	107.1
43	G	29.4	Very low	50.1	Low	77 Å²	77	98.7 Å²	98.7	79%	0.794	56%	0.561	S	S	*	*	S	Bend	trans	91.1	111.9	-151	0	0	0	0	0	108.7
44	A	34.6	Very low	53.1	Low	77 Å²	77	101.6 Å²	101.6	64%	0.636	55%	0.551	S	S	*	*			trans	-128	96.3	177	0	0	0	0	0	107.4
45	E	42.5	Very low	56.2	Low	163 Å²	163	96 Å²	96	76%	0.762	51%	0.511	S	S	*	.			trans	-55.6	141.1	160.7	-69.7	160.5	-171.5	0	0	108.1
46	M	57.3	Low	59.1	Low	58 Å²	58	89 Å²	89	29%	0.286	47%	0.469	S	S	.	.			trans	-111.3	113.7	-169.5	-173.2	150.9	-63.7	0	0	111.3	E48 R50 Q51 R54 T179	M46-E48 PolarHBondContact O-N 3.22Å; M46-R50 HydrophobicContact CG-CB 4.01Å; M46-R50 HydrophobicContact SD-CB 4.42Å; M46-Q51 HydrophobicContact CB-CG 4.27Å; M46-Q51 HydrophobicContact CG-CG 3.85Å; M46-Q51 PolarHBondContact O-NE2 2.61Å; M46-R54 PolarHBondContact SD-NH1 3.39Å; M46-T179 WeakPolarHBondContact O-CG2 3.42Å
47	E	73.7	Confident	62	Low	79 Å²	79	84.9 Å²	84.9	37%	0.369	44%	0.437	S	S	.	.			trans	-45	132.5	175.5	-58.4	165.4	176.2	0	0	111.4	W49 R50 Q51 E183	E47-W49 VanDerWaalsContact C-N 3.26Å; E47-W49 PolarHBondContact O-N 2.83Å; E47-W49 PolarHBondContact OE2-NE1 3.37Å; E47-R50 HydrophobicContact CB-CG 4.22Å; E47-R50 WeakPolarHBondContact O-CA 3.4Å; E47-R50 WeakPolarHBondContact O-CB 3.23Å; E47-R50 PolarHBondContact O-N 2.97Å; E47-R50 IonicContact OE2-CZ 2.67Å; E47-R50 VanDerWaalsContact OE2-CZ 3.3Å; E47-R50 IonicContact OE2-NE 2.83Å; E47-R50 PolarHBondContact OE2-NE 2.86Å; E47-R50 IonicContact OE2-NH2 3.31Å; E47-R50 PolarHBondContact OE2-NH2 2.71Å; E47-R50 VanDerWaalsContact OE2-NH2 3.08Å; E47-Q51 PolarHBondContact O-N 3.06Å; E47-E183 WeakPolarHBondContact CA-OE1 2.93Å
48	E	82.7	Confident	64.9	Low	42 Å²	42	79.3 Å²	79.3	20%	0.196	42%	0.417	C	S	.	.	H	α-helix	trans	-56.9	-41	-170.4	-175.4	178.7	-172.3	0	0	111.2	M46 R50 Q51 C52 I154 F174 P175 E183	M46-E48 PolarHBondContact O-N 3.22Å; E48-R50 VanDerWaalsContact C-N 3.25Å; E48-R50 PolarHBondContact O-N 2.66Å; E48-Q51 WeakPolarHBondContact O-CA 3.22Å; E48-Q51 WeakPolarHBondContact O-CB 3.46Å; E48-Q51 PolarHBondContact O-N 2.96Å; E48-C52 PolarHBondContact O-N 2.87Å; E48-I154 HydrophobicContact CB-CG2 4.41Å; E48-I154 HydrophobicContact CG-CG2 3.66Å; E48-F174 HydrophobicContact CG-CD2 3.95Å; E48-F174 HydrophobicContact CG-CE2 4.02Å; E48-P175 HydrophobicContact CG-CB 4.2Å; E48-P175 HydrophobicContact CG-CG 4.5Å; E48-P175 WeakPolarHBondContact OE1-CD 3.37Å; E48-E183 PolarHBondContact N-OE1 2.9Å
49	W	86.6	Confident	67.7	Low	3 Å²	3	75.1 Å²	75.1	1%	0.011	38%	0.382	C	S	.	.	H	α-helix	trans	-60.5	-31.4	176.7	78.7	-92.5	0	0	0	113.1	E47 C52 G53 A73 V74 V75 L78 I154	E47-W49 VanDerWaalsContact C-N 3.26Å; E47-W49 PolarHBondContact O-N 2.83Å; E47-W49 PolarHBondContact OE2-NE1 3.37Å; W49-C52 WeakPolarHBondContact O-CB 3.34Å; W49-C52 PolarHBondContact O-N 3.1Å; W49-G53 PolarHBondContact O-N 3.24Å; W49-A73 HydrophobicContact CH2-CB 4.04Å; W49-V74 WeakPolarHBondContact CH2-O 3.4Å; W49-V74 VanDerWaalsContact CZ2-C 3.49Å; W49-V75 HydrophobicContact CB-CG2 3.78Å; W49-V75 HydrophobicContact CD2-CB 3.71Å; W49-V75 HydrophobicContact CD2-CG2 3.89Å; W49-V75 HydrophobicContact CE3-CB 4.27Å; W49-V75 HydrophobicContact CE3-CG2 4.4Å; W49-V75 HydrophobicContact CG-CB 3.83Å; W49-V75 HydrophobicContact CG-CG2 3.6Å; W49-V75 HydrophobicContact CZ2-CB 4.27Å; W49-V75 VanDerWaalsContact CZ2-N 3.31Å; W49-L78 HydrophobicContact CB-CD2 4.27Å; W49-L78 HydrophobicContact CE3-CB 4.01Å; W49-L78 HydrophobicContact CE3-CD2 4.01Å; W49-L78 HydrophobicContact CZ3-CB 4.28Å; W49-L78 VanDerWaalsContact O-CD2 3.27Å; W49-L78 WeakPolarHBondContact O-CD2 3.29Å; W49-I154 HydrophobicContact CB-CD1 4.21Å; W49-I154 HydrophobicContact CB-CG1 4.45Å
50	R	88	Confident	70.5	Confident	58 Å²	58	71.4 Å²	71.4	22%	0.219	37%	0.373	C	S	.	.	H	α-helix	trans	-74	-30	174.5	-62.6	-170.9	-167.3	-90.3	-2.8	112.1	M46 E47 E48 R54 A73	M46-R50 HydrophobicContact CG-CB 4.01Å; M46-R50 HydrophobicContact SD-CB 4.42Å; E47-R50 HydrophobicContact CB-CG 4.22Å; E47-R50 WeakPolarHBondContact O-CA 3.4Å; E47-R50 WeakPolarHBondContact O-CB 3.23Å; E47-R50 PolarHBondContact O-N 2.97Å; E47-R50 IonicContact OE2-CZ 2.67Å; E47-R50 VanDerWaalsContact OE2-CZ 3.3Å; E47-R50 IonicContact OE2-NE 2.83Å; E47-R50 PolarHBondContact OE2-NE 2.86Å; E47-R50 IonicContact OE2-NH2 3.31Å; E47-R50 PolarHBondContact OE2-NH2 2.71Å; E47-R50 VanDerWaalsContact OE2-NH2 3.08Å; E48-R50 VanDerWaalsContact C-N 3.25Å; E48-R50 PolarHBondContact O-N 2.66Å; R50-R54 WeakPolarHBondContact O-CG 3.37Å; R50-R54 PolarHBondContact O-N 3.48Å; R50-A73 PolarHBondContact NH1-O 3.26Å; R50-A73 PolarHBondContact NH2-O 3.37Å
51	Q	89.2	Confident	73.3	Confident	21 Å²	21	60.1 Å²	60.1	10%	0.098	33%	0.33	C	S	.	.	H	α-helix	trans	-68.5	-43.7	171	-51.3	-173	38.6	0	0	110	M46 E47 E48 G53 R54 W55 F174 P175 S176 T179	M46-Q51 HydrophobicContact CB-CG 4.27Å; M46-Q51 HydrophobicContact CG-CG 3.85Å; M46-Q51 PolarHBondContact O-NE2 2.61Å; E47-Q51 PolarHBondContact O-N 3.06Å; E48-Q51 WeakPolarHBondContact O-CA 3.22Å; E48-Q51 WeakPolarHBondContact O-CB 3.46Å; E48-Q51 PolarHBondContact O-N 2.96Å; Q51-G53 PolarHBondContact O-N 3.18Å; Q51-R54 PolarHBondContact O-N 3.43Å; Q51-W55 WeakPolarHBondContact O-CB 3.47Å; Q51-W55 PolarHBondContact O-N 2.97Å; Q51-F174 HydrophobicContact CB-CB 3.82Å; Q51-F174 HydrophobicContact CB-CD2 4.26Å; Q51-F174 HydrophobicContact CB-CG 4.28Å; Q51-P175 VanDerWaalsContact OE1-CA 3.29Å; Q51-S176 PolarHBondContact OE1-OG 3.44Å; Q51-T179 PolarHBondContact NE2-OG1 2.78Å
52	C	91.8	Very high	75.9	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-57.2	-48.3	173	-171.7	0	0	0	0	112.4	E48 W49 R54 W55 L56 L78 I154 F174	E48-C52 PolarHBondContact O-N 2.87Å; W49-C52 WeakPolarHBondContact O-CB 3.34Å; W49-C52 PolarHBondContact O-N 3.1Å; C52-R54 VanDerWaalsContact C-N 3.26Å; C52-R54 PolarHBondContact O-N 2.92Å; C52-W55 WeakPolarHBondContact O-CB 3.13Å; C52-W55 PolarHBondContact O-N 2.67Å; C52-W55 VanDerWaalsContact O-N 3.15Å; C52-L56 WeakPolarHBondContact O-CG 3.37Å; C52-L56 PolarHBondContact O-N 3.07Å; C52-L78 HydrophobicContact CB-CD2 4.27Å; C52-I154 HydrophobicContact CB-CD1 3.94Å; C52-F174 HydrophobicContact CB-CD2 4.18Å; C52-F174 HydrophobicContact CB-CE1 4.11Å; C52-F174 HydrophobicContact CB-CE2 3.57Å; C52-F174 HydrophobicContact CB-CZ 3.52Å; C52-F174 WeakPolarHBondContact SG-CZ 3.37Å
53	G	89.6	Confident	78.3	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-59.5	-32.7	177.7	0	0	0	0	0	113.9	W49 Q51	W49-G53 PolarHBondContact O-N 3.24Å; Q51-G53 PolarHBondContact O-N 3.18Å
54	R	89.1	Confident	80.6	Confident	127 Å²	127	51.4 Å²	51.4	48%	0.479	26%	0.259	S	S	.	.	H	α-helix	trans	-76	-42.3	173.1	-70.7	171.2	177.6	-163	-1.7	112.4	M46 R50 Q51 C52 L56 I57 D58 V69	M46-R54 PolarHBondContact SD-NH1 3.39Å; R50-R54 WeakPolarHBondContact O-CG 3.37Å; R50-R54 PolarHBondContact O-N 3.48Å; Q51-R54 PolarHBondContact O-N 3.43Å; C52-R54 VanDerWaalsContact C-N 3.26Å; C52-R54 PolarHBondContact O-N 2.92Å; R54-L56 PolarHBondContact O-N 3.03Å; R54-I57 WeakPolarHBondContact O-CA 3.4Å; R54-I57 WeakPolarHBondContact O-CB 3.25Å; R54-I57 PolarHBondContact O-N 2.97Å; R54-D58 PolarHBondContact O-N 3.32Å; R54-V69 HydrophobicContact CG-CG1 3.92Å
55	W	92.5	Very high	82.6	Confident	5 Å²	5	53.8 Å²	53.8	2%	0.019	26%	0.261	C	S	.	.	H	α-helix	trans	-58.6	-35.6	176	178.9	72.9	0	0	0	112	Q51 C52 I57 D58 C59 M91 L95 L157 I160 S161 I171 F174	Q51-W55 WeakPolarHBondContact O-CB 3.47Å; Q51-W55 PolarHBondContact O-N 2.97Å; C52-W55 WeakPolarHBondContact O-CB 3.13Å; C52-W55 PolarHBondContact O-N 2.67Å; C52-W55 VanDerWaalsContact O-N 3.15Å; W55-I57 VanDerWaalsContact C-N 3.34Å; W55-I57 PolarHBondContact O-N 2.79Å; W55-D58 PolarHBondContact O-N 3.02Å; W55-C59 VanDerWaalsContact CE2-SG 3.58Å; W55-C59 WeakPolarHBondContact O-CB 3.32Å; W55-C59 PolarHBondContact O-N 2.81Å; W55-C59 PolarHBondContact O-SG 2.87Å; W55-C59 VanDerWaalsContact O-SG 3.32Å; W55-M91 HydrophobicContact CE3-SD 4.37Å; W55-M91 HydrophobicContact CH2-CE 3.97Å; W55-M91 HydrophobicContact CH2-CG 4.36Å; W55-M91 HydrophobicContact CH2-SD 3.48Å; W55-M91 WeakPolarHBondContact CH2-SD 3.28Å; W55-M91 HydrophobicContact CZ3-CE 4.25Å; W55-M91 HydrophobicContact CZ3-CG 4.43Å; W55-M91 HydrophobicContact CZ3-SD 3.3Å; W55-M91 WeakPolarHBondContact CZ3-SD 3.41Å; W55-L95 HydrophobicContact CH2-CD1 4.14Å; W55-L95 HydrophobicContact CZ2-CD1 4.13Å; W55-L157 HydrophobicContact CZ3-CB 4.26Å; W55-L157 HydrophobicContact CZ3-CD2 4.31Å; W55-I160 HydrophobicContact CH2-CB 4.31Å; W55-I160 HydrophobicContact CH2-CG2 3.97Å; W55-I160 HydrophobicContact CZ2-CG2 4.49Å; W55-S161 VanDerWaalsContact CZ2-CA 3.45Å; W55-I171 VanDerWaalsContact NE1-CG2 3.34Å; W55-F174 HydrophobicContact CB-CD1 3.76Å; W55-F174 HydrophobicContact CB-CE1 4.24Å; W55-F174 AromaticContact CD2-CD1 3.92Å; W55-F174 HydrophobicContact CD2-CD1 3.92Å; W55-F174 AromaticContact CD2-CE1 3.81Å; W55-F174 HydrophobicContact CD2-CE1 3.81Å; W55-F174 HydrophobicContact CE3-CD1 4.15Å; W55-F174 AromaticContact CE3-CE1 3.57Å; W55-F174 HydrophobicContact CE3-CE1 3.57Å; W55-F174 AromaticContact CG-CD1 3.73Å; W55-F174 HydrophobicContact CG-CD1 3.73Å; W55-F174 HydrophobicContact CG-CE1 4.09Å; W55-F174 HydrophobicContact CZ3-CE1 4.19Å
56	L	92.1	Very high	84.5	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-66.7	-29.5	172.9	-70.5	165.4	0	0	0	113.7	C52 R54 K60 V61 L62 L78 L82 M91	C52-L56 WeakPolarHBondContact O-CG 3.37Å; C52-L56 PolarHBondContact O-N 3.07Å; R54-L56 PolarHBondContact O-N 3.03Å; L56-K60 PolarHBondContact O-N 2.8Å; L56-V61 WeakPolarHBondContact O-CB 3.4Å; L56-V61 PolarHBondContact O-N 2.72Å; L56-L62 HydrophobicContact CB-CD1 3.93Å; L56-L62 HydrophobicContact CB-CG 4.32Å; L56-L62 HydrophobicContact CD1-CD1 4.3Å; L56-L62 PolarHBondContact O-N 2.92Å; L56-L78 HydrophobicContact CD1-CD1 3.86Å; L56-L82 HydrophobicContact CD1-CD1 4.18Å; L56-L82 HydrophobicContact CD1-CD2 4.09Å; L56-M91 HydrophobicContact CD2-CG 4.07Å; L56-M91 HydrophobicContact CD2-SD 3.66Å
57	I	89.1	Confident	85.7	Confident	29 Å²	29	48.5 Å²	48.5	15%	0.149	23%	0.232	C	C	.	.	H	α-helix	trans	-71.5	-43.6	170.8	-64.6	168.4	0	0	0	110	R54 W55 C59 K60 L62 P64 V69	R54-I57 WeakPolarHBondContact O-CA 3.4Å; R54-I57 WeakPolarHBondContact O-CB 3.25Å; R54-I57 PolarHBondContact O-N 2.97Å; W55-I57 VanDerWaalsContact C-N 3.34Å; W55-I57 PolarHBondContact O-N 2.79Å; I57-C59 VanDerWaalsContact C-N 3.28Å; I57-C59 PolarHBondContact O-N 2.92Å; I57-K60 WeakPolarHBondContact O-CA 3.45Å; I57-K60 PolarHBondContact O-N 3.04Å; I57-L62 HydrophobicContact CG1-CB 3.71Å; I57-P64 HydrophobicContact CG2-CB 4.36Å; I57-P64 HydrophobicContact CG2-CG 4.2Å; I57-V69 HydrophobicContact CD1-CB 4.42Å; I57-V69 HydrophobicContact CD1-CG1 3.55Å; I57-V69 HydrophobicContact CD1-CG2 3.97Å
58	D	89.1	Confident	86.1	Confident	97 Å²	97	44.8 Å²	44.8	52%	0.519	22%	0.215	S	C	.	.	H	α-helix	trans	-64.1	-33.2	176	-70.3	-20.3	0	0	0	112.1	R54 W55 K60 I171	R54-D58 PolarHBondContact O-N 3.32Å; W55-D58 PolarHBondContact O-N 3.02Å; D58-K60 PolarHBondContact O-N 2.99Å; D58-I171 HydrophobicContact CB-CG2 3.89Å
59	C	89.1	Confident	86.1	Confident	6 Å²	6	45 Å²	45	4%	0.041	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-1.5	168.6	-73.4	0	0	0	0	114.2	W55 I57 V61 M91 N94	W55-C59 VanDerWaalsContact CE2-SG 3.58Å; W55-C59 WeakPolarHBondContact O-CB 3.32Å; W55-C59 PolarHBondContact O-N 2.81Å; W55-C59 PolarHBondContact O-SG 2.87Å; W55-C59 VanDerWaalsContact O-SG 3.32Å; I57-C59 VanDerWaalsContact C-N 3.28Å; I57-C59 PolarHBondContact O-N 2.92Å; C59-V61 HydrophobicContact CB-CG2 3.87Å; C59-V61 PolarHBondContact O-N 2.84Å; C59-M91 HydrophobicContact CB-CG 4.3Å; C59-N94 WeakPolarHBondContact O-CB 3.45Å; C59-N94 PolarHBondContact O-ND2 2.92Å
60	K	87.4	Confident	85.9	Confident	172 Å²	172	51.3 Å²	51.3	75%	0.748	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.2	41.3	-176	-53.6	-176.9	-179.5	-176.4	0	113.9	L56 I57 D58 N94	L56-K60 PolarHBondContact O-N 2.8Å; I57-K60 WeakPolarHBondContact O-CA 3.45Å; I57-K60 PolarHBondContact O-N 3.04Å; D58-K60 PolarHBondContact O-N 2.99Å; K60-N94 PolarHBondContact O-ND2 2.77Å
61	V	85.9	Confident	85.5	Confident	4 Å²	4	55 Å²	55	2%	0.024	27%	0.274	C	S	.	.	S	Bend	trans	-106.2	-32	179.2	-175.9	0	0	0	0	111.3	L56 C59 L87 M91	L56-V61 WeakPolarHBondContact O-CB 3.4Å; L56-V61 PolarHBondContact O-N 2.72Å; C59-V61 HydrophobicContact CB-CG2 3.87Å; C59-V61 PolarHBondContact O-N 2.84Å; V61-L87 HydrophobicContact CG1-CB 3.62Å; V61-L87 HydrophobicContact CG1-CD1 4.3Å; V61-L87 HydrophobicContact CG1-CD2 4.02Å; V61-L87 HydrophobicContact CG1-CG 4.19Å; V61-L87 VanDerWaalsContact CG1-O 3.3Å; V61-L87 WeakPolarHBondContact CG1-O 3.34Å; V61-M91 HydrophobicContact CG2-CB 3.72Å; V61-M91 HydrophobicContact CG2-CG 4.06Å
62	L	84.6	Confident	85.1	Confident	5 Å²	5	58.6 Å²	58.6	3%	0.026	30%	0.301	C	S	.	.	S	Bend	trans	-117.9	147.3	176.5	-72	175.5	0	0	0	111.1	L56 I57 H66 V68 L87	L56-L62 HydrophobicContact CB-CD1 3.93Å; L56-L62 HydrophobicContact CB-CG 4.32Å; L56-L62 HydrophobicContact CD1-CD1 4.3Å; L56-L62 PolarHBondContact O-N 2.92Å; I57-L62 HydrophobicContact CG1-CB 3.71Å; L62-H66 HydrophobicContact CB-CB 4.42Å; L62-V68 HydrophobicContact CD1-CG2 3.9Å; L62-L87 HydrophobicContact CD2-CD1 3.42Å; L62-L87 VanDerWaalsContact CD2-CD1 3.42Å; L62-L87 HydrophobicContact CG-CD1 4.21Å
63	P	79.4	Confident	84.7	Confident	33 Å²	33	58.7 Å²	58.7	21%	0.214	30%	0.303	C	S	.	.			trans	-64.8	146.9	174.4	15	-20.7	0	0	0	112.1	N65 H66 C207	P63-N65 PolarHBondContact O-N 2.97Å; P63-H66 HydrophobicContact CG-CB 3.9Å; P63-H66 VanDerWaalsContact O-CB 3.27Å; P63-H66 WeakPolarHBondContact O-CB 3.48Å; P63-H66 PolarHBondContact O-N 2.56Å; P63-C207 VanDerWaalsContact CB-SG 3.53Å
64	P	78.3	Confident	84.4	Confident	100 Å²	100	62.5 Å²	62.5	65%	0.649	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-21.2	177.3	-28.6	36.1	0	0	0	115.9	I57	I57-P64 HydrophobicContact CG2-CB 4.36Å; I57-P64 HydrophobicContact CG2-CG 4.2Å
65	N	77.6	Confident	84.2	Confident	127 Å²	127	56.9 Å²	56.9	68%	0.679	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.9	10.6	179.3	-65	-20.9	0	0	0	113.4	P63 W70	P63-N65 PolarHBondContact O-N 2.97Å; N65-W70 PolarHBondContact O-NE1 2.75Å
66	H	82.1	Confident	83.7	Confident	17 Å²	17	57 Å²	57	8%	0.079	31%	0.306	C	S	.	.			trans	-57.7	148.9	-174.6	-163.2	-112.2	0	0	0	112.8	L62 P63 V68 V69 W70	L62-H66 HydrophobicContact CB-CB 4.42Å; P63-H66 HydrophobicContact CG-CB 3.9Å; P63-H66 VanDerWaalsContact O-CB 3.27Å; P63-H66 WeakPolarHBondContact O-CB 3.48Å; P63-H66 PolarHBondContact O-N 2.56Å; H66-V68 HydrophobicContact CB-CG2 4.36Å; H66-V68 PolarHBondContact O-N 3.39Å; H66-V69 WeakPolarHBondContact O-CG2 3.47Å; H66-V69 PolarHBondContact O-N 3.09Å; H66-V69 VanDerWaalsContact O-N 3.11Å; H66-W70 VanDerWaalsContact O-CD1 3.27Å; H66-W70 PolarHBondContact O-NE1 2.97Å
67	R	80.9	Confident	83.3	Confident	93 Å²	93	57.4 Å²	57.4	35%	0.351	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-48.6	-40.3	-177.7	177.1	177	163.2	174	-7.3	113	V69 W70 A73 D77 E201	R67-V69 PolarHBondContact O-N 3.4Å; R67-V69 VanDerWaalsContact O-N 3.1Å; R67-W70 VanDerWaalsContact O-CB 3.3Å; R67-W70 WeakPolarHBondContact O-CB 3.31Å; R67-W70 PolarHBondContact O-N 3.19Å; R67-A73 WeakPolarHBondContact O-CB 3.4Å; R67-D77 HydrophobicContact CG-CB 4.48Å; R67-D77 IonicContact CZ-OD1 3.56Å; R67-D77 VanDerWaalsContact NE-CG 3.35Å; R67-D77 IonicContact NE-OD1 2.73Å; R67-D77 PolarHBondContact NE-OD1 3.02Å; R67-D77 IonicContact NE-OD2 3.27Å; R67-D77 IonicContact NH2-OD1 2.96Å; R67-D77 PolarHBondContact NH2-OD1 3Å; R67-E201 IonicContact CZ-OE1 2.64Å; R67-E201 IonicContact NH1-OE1 2.66Å; R67-E201 PolarHBondContact NH1-OE1 3.08Å
68	V	83.8	Confident	83.3	Confident	2 Å²	2	56 Å²	56	1%	0.012	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-60.4	-20.5	-176.6	-55.5	0	0	0	0	115.5	L62 H66 A73 D77 L78	L62-V68 HydrophobicContact CD1-CG2 3.9Å; H66-V68 HydrophobicContact CB-CG2 4.36Å; H66-V68 PolarHBondContact O-N 3.39Å; V68-A73 WeakPolarHBondContact O-CB 3.34Å; V68-D77 HydrophobicContact CG1-CB 3.99Å; V68-D77 WeakPolarHBondContact CG1-O 3.41Å; V68-L78 HydrophobicContact CG1-CB 4.12Å; V68-L78 HydrophobicContact CG1-CD1 4.31Å
69	V	81.6	Confident	83.2	Confident	45 Å²	45	51.4 Å²	51.4	27%	0.273	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-98.6	2.9	176.2	-68.5	0	0	0	0	113.9	R54 I57 H66 R67	R54-V69 HydrophobicContact CG-CG1 3.92Å; I57-V69 HydrophobicContact CD1-CB 4.42Å; I57-V69 HydrophobicContact CD1-CG1 3.55Å; I57-V69 HydrophobicContact CD1-CG2 3.97Å; H66-V69 WeakPolarHBondContact O-CG2 3.47Å; H66-V69 PolarHBondContact O-N 3.09Å; H66-V69 VanDerWaalsContact O-N 3.11Å; R67-V69 PolarHBondContact O-N 3.4Å; R67-V69 VanDerWaalsContact O-N 3.1Å
70	W	83.3	Confident	83	Confident	136 Å²	136	51.8 Å²	51.8	52%	0.515	28%	0.278	S	S	.	.	S	Bend	trans	-71.4	150.2	177.5	-64.8	12	0	0	0	111.2	N65 H66 R67 S72 A73	N65-W70 PolarHBondContact O-NE1 2.75Å; H66-W70 VanDerWaalsContact O-CD1 3.27Å; H66-W70 PolarHBondContact O-NE1 2.97Å; R67-W70 VanDerWaalsContact O-CB 3.3Å; R67-W70 WeakPolarHBondContact O-CB 3.31Å; R67-W70 PolarHBondContact O-N 3.19Å; W70-S72 PolarHBondContact O-N 3.03Å; W70-S72 VanDerWaalsContact O-N 3.13Å; W70-A73 HydrophobicContact CB-CB 4.47Å; W70-A73 WeakPolarHBondContact O-CB 3.42Å; W70-A73 PolarHBondContact O-N 3.02Å
71	P	79.3	Confident	82.9	Confident	136 Å²	136	43.6 Å²	43.6	88%	0.883	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-23.1	178.2	-24.8	35	0	0	0	114.5
72	S	81.8	Confident	83.2	Confident	96 Å²	96	43.4 Å²	43.4	67%	0.671	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-1.8	176.1	57.4	0	0	0	0	114	W70	W70-S72 PolarHBondContact O-N 3.03Å; W70-S72 VanDerWaalsContact O-N 3.13Å
73	A	82.5	Confident	83.4	Confident	3 Å²	3	43.8 Å²	43.8	3%	0.025	24%	0.242	C	C	.	.			trans	-68.7	145.2	-174.7	0	0	0	0	0	111.9	W49 R50 R67 V68 W70 D77	W49-A73 HydrophobicContact CH2-CB 4.04Å; R50-A73 PolarHBondContact NH1-O 3.26Å; R50-A73 PolarHBondContact NH2-O 3.37Å; R67-A73 WeakPolarHBondContact O-CB 3.4Å; V68-A73 WeakPolarHBondContact O-CB 3.34Å; W70-A73 HydrophobicContact CB-CB 4.47Å; W70-A73 WeakPolarHBondContact O-CB 3.42Å; W70-A73 PolarHBondContact O-N 3.02Å; A73-D77 WeakPolarHBondContact CA-OD2 2.54Å; A73-D77 WeakPolarHBondContact CB-OD2 3.43Å
74	V	83.6	Confident	83.7	Confident	79 Å²	79	42.4 Å²	42.4	48%	0.479	23%	0.233	S	C	.	.			trans	-114.5	156.9	174.7	-66.9	0	0	0	0	110.4	W49 F76 D77	W49-V74 WeakPolarHBondContact CH2-O 3.4Å; W49-V74 VanDerWaalsContact CZ2-C 3.49Å; V74-F76 HydrophobicContact CG2-CB 4.06Å; V74-F76 PolarHBondContact O-N 2.71Å; V74-D77 PolarHBondContact N-OD2 3.48Å; V74-D77 VanDerWaalsContact O-CB 3.27Å; V74-D77 WeakPolarHBondContact O-CB 3.4Å; V74-D77 PolarHBondContact O-N 3.12Å
75	V	83.7	Confident	84.2	Confident	9 Å²	9	37.7 Å²	37.7	6%	0.055	20%	0.202	C	C	.	.	H	α-helix	trans	-57.1	-27	-179.5	64.8	0	0	0	0	113.1	W49 D77 L78 A79 F150 V186 Y187 L190	W49-V75 HydrophobicContact CB-CG2 3.78Å; W49-V75 HydrophobicContact CD2-CB 3.71Å; W49-V75 HydrophobicContact CD2-CG2 3.89Å; W49-V75 HydrophobicContact CE3-CB 4.27Å; W49-V75 HydrophobicContact CE3-CG2 4.4Å; W49-V75 HydrophobicContact CG-CB 3.83Å; W49-V75 HydrophobicContact CG-CG2 3.6Å; W49-V75 HydrophobicContact CZ2-CB 4.27Å; W49-V75 VanDerWaalsContact CZ2-N 3.31Å; V75-D77 VanDerWaalsContact C-N 3.28Å; V75-D77 PolarHBondContact O-N 2.81Å; V75-L78 PolarHBondContact O-N 2.89Å; V75-L78 VanDerWaalsContact O-N 3.14Å; V75-A79 PolarHBondContact O-N 2.91Å; V75-F150 HydrophobicContact CG2-CD1 3.84Å; V75-F150 HydrophobicContact CG2-CE1 3.86Å; V75-V186 HydrophobicContact CG1-CG1 3.9Å; V75-Y187 HydrophobicContact CG2-CD1 4.2Å; V75-Y187 HydrophobicContact CG2-CE1 3.75Å; V75-L190 HydrophobicContact CG1-CD1 3.83Å; V75-L190 HydrophobicContact CG1-CD2 3.63Å; V75-L190 HydrophobicContact CG1-CG 4.25Å; V75-L190 HydrophobicContact CG2-CD1 4.3Å
76	F	83.1	Confident	84.7	Confident	9 Å²	9	31.7 Å²	31.7	4%	0.039	17%	0.17	C	C	.	.	H	α-helix	trans	-61.4	-33.8	173.8	-173.4	-105.6	0	0	0	112.9	V74 L78 A79 Q80 L190 L193 A194 H197	V74-F76 HydrophobicContact CG2-CB 4.06Å; V74-F76 PolarHBondContact O-N 2.71Å; F76-L78 PolarHBondContact O-N 2.89Å; F76-A79 PolarHBondContact O-N 3.4Å; F76-Q80 HydrophobicContact CE1-CB 4.4Å; F76-Q80 VanDerWaalsContact O-CB 3.3Å; F76-Q80 WeakPolarHBondContact O-CB 3.46Å; F76-Q80 PolarHBondContact O-N 2.79Å; F76-L190 HydrophobicContact CB-CD2 3.88Å; F76-L190 HydrophobicContact CD2-CD2 4.23Å; F76-L193 HydrophobicContact CB-CD1 4.46Å; F76-L193 HydrophobicContact CD2-CB 3.9Å; F76-L193 HydrophobicContact CE2-CB 4.12Å; F76-L193 HydrophobicContact CG-CB 4.18Å; F76-A194 VanDerWaalsContact CE2-CA 3.48Å; F76-A194 HydrophobicContact CE2-CB 3.86Å; F76-H197 HydrophobicContact CD1-CB 4.48Å; F76-H197 HydrophobicContact CE1-CB 3.61Å; F76-H197 HydrophobicContact CZ-CB 4.09Å
77	D	84.3	Confident	85.1	Confident	7 Å²	7	30.9 Å²	30.9	4%	0.037	17%	0.166	C	C	.	.	H	α-helix	trans	-61.2	-35.7	176.2	-55.8	-31.7	0	0	0	111	R67 V68 A73 V74 V75 A81	R67-D77 HydrophobicContact CG-CB 4.48Å; R67-D77 IonicContact CZ-OD1 3.56Å; R67-D77 VanDerWaalsContact NE-CG 3.35Å; R67-D77 IonicContact NE-OD1 2.73Å; R67-D77 PolarHBondContact NE-OD1 3.02Å; R67-D77 IonicContact NE-OD2 3.27Å; R67-D77 IonicContact NH2-OD1 2.96Å; R67-D77 PolarHBondContact NH2-OD1 3Å; V68-D77 HydrophobicContact CG1-CB 3.99Å; V68-D77 WeakPolarHBondContact CG1-O 3.41Å; A73-D77 WeakPolarHBondContact CA-OD2 2.54Å; A73-D77 WeakPolarHBondContact CB-OD2 3.43Å; V74-D77 PolarHBondContact N-OD2 3.48Å; V74-D77 VanDerWaalsContact O-CB 3.27Å; V74-D77 WeakPolarHBondContact O-CB 3.4Å; V74-D77 PolarHBondContact O-N 3.12Å; V75-D77 VanDerWaalsContact C-N 3.28Å; V75-D77 PolarHBondContact O-N 2.81Å; D77-A81 WeakPolarHBondContact O-CB 3.21Å; D77-A81 PolarHBondContact O-N 2.82Å
78	L	88.2	Confident	85.7	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-77.5	-38.8	176.3	-178.1	63	0	0	0	111.7	W49 C52 L56 V68 V75 F76 Q80 A81 L82 F150 I154	W49-L78 HydrophobicContact CB-CD2 4.27Å; W49-L78 HydrophobicContact CE3-CB 4.01Å; W49-L78 HydrophobicContact CE3-CD2 4.01Å; W49-L78 HydrophobicContact CZ3-CB 4.28Å; W49-L78 VanDerWaalsContact O-CD2 3.27Å; W49-L78 WeakPolarHBondContact O-CD2 3.29Å; C52-L78 HydrophobicContact CB-CD2 4.27Å; L56-L78 HydrophobicContact CD1-CD1 3.86Å; V68-L78 HydrophobicContact CG1-CB 4.12Å; V68-L78 HydrophobicContact CG1-CD1 4.31Å; V75-L78 PolarHBondContact O-N 2.89Å; V75-L78 VanDerWaalsContact O-N 3.14Å; F76-L78 PolarHBondContact O-N 2.89Å; L78-Q80 VanDerWaalsContact C-N 3.33Å; L78-A81 PolarHBondContact O-N 2.9Å; L78-L82 HydrophobicContact CD1-CD1 4.1Å; L78-L82 HydrophobicContact CD1-CG 4.31Å; L78-L82 HydrophobicContact CG-CD1 4.21Å; L78-L82 WeakPolarHBondContact O-CG 3.38Å; L78-L82 PolarHBondContact O-N 2.83Å; L78-F150 HydrophobicContact CD2-CE1 4.43Å; L78-F150 HydrophobicContact CD2-CZ 4.47Å; L78-F150 HydrophobicContact CG-CE1 4.43Å; L78-F150 HydrophobicContact CG-CZ 4.14Å; L78-I154 HydrophobicContact CD2-CD1 4Å
79	A	87.6	Confident	86	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-61.3	-43.6	174.7	0	0	0	0	0	111.6	V75 F76 L82 R83 V147 F150	V75-A79 PolarHBondContact O-N 2.91Å; F76-A79 PolarHBondContact O-N 3.4Å; A79-L82 PolarHBondContact O-N 2.97Å; A79-R83 WeakPolarHBondContact O-CB 3.42Å; A79-R83 PolarHBondContact O-N 2.94Å; A79-V147 HydrophobicContact CB-CG1 3.76Å; A79-V147 HydrophobicContact CB-CG2 4.4Å; A79-F150 VanDerWaalsContact CA-CZ 3.46Å; A79-F150 HydrophobicContact CB-CD1 4.26Å; A79-F150 HydrophobicContact CB-CD2 3.91Å; A79-F150 HydrophobicContact CB-CE1 4.06Å; A79-F150 HydrophobicContact CB-CE2 3.72Å; A79-F150 HydrophobicContact CB-CG 4.19Å; A79-F150 HydrophobicContact CB-CZ 3.8Å
80	Q	84.1	Confident	86.3	Confident	15 Å²	15	24.6 Å²	24.6	7%	0.07	14%	0.138	C	C	.	.	H	α-helix	trans	-61.4	-45.5	177	-172.9	152.2	27.4	0	0	111.9	F76 L78 L82 R83 H197 L199	F76-Q80 HydrophobicContact CE1-CB 4.4Å; F76-Q80 VanDerWaalsContact O-CB 3.3Å; F76-Q80 WeakPolarHBondContact O-CB 3.46Å; F76-Q80 PolarHBondContact O-N 2.79Å; L78-Q80 VanDerWaalsContact C-N 3.33Å; Q80-L82 PolarHBondContact O-N 2.95Å; Q80-R83 WeakPolarHBondContact O-CB 3.43Å; Q80-R83 PolarHBondContact O-N 3.15Å; Q80-H197 PolarHBondContact NE2-O 3.28Å; Q80-L199 PolarHBondContact NE2-O 2.68Å
81	A	86.1	Confident	86.8	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-66.6	-19.7	177.6	0	0	0	0	0	114.6	D77 L78 L87 I204	D77-A81 WeakPolarHBondContact O-CB 3.21Å; D77-A81 PolarHBondContact O-N 2.82Å; L78-A81 PolarHBondContact O-N 2.9Å; A81-L87 VanDerWaalsContact O-CD1 3.27Å; A81-L87 WeakPolarHBondContact O-CD1 3.35Å; A81-I204 HydrophobicContact CB-CD1 4.11Å
82	L	91.3	Very high	87.4	Confident	0 Å²	0	11.7 Å²	11.7	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-103.2	-9.7	177.7	-61.6	179.5	0	0	0	113.6	L56 L78 A79 Q80 D84 G85 L87 L88 L144 F150 L157	L56-L82 HydrophobicContact CD1-CD1 4.18Å; L56-L82 HydrophobicContact CD1-CD2 4.09Å; L78-L82 HydrophobicContact CD1-CD1 4.1Å; L78-L82 HydrophobicContact CD1-CG 4.31Å; L78-L82 HydrophobicContact CG-CD1 4.21Å; L78-L82 WeakPolarHBondContact O-CG 3.38Å; L78-L82 PolarHBondContact O-N 2.83Å; A79-L82 PolarHBondContact O-N 2.97Å; Q80-L82 PolarHBondContact O-N 2.95Å; L82-D84 PolarHBondContact O-N 2.91Å; L82-G85 PolarHBondContact O-N 2.94Å; L82-G85 VanDerWaalsContact O-N 3.09Å; L82-L87 HydrophobicContact CD2-CB 4.05Å; L82-L88 HydrophobicContact CD1-CD2 4.32Å; L82-L88 HydrophobicContact CD2-CD2 3.87Å; L82-L88 HydrophobicContact CD2-CG 4.16Å; L82-L144 HydrophobicContact CB-CD1 4.13Å; L82-F150 HydrophobicContact CD1-CZ 4.26Å; L82-L157 HydrophobicContact CD1-CD1 4.02Å
83	R	89.6	Confident	87.7	Confident	12 Å²	12	9.4 Å²	9.4	5%	0.045	5%	0.05	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.4	-27.5	-168.1	-163.9	-179.9	-171.1	169.2	18.2	114.4	A79 Q80 M111 F145 A194 D198	A79-R83 WeakPolarHBondContact O-CB 3.42Å; A79-R83 PolarHBondContact O-N 2.94Å; Q80-R83 WeakPolarHBondContact O-CB 3.43Å; Q80-R83 PolarHBondContact O-N 3.15Å; R83-M111 HydrophobicContact CG-SD 4.12Å; R83-F145 HydrophobicContact CG-CD2 4.41Å; R83-F145 PolarHBondContact NE-O 2.79Å; R83-F145 PolarHBondContact NH2-O 2.82Å; R83-F145 VanDerWaalsContact NH2-O 3.15Å; R83-A194 PolarHBondContact NH1-O 3.26Å; R83-A194 PolarHBondContact NH2-O 2.7Å; R83-D198 IonicContact CZ-OD1 2.69Å; R83-D198 IonicContact NH1-OD1 2.74Å; R83-D198 PolarHBondContact NH1-OD1 3.36Å
84	D	85.1	Confident	88	Confident	5 Å²	5	11.3 Å²	11.3	3%	0.027	6%	0.06	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-8.4	-176.8	60.9	41.7	0	0	0	115.4	L82 V86 P109 N119 Y205	L82-D84 PolarHBondContact O-N 2.91Å; D84-V86 HydrophobicContact CB-CG2 4.34Å; D84-V86 PolarHBondContact O-N 3.3Å; D84-V86 WeakPolarHBondContact OD1-CA 3.29Å; D84-V86 VanDerWaalsContact OD1-CB 3.26Å; D84-V86 WeakPolarHBondContact OD1-CB 3.49Å; D84-V86 WeakPolarHBondContact OD1-CG2 3.43Å; D84-V86 PolarHBondContact OD1-N 3.4Å; D84-P109 HydrophobicContact CB-CG 3.75Å; D84-N119 VanDerWaalsContact O-CB 3.25Å; D84-N119 WeakPolarHBondContact O-CB 3.26Å; D84-N119 PolarHBondContact O-ND2 3.47Å; D84-Y205 WeakPolarHBondContact OD2-CE1 3.38Å; D84-Y205 PolarHBondContact OD2-OH 3.44Å
85	G	89.3	Confident	88.3	Confident	0 Å²	0	7.7 Å²	7.7	0%	0	4%	0.038	C	C	.	.	S	Bend	trans	70.7	-4	-176.7	0	0	0	0	0	116.9	L82 L88 C89	L82-G85 PolarHBondContact O-N 2.94Å; L82-G85 VanDerWaalsContact O-N 3.09Å; G85-L88 PolarHBondContact O-N 3.02Å; G85-C89 PolarHBondContact O-N 3.11Å
86	V	87.4	Confident	88.4	Confident	1 Å²	1	8.9 Å²	8.9	1%	0.006	5%	0.046	C	C	.	.	H	α-helix	trans	-64.8	-52.9	-179.4	-180	0	0	0	0	110.2	D84 L88 C89 Q90 N106 F107 P109 N119 Y205	D84-V86 HydrophobicContact CB-CG2 4.34Å; D84-V86 PolarHBondContact O-N 3.3Å; D84-V86 WeakPolarHBondContact OD1-CA 3.29Å; D84-V86 VanDerWaalsContact OD1-CB 3.26Å; D84-V86 WeakPolarHBondContact OD1-CB 3.49Å; D84-V86 WeakPolarHBondContact OD1-CG2 3.43Å; D84-V86 PolarHBondContact OD1-N 3.4Å; V86-L88 PolarHBondContact O-N 1.89Å; V86-C89 PolarHBondContact O-N 3.15Å; V86-Q90 PolarHBondContact O-N 3.12Å; V86-N106 VanDerWaalsContact CG2-O 3.27Å; V86-N106 WeakPolarHBondContact CG2-O 3.4Å; V86-F107 HydrophobicContact CG1-CD1 3.65Å; V86-F107 HydrophobicContact CG1-CE1 4.27Å; V86-P109 HydrophobicContact CG2-CG 4.24Å; V86-N119 WeakPolarHBondContact CG2-ND2 3.48Å; V86-Y205 HydrophobicContact CB-CE1 4.15Å; V86-Y205 HydrophobicContact CG1-CD1 4.38Å; V86-Y205 HydrophobicContact CG1-CE1 4.26Å; V86-Y205 HydrophobicContact CG2-CE1 4.34Å
87	L	90	Very high	88.5	Confident	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-61	-34.9	178.1	-65.7	-161.3	0	0	0	112.1	V61 L62 A81 L82 Q90 M91 I204 V208	V61-L87 HydrophobicContact CG1-CB 3.62Å; V61-L87 HydrophobicContact CG1-CD1 4.3Å; V61-L87 HydrophobicContact CG1-CD2 4.02Å; V61-L87 HydrophobicContact CG1-CG 4.19Å; V61-L87 VanDerWaalsContact CG1-O 3.3Å; V61-L87 WeakPolarHBondContact CG1-O 3.34Å; L62-L87 HydrophobicContact CD2-CD1 3.42Å; L62-L87 VanDerWaalsContact CD2-CD1 3.42Å; L62-L87 HydrophobicContact CG-CD1 4.21Å; A81-L87 VanDerWaalsContact O-CD1 3.27Å; A81-L87 WeakPolarHBondContact O-CD1 3.35Å; L82-L87 HydrophobicContact CD2-CB 4.05Å; L87-Q90 PolarHBondContact O-N 3.34Å; L87-M91 WeakPolarHBondContact O-CB 3.47Å; L87-M91 PolarHBondContact O-N 2.91Å; L87-I204 HydrophobicContact CD1-CG2 4.04Å; L87-V208 HydrophobicContact CD2-CG2 3.89Å
88	L	94.1	Very high	88.2	Confident	0 Å²	0	15.4 Å²	15.4	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-66.4	-42.7	175.8	-68.4	-176.5	0	0	0	112.5	L82 G85 V86 M91 L92 F123 F139 L144 L157	L82-L88 HydrophobicContact CD1-CD2 4.32Å; L82-L88 HydrophobicContact CD2-CD2 3.87Å; L82-L88 HydrophobicContact CD2-CG 4.16Å; G85-L88 PolarHBondContact O-N 3.02Å; V86-L88 PolarHBondContact O-N 1.89Å; L88-M91 WeakPolarHBondContact O-CB 3.49Å; L88-M91 PolarHBondContact O-N 3.16Å; L88-L92 PolarHBondContact O-N 2.9Å; L88-F123 HydrophobicContact CB-CB 4.22Å; L88-F123 HydrophobicContact CB-CD1 4.43Å; L88-F123 HydrophobicContact CB-CD2 3.56Å; L88-F123 HydrophobicContact CB-CE2 3.98Å; L88-F123 HydrophobicContact CB-CG 3.81Å; L88-F123 HydrophobicContact CD1-CD1 4.13Å; L88-F123 HydrophobicContact CD1-CE1 4.24Å; L88-F123 HydrophobicContact CD1-CG 4.32Å; L88-F123 HydrophobicContact CD2-CE2 4.22Å; L88-F123 HydrophobicContact CD2-CZ 4.34Å; L88-F123 HydrophobicContact CG-CD2 4.5Å; L88-F123 WeakPolarHBondContact O-CD2 3.35Å; L88-F139 HydrophobicContact CD1-CZ 4.3Å; L88-L144 HydrophobicContact CD1-CD2 3.39Å; L88-L157 HydrophobicContact CD2-CD1 4.22Å; L88-L157 HydrophobicContact CD2-CD2 3.82Å
89	C	91.3	Very high	88	Confident	0 Å²	0	16 Å²	16	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-65.7	-41.9	173.2	-76.2	0	0	0	0	112.2	G85 V86 M91 L92 H93 V100 I105 N119	G85-C89 PolarHBondContact O-N 3.11Å; V86-C89 PolarHBondContact O-N 3.15Å; C89-M91 VanDerWaalsContact C-N 3.32Å; C89-M91 PolarHBondContact O-N 2.83Å; C89-L92 PolarHBondContact O-N 3.24Å; C89-H93 PolarHBondContact O-N 3.46Å; C89-H93 VanDerWaalsContact O-N 3.12Å; C89-V100 HydrophobicContact CB-CG1 4.16Å; C89-I105 HydrophobicContact CB-CD1 3.85Å; C89-I105 HydrophobicContact CB-CG1 3.98Å; C89-I105 HydrophobicContact CB-CG2 4.38Å; C89-I105 WeakPolarHBondContact SG-CD1 3.45Å; C89-N119 PolarHBondContact SG-O 3.04Å; C89-N119 VanDerWaalsContact SG-O 3.4Å
90	Q	86.8	Confident	87.9	Confident	9 Å²	9	16 Å²	16	4%	0.042	11%	0.106	C	C	.	.	H	α-helix	trans	-62.9	-38.7	175.5	-168.5	61.7	46.5	0	0	111.8	V86 L87 H93 N94	V86-Q90 PolarHBondContact O-N 3.12Å; L87-Q90 PolarHBondContact O-N 3.34Å; Q90-H93 PolarHBondContact O-N 2.89Å; Q90-N94 PolarHBondContact NE2-OD1 3.1Å; Q90-N94 WeakPolarHBondContact O-CB 3.4Å; Q90-N94 VanDerWaalsContact O-CG 3.26Å; Q90-N94 PolarHBondContact O-N 2.89Å; Q90-N94 PolarHBondContact O-OD1 3.32Å
91	M	93.4	Very high	87.6	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-58.2	-48.2	175.3	-172.8	-159.3	77.8	0	0	112.1	W55 L56 C59 V61 L87 L88 C89 H93 N94 L95 F123 L157 I160	W55-M91 HydrophobicContact CE3-SD 4.37Å; W55-M91 HydrophobicContact CH2-CE 3.97Å; W55-M91 HydrophobicContact CH2-CG 4.36Å; W55-M91 HydrophobicContact CH2-SD 3.48Å; W55-M91 WeakPolarHBondContact CH2-SD 3.28Å; W55-M91 HydrophobicContact CZ3-CE 4.25Å; W55-M91 HydrophobicContact CZ3-CG 4.43Å; W55-M91 HydrophobicContact CZ3-SD 3.3Å; W55-M91 WeakPolarHBondContact CZ3-SD 3.41Å; L56-M91 HydrophobicContact CD2-CG 4.07Å; L56-M91 HydrophobicContact CD2-SD 3.66Å; C59-M91 HydrophobicContact CB-CG 4.3Å; V61-M91 HydrophobicContact CG2-CB 3.72Å; V61-M91 HydrophobicContact CG2-CG 4.06Å; L87-M91 WeakPolarHBondContact O-CB 3.47Å; L87-M91 PolarHBondContact O-N 2.91Å; L88-M91 WeakPolarHBondContact O-CB 3.49Å; L88-M91 PolarHBondContact O-N 3.16Å; C89-M91 VanDerWaalsContact C-N 3.32Å; C89-M91 PolarHBondContact O-N 2.83Å; M91-H93 VanDerWaalsContact C-N 3.34Å; M91-H93 PolarHBondContact O-N 3.09Å; M91-N94 PolarHBondContact O-N 3.33Å; M91-L95 HydrophobicContact CE-CD1 4.17Å; M91-L95 HydrophobicContact CG-CD1 4.15Å; M91-L95 WeakPolarHBondContact O-CB 3.26Å; M91-L95 VanDerWaalsContact O-CG 3.28Å; M91-L95 WeakPolarHBondContact O-CG 3.33Å; M91-L95 PolarHBondContact O-N 3.42Å; M91-F123 HydrophobicContact CE-CE2 3.87Å; M91-L157 HydrophobicContact CE-CD2 3.84Å; M91-L157 HydrophobicContact SD-CD2 3.8Å; M91-I160 HydrophobicContact CE-CD1 4.26Å; M91-I160 HydrophobicContact CE-CG2 3.97Å
92	L	91.9	Very high	86.9	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-64	-40.1	178	-63.8	-177.7	0	0	0	111.5	L88 C89 L95 S96 S99 V100 F123 V126 F131 I160	L88-L92 PolarHBondContact O-N 2.9Å; C89-L92 PolarHBondContact O-N 3.24Å; L92-L95 PolarHBondContact O-N 2.95Å; L92-S96 PolarHBondContact O-N 3.16Å; L92-S99 PolarHBondContact O-OG 2.88Å; L92-V100 HydrophobicContact CB-CG2 3.72Å; L92-V100 HydrophobicContact CD1-CG2 4.19Å; L92-F123 HydrophobicContact CD1-CD2 3.38Å; L92-F123 HydrophobicContact CD1-CE2 3.88Å; L92-F123 HydrophobicContact CD1-CG 4.21Å; L92-F123 HydrophobicContact CD2-CD2 4.32Å; L92-F123 HydrophobicContact CD2-CE2 4Å; L92-F123 HydrophobicContact CG-CD2 3.71Å; L92-F123 HydrophobicContact CG-CE2 3.88Å; L92-V126 HydrophobicContact CD1-CB 3.8Å; L92-V126 HydrophobicContact CD1-CG1 3.77Å; L92-F131 HydrophobicContact CB-CE2 4.44Å; L92-F131 HydrophobicContact CD2-CD2 4.12Å; L92-F131 HydrophobicContact CD2-CE1 4.48Å; L92-F131 HydrophobicContact CD2-CE2 3.69Å; L92-F131 HydrophobicContact CD2-CZ 3.89Å; L92-I160 HydrophobicContact CD2-CD1 4.47Å; L92-I160 HydrophobicContact CD2-CG2 4.38Å
93	H	88.8	Confident	85.6	Confident	49 Å²	49	23.8 Å²	23.8	23%	0.227	14%	0.144	C	C	.	.	H	α-helix	trans	-63.1	-45.2	174.1	-171.7	104.1	0	0	0	112.1	C89 Q90 M91 L95 S96 P97 V100 L102	C89-H93 PolarHBondContact O-N 3.46Å; C89-H93 VanDerWaalsContact O-N 3.12Å; Q90-H93 PolarHBondContact O-N 2.89Å; M91-H93 VanDerWaalsContact C-N 3.34Å; M91-H93 PolarHBondContact O-N 3.09Å; H93-L95 VanDerWaalsContact C-N 3.31Å; H93-L95 PolarHBondContact O-N 3.12Å; H93-S96 CarbonylContact O-C 3.36Å; H93-S96 PolarHBondContact O-N 3.44Å; H93-P97 WeakPolarHBondContact O-CA 3.2Å; H93-V100 PolarHBondContact ND1-O 3.2Å; H93-V100 VanDerWaalsContact ND1-O 3.17Å; H93-L102 HydrophobicContact CB-CD2 4.08Å; H93-L102 HydrophobicContact CB-CG 4.46Å
94	N	88.6	Confident	84.6	Confident	42 Å²	42	28.8 Å²	28.8	23%	0.225	17%	0.168	C	C	.	.	H	α-helix	trans	-62.2	-37.3	177	-74.5	7.3	0	0	0	111.9	C59 K60 Q90 M91 K169	C59-N94 WeakPolarHBondContact O-CB 3.45Å; C59-N94 PolarHBondContact O-ND2 2.92Å; K60-N94 PolarHBondContact O-ND2 2.77Å; Q90-N94 PolarHBondContact NE2-OD1 3.1Å; Q90-N94 WeakPolarHBondContact O-CB 3.4Å; Q90-N94 VanDerWaalsContact O-CG 3.26Å; Q90-N94 PolarHBondContact O-N 2.89Å; Q90-N94 PolarHBondContact O-OD1 3.32Å; M91-N94 PolarHBondContact O-N 3.33Å; N94-K169 PolarHBondContact O-NZ 3.37Å
95	L	89.1	Confident	84.2	Confident	3 Å²	3	29.2 Å²	29.2	2%	0.016	17%	0.17	C	C	.	.	H	α-helix	trans	-71.9	-45.4	174.9	-71.2	171.8	0	0	0	111.8	W55 M91 L92 H93 F131 I160 I165 A166 K169 I171	W55-L95 HydrophobicContact CH2-CD1 4.14Å; W55-L95 HydrophobicContact CZ2-CD1 4.13Å; M91-L95 HydrophobicContact CE-CD1 4.17Å; M91-L95 HydrophobicContact CG-CD1 4.15Å; M91-L95 WeakPolarHBondContact O-CB 3.26Å; M91-L95 VanDerWaalsContact O-CG 3.28Å; M91-L95 WeakPolarHBondContact O-CG 3.33Å; M91-L95 PolarHBondContact O-N 3.42Å; L92-L95 PolarHBondContact O-N 2.95Å; H93-L95 VanDerWaalsContact C-N 3.31Å; H93-L95 PolarHBondContact O-N 3.12Å; L95-F131 HydrophobicContact CB-CZ 4.22Å; L95-F131 HydrophobicContact CD1-CE1 4.41Å; L95-I160 HydrophobicContact CD1-CG2 3.87Å; L95-I165 HydrophobicContact CB-CG2 4.42Å; L95-A166 HydrophobicContact CD2-CB 3.87Å; L95-K169 WeakPolarHBondContact O-CE 3.44Å; L95-K169 PolarHBondContact O-NZ 3.44Å; L95-I171 HydrophobicContact CD2-CD1 4.03Å
96	S	87.3	Confident	83.2	Confident	34 Å²	34	30.6 Å²	30.6	24%	0.238	18%	0.178	C	C	.	.	S	Bend	trans	-137.5	97.1	-179.2	-173.9	0	0	0	0	110.2	L92 H93 G98 S99	L92-S96 PolarHBondContact O-N 3.16Å; H93-S96 CarbonylContact O-C 3.36Å; H93-S96 PolarHBondContact O-N 3.44Å; S96-G98 PolarHBondContact O-N 3.01Å; S96-S99 WeakPolarHBondContact O-CB 3.38Å; S96-S99 PolarHBondContact O-N 2.83Å; S96-S99 PolarHBondContact O-OG 3.25Å
97	P	83.8	Confident	82.3	Confident	93 Å²	93	33.7 Å²	33.7	60%	0.604	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.2	133.2	179.4	-27.6	36.4	0	0	0	111.4	H93 S99	H93-P97 WeakPolarHBondContact O-CA 3.2Å; P97-S99 VanDerWaalsContact C-N 3.28Å; P97-S99 PolarHBondContact O-N 2.81Å
98	G	78.8	Confident	81.1	Confident	61 Å²	61	42 Å²	42	63%	0.629	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.5	9	-173.8	0	0	0	0	0	115.3	S96	S96-G98 PolarHBondContact O-N 3.01Å
99	S	84.6	Confident	79.5	Confident	11 Å²	11	42 Å²	42	8%	0.077	22%	0.223	C	C	.	.	S	Bend	trans	-73.8	-32.9	167	65.2	0	0	0	0	112.6	L92 S96 P97 V126	L92-S99 PolarHBondContact O-OG 2.88Å; S96-S99 WeakPolarHBondContact O-CB 3.38Å; S96-S99 PolarHBondContact O-N 2.83Å; S96-S99 PolarHBondContact O-OG 3.25Å; P97-S99 VanDerWaalsContact C-N 3.28Å; P97-S99 PolarHBondContact O-N 2.81Å; S99-V126 WeakPolarHBondContact O-CG1 3.23Å; S99-V126 VanDerWaalsContact O-CG2 3.31Å; S99-V126 WeakPolarHBondContact O-CG2 3.22Å
100	V	84.8	Confident	78.3	Confident	2 Å²	2	50.2 Å²	50.2	1%	0.012	26%	0.261	C	S	.	.	S	Bend	trans	-118.7	129.8	169.9	-175.8	0	0	0	0	108	C89 L92 H93 L102 I105 T122 V126	C89-V100 HydrophobicContact CB-CG1 4.16Å; L92-V100 HydrophobicContact CB-CG2 3.72Å; L92-V100 HydrophobicContact CD1-CG2 4.19Å; H93-V100 PolarHBondContact ND1-O 3.2Å; H93-V100 VanDerWaalsContact ND1-O 3.17Å; V100-L102 PolarHBondContact O-N 3.17Å; V100-I105 HydrophobicContact CG1-CD1 3.88Å; V100-I105 HydrophobicContact CG1-CG1 3.91Å; V100-T122 HydrophobicContact CG1-CG2 4.23Å; V100-V126 HydrophobicContact CG2-CB 4.31Å; V100-V126 HydrophobicContact CG2-CG1 4.1Å; V100-V126 HydrophobicContact CG2-CG2 4.12Å
101	D	76.9	Confident	77.5	Confident	85 Å²	85	52.2 Å²	52.2	46%	0.455	27%	0.271	S	S	.	.			trans	-76.7	107.7	162.7	-177.1	8.3	0	0	0	108.8	K103 E104	D101-K103 PolarHBondContact O-N 2.86Å; D101-K103 VanDerWaalsContact OD1-CB 3.24Å; D101-K103 WeakPolarHBondContact OD1-CB 3.41Å; D101-K103 WeakPolarHBondContact OD1-CG 3.3Å; D101-K103 PolarHBondContact OD1-N 3.18Å; D101-E104 HydrophobicContact CB-CG 4.3Å; D101-E104 PolarHBondContact O-N 2.84Å; D101-E104 VanDerWaalsContact O-N 3.16Å
102	L	73	Confident	76.5	Confident	25 Å²	25	52.6 Å²	52.6	13%	0.131	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-61.2	-25	176.8	-65.8	-178.7	0	0	0	111.7	H93 V100 E104 I105 F107	H93-L102 HydrophobicContact CB-CD2 4.08Å; H93-L102 HydrophobicContact CB-CG 4.46Å; V100-L102 PolarHBondContact O-N 3.17Å; L102-E104 PolarHBondContact O-N 2.96Å; L102-I105 PolarHBondContact O-N 2.87Å; L102-I105 VanDerWaalsContact O-N 3.1Å; L102-F107 HydrophobicContact CB-CE2 4.28Å; L102-F107 HydrophobicContact CB-CZ 3.92Å; L102-F107 HydrophobicContact CD1-CZ 4.46Å; L102-F107 HydrophobicContact CD2-CZ 4.15Å; L102-F107 HydrophobicContact CG-CZ 4.38Å; L102-F107 WeakPolarHBondContact O-CE2 2.96Å
103	K	63.6	Low	76	Confident	68 Å²	68	53.2 Å²	53.2	30%	0.296	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-73.8	-2.8	178.6	-50	-175.5	179	-173.9	0	113.8	D101 K341 D344	D101-K103 PolarHBondContact O-N 2.86Å; D101-K103 VanDerWaalsContact OD1-CB 3.24Å; D101-K103 WeakPolarHBondContact OD1-CB 3.41Å; D101-K103 WeakPolarHBondContact OD1-CG 3.3Å; D101-K103 PolarHBondContact OD1-N 3.18Å; K103-K341 VanDerWaalsContact CB-CE 3.46Å; K103-K341 HydrophobicContact CD-CG 4.37Å; K103-K341 PolarHBondContact O-NZ 3.2Å; K103-D344 IonicContact NZ-OD2 2.76Å; K103-D344 PolarHBondContact NZ-OD2 2.83Å
104	E	68.8	Low	75.3	Confident	117 Å²	117	51.9 Å²	51.9	55%	0.547	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-99.7	-15.3	168.1	-65.4	-161.2	142	0	0	114	D101 L102	D101-E104 HydrophobicContact CB-CG 4.3Å; D101-E104 PolarHBondContact O-N 2.84Å; D101-E104 VanDerWaalsContact O-N 3.16Å; L102-E104 PolarHBondContact O-N 2.96Å
105	I	76.9	Confident	74.7	Confident	13 Å²	13	50.3 Å²	50.3	7%	0.067	26%	0.261	C	S	.	.	S	Bend	trans	-82.8	140.4	-174.7	-56.5	-53.9	0	0	0	111	C89 V100 L102 F107 T122	C89-I105 HydrophobicContact CB-CD1 3.85Å; C89-I105 HydrophobicContact CB-CG1 3.98Å; C89-I105 HydrophobicContact CB-CG2 4.38Å; C89-I105 WeakPolarHBondContact SG-CD1 3.45Å; V100-I105 HydrophobicContact CG1-CD1 3.88Å; V100-I105 HydrophobicContact CG1-CG1 3.91Å; L102-I105 PolarHBondContact O-N 2.87Å; L102-I105 VanDerWaalsContact O-N 3.1Å; I105-F107 PolarHBondContact O-N 3.23Å; I105-T122 HydrophobicContact CD1-CG2 3.77Å
106	N	66.6	Low	74.5	Confident	30 Å²	30	50.1 Å²	50.1	16%	0.16	26%	0.26	C	S	.	.			trans	-90.2	93.4	171.6	-63.9	-83.8	0	0	0	109.1	V86 R108 P109 L115 N119	V86-N106 VanDerWaalsContact CG2-O 3.27Å; V86-N106 WeakPolarHBondContact CG2-O 3.4Å; N106-R108 VanDerWaalsContact C-N 3.27Å; N106-R108 PolarHBondContact O-N 3.04Å; N106-P109 HydrophobicContact CB-CB 4.33Å; N106-P109 WeakPolarHBondContact O-CD 3.21Å; N106-L115 HydrophobicContact CB-CB 4.34Å; N106-N119 PolarHBondContact N-OD1 2.81Å; N106-N119 PolarHBondContact O-ND2 2.82Å
107	F	69.7	Low	74.4	Confident	65 Å²	65	48.5 Å²	48.5	29%	0.285	25%	0.249	S	C	.	.	S	Bend	trans	-62.5	-27	-178.5	-76.4	-74.5	0	0	0	115.1	V86 L102 I105 V208	V86-F107 HydrophobicContact CG1-CD1 3.65Å; V86-F107 HydrophobicContact CG1-CE1 4.27Å; L102-F107 HydrophobicContact CB-CE2 4.28Å; L102-F107 HydrophobicContact CB-CZ 3.92Å; L102-F107 HydrophobicContact CD1-CZ 4.46Å; L102-F107 HydrophobicContact CD2-CZ 4.15Å; L102-F107 HydrophobicContact CG-CZ 4.38Å; L102-F107 WeakPolarHBondContact O-CE2 2.96Å; I105-F107 PolarHBondContact O-N 3.23Å; F107-V208 HydrophobicContact CD1-CG1 3.67Å; F107-V208 HydrophobicContact CE1-CG1 3.54Å
108	R	64.8	Low	74.3	Confident	176 Å²	176	46.6 Å²	46.6	66%	0.664	23%	0.231	S	C	*	.			trans	-126	77.2	173.6	-66	-173.9	-178.7	-168.5	-0.6	109.5	N106 Q110	N106-R108 VanDerWaalsContact C-N 3.27Å; N106-R108 PolarHBondContact O-N 3.04Å; R108-Q110 PolarHBondContact O-N 3.22Å
109	P	60.3	Low	74.7	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	20%	0.202	C	C	.	.			trans	-77.2	-7.2	-175.4	29.7	-29	0	0	0	113.1	D84 V86 N106 M111 S112 L115	D84-P109 HydrophobicContact CB-CG 3.75Å; V86-P109 HydrophobicContact CG2-CG 4.24Å; N106-P109 HydrophobicContact CB-CB 4.33Å; N106-P109 WeakPolarHBondContact O-CD 3.21Å; P109-M111 PolarHBondContact O-N 3.46Å; P109-S112 WeakPolarHBondContact O-CB 3.35Å; P109-S112 PolarHBondContact O-N 3.08Å; P109-L115 HydrophobicContact CB-CB 3.66Å; P109-L115 HydrophobicContact CB-CD1 4.36Å
110	Q	66.4	Low	75.1	Confident	171 Å²	171	43.2 Å²	43.2	80%	0.799	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	55	34.9	177.2	-58.7	-179.9	-42.6	0	0	113.3	R108 S112	R108-Q110 PolarHBondContact O-N 3.22Å; Q110-S112 PolarHBondContact O-N 3.06Å
111	M	68.6	Low	75.4	Confident	52 Å²	52	45.6 Å²	45.6	26%	0.256	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.9	19.4	-172.2	-147.9	59.1	71.6	0	0	115.4	R83 P109 Q113 F145	R83-M111 HydrophobicContact CG-SD 4.12Å; P109-M111 PolarHBondContact O-N 3.46Å; M111-Q113 PolarHBondContact O-N 2.99Å; M111-Q113 VanDerWaalsContact O-N 3.12Å; M111-F145 HydrophobicContact SD-CE2 4.05Å
112	S	74.1	Confident	76	Confident	8 Å²	8	42.8 Å²	42.8	6%	0.056	19%	0.192	C	C	.	.			trans	-61.7	111.5	170.5	177.2	0	0	0	0	109.1	P109 Q110 F114 L115 C116 K431 D455	P109-S112 WeakPolarHBondContact O-CB 3.35Å; P109-S112 PolarHBondContact O-N 3.08Å; Q110-S112 PolarHBondContact O-N 3.06Å; S112-F114 PolarHBondContact O-N 3.5Å; S112-F114 VanDerWaalsContact O-N 3.14Å; S112-L115 PolarHBondContact O-N 3.46Å; S112-C116 PolarHBondContact O-N 3.47Å; S112-C116 PolarHBondContact O-SG 2.82Å; S112-K431 VanDerWaalsContact CB-NZ 3.26Å; S112-K431 WeakPolarHBondContact OG-CE 3.45Å; S112-K431 PolarHBondContact OG-NZ 3.48Å; S112-D455 WeakPolarHBondContact CB-OD1 3.44Å; S112-D455 VanDerWaalsContact OG-CG 3.27Å; S112-D455 PolarHBondContact OG-OD1 2.91Å; S112-D455 PolarHBondContact OG-OD2 3.35Å
113	Q	79.6	Confident	77.1	Confident	13 Å²	13	41.6 Å²	41.6	6%	0.061	19%	0.186	C	C	.	.	H	α-helix	trans	-55.1	-38	-172.2	179.2	169.2	58	0	0	111.5	M111 L117 F145 D455 Y472	M111-Q113 PolarHBondContact O-N 2.99Å; M111-Q113 VanDerWaalsContact O-N 3.12Å; Q113-L117 HydrophobicContact CG-CD1 3.58Å; Q113-L117 HydrophobicContact CG-CG 4.22Å; Q113-L117 WeakPolarHBondContact O-CB 3.44Å; Q113-L117 WeakPolarHBondContact O-CD1 3.43Å; Q113-L117 WeakPolarHBondContact O-CG 3.26Å; Q113-L117 PolarHBondContact O-N 2.71Å; Q113-F145 HydrophobicContact CB-CE1 3.86Å; Q113-F145 HydrophobicContact CB-CE2 4.45Å; Q113-F145 HydrophobicContact CB-CZ 3.69Å; Q113-F145 HydrophobicContact CG-CD1 3.97Å; Q113-F145 HydrophobicContact CG-CE1 3.49Å; Q113-F145 VanDerWaalsContact CG-CE1 3.49Å; Q113-F145 HydrophobicContact CG-CZ 3.82Å; Q113-D455 PolarHBondContact N-OD2 3.04Å; Q113-D455 VanDerWaalsContact N-OD2 3.11Å; Q113-Y472 HydrophobicContact CG-CE2 4.41Å; Q113-Y472 VanDerWaalsContact OE1-CE2 3.28Å
114	F	75.8	Confident	78.5	Confident	20 Å²	20	39.2 Å²	39.2	9%	0.088	18%	0.177	C	C	.	.	H	α-helix	trans	-59.3	-46.3	173.9	-178.4	-82.9	0	0	0	113.1	S112 K118 E434 F435 D455 Y472 Y490	S112-F114 PolarHBondContact O-N 3.5Å; S112-F114 VanDerWaalsContact O-N 3.14Å; F114-K118 WeakPolarHBondContact O-CB 3.38Å; F114-K118 PolarHBondContact O-N 2.98Å; F114-E434 HydrophobicContact CE1-CB 4.17Å; F114-E434 HydrophobicContact CZ-CB 4.38Å; F114-F435 HydrophobicContact CB-CE1 3.76Å; F114-F435 HydrophobicContact CB-CZ 4.48Å; F114-F435 AromaticContact CD1-CD1 3.93Å; F114-F435 HydrophobicContact CD1-CD1 3.93Å; F114-F435 AromaticContact CD1-CE1 3.63Å; F114-F435 HydrophobicContact CD1-CE1 3.63Å; F114-F435 HydrophobicContact CD2-CD1 4.17Å; F114-F435 HydrophobicContact CD2-CE1 4.18Å; F114-F435 HydrophobicContact CE1-CD1 4.09Å; F114-F435 HydrophobicContact CE1-CE1 4.24Å; F114-F435 HydrophobicContact CE2-CD1 4.32Å; F114-F435 AromaticContact CG-CD1 3.98Å; F114-F435 HydrophobicContact CG-CD1 3.98Å; F114-F435 AromaticContact CG-CE1 3.6Å; F114-F435 HydrophobicContact CG-CE1 3.6Å; F114-F435 HydrophobicContact CZ-CD1 4.28Å; F114-D455 WeakPolarHBondContact CB-OD2 3.33Å; F114-D455 PolarHBondContact N-OD2 3.17Å; F114-Y472 PolarHBondContact N-OH 3.21Å; F114-Y490 AromaticContact CD2-CE2 3.87Å; F114-Y490 HydrophobicContact CD2-CE2 3.87Å; F114-Y490 AromaticContact CE2-CE2 3.99Å; F114-Y490 HydrophobicContact CE2-CE2 3.99Å
115	L	75.4	Confident	79.6	Confident	9 Å²	9	39.9 Å²	39.9	5%	0.047	18%	0.178	C	C	.	.	H	α-helix	trans	-75	-42.4	-175.6	-61.6	179.6	0	0	0	112.2	N106 P109 S112 K118 N119 K431	N106-L115 HydrophobicContact CB-CB 4.34Å; P109-L115 HydrophobicContact CB-CB 3.66Å; P109-L115 HydrophobicContact CB-CD1 4.36Å; S112-L115 PolarHBondContact O-N 3.46Å; L115-K118 WeakPolarHBondContact O-CB 3.39Å; L115-K118 PolarHBondContact O-N 3.41Å; L115-K118 VanDerWaalsContact O-N 3.17Å; L115-N119 PolarHBondContact O-N 2.98Å; L115-K431 HydrophobicContact CD1-CD 3.97Å
116	C	84.7	Confident	80.3	Confident	0 Å²	0	40 Å²	40	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-60.5	-47	174.5	-62.2	0	0	0	0	110.7	S112 K118 N119 I120 F145	S112-C116 PolarHBondContact O-N 3.47Å; S112-C116 PolarHBondContact O-SG 2.82Å; C116-K118 VanDerWaalsContact C-N 3.28Å; C116-K118 PolarHBondContact O-N 3.07Å; C116-N119 PolarHBondContact O-N 2.79Å; C116-I120 VanDerWaalsContact O-CG1 3.28Å; C116-I120 WeakPolarHBondContact O-CG1 3.41Å; C116-I120 PolarHBondContact O-N 2.97Å; C116-F145 HydrophobicContact CB-CD2 3.53Å; C116-F145 HydrophobicContact CB-CE2 3.49Å; C116-F145 VanDerWaalsContact CB-CE2 3.49Å
117	L	84.8	Confident	81.5	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-65.3	-28.6	175.7	-67.6	171.3	0	0	0	112.9	Q113 R121 P141 F142 F145	Q113-L117 HydrophobicContact CG-CD1 3.58Å; Q113-L117 HydrophobicContact CG-CG 4.22Å; Q113-L117 WeakPolarHBondContact O-CB 3.44Å; Q113-L117 WeakPolarHBondContact O-CD1 3.43Å; Q113-L117 WeakPolarHBondContact O-CG 3.26Å; Q113-L117 PolarHBondContact O-N 2.71Å; L117-R121 WeakPolarHBondContact O-CB 3.29Å; L117-R121 WeakPolarHBondContact O-CD 3.49Å; L117-R121 WeakPolarHBondContact O-CG 3.35Å; L117-R121 PolarHBondContact O-N 2.71Å; L117-P141 HydrophobicContact CD2-CB 3.63Å; L117-F142 HydrophobicContact CD1-CE1 3.63Å; L117-F142 HydrophobicContact CD1-CE2 4.24Å; L117-F142 HydrophobicContact CD1-CZ 3.44Å; L117-F142 VanDerWaalsContact CD1-CZ 3.44Å; L117-F142 HydrophobicContact CD2-CD1 4.33Å; L117-F142 HydrophobicContact CD2-CE1 4.19Å; L117-F142 HydrophobicContact CD2-CE2 4.4Å; L117-F142 HydrophobicContact CD2-CZ 4.21Å; L117-F145 HydrophobicContact CD2-CB 3.78Å; L117-F145 HydrophobicContact CD2-CG 4.16Å; L117-F145 HydrophobicContact CG-CG 4.4Å
118	K	81.9	Confident	82.6	Confident	53 Å²	53	39.5 Å²	39.5	23%	0.23	18%	0.176	C	C	.	.	H	α-helix	trans	-64.3	-52.3	171.4	-176.8	-175.4	175.3	-166.6	0	110.5	F114 L115 C116 I120 R121 T122 E434	F114-K118 WeakPolarHBondContact O-CB 3.38Å; F114-K118 PolarHBondContact O-N 2.98Å; L115-K118 WeakPolarHBondContact O-CB 3.39Å; L115-K118 PolarHBondContact O-N 3.41Å; L115-K118 VanDerWaalsContact O-N 3.17Å; C116-K118 VanDerWaalsContact C-N 3.28Å; C116-K118 PolarHBondContact O-N 3.07Å; K118-I120 PolarHBondContact O-N 3.14Å; K118-R121 PolarHBondContact O-N 3.04Å; K118-T122 PolarHBondContact O-N 3.15Å; K118-T122 PolarHBondContact O-OG1 2.94Å; K118-E434 IonicContact NZ-OE1 2.9Å; K118-E434 PolarHBondContact NZ-OE1 2.93Å; K118-E434 IonicContact NZ-OE2 2.74Å; K118-E434 PolarHBondContact NZ-OE2 2.87Å
119	N	87.8	Confident	83.8	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.005	17%	0.168	C	C	.	.	H	α-helix	trans	-56.5	-49.4	177.1	-65.2	-12.3	0	0	0	111.5	D84 V86 C89 N106 L115 C116 R121 T122 F123	D84-N119 VanDerWaalsContact O-CB 3.25Å; D84-N119 WeakPolarHBondContact O-CB 3.26Å; D84-N119 PolarHBondContact O-ND2 3.47Å; V86-N119 WeakPolarHBondContact CG2-ND2 3.48Å; C89-N119 PolarHBondContact SG-O 3.04Å; C89-N119 VanDerWaalsContact SG-O 3.4Å; N106-N119 PolarHBondContact N-OD1 2.81Å; N106-N119 PolarHBondContact O-ND2 2.82Å; L115-N119 PolarHBondContact O-N 2.98Å; C116-N119 PolarHBondContact O-N 2.79Å; N119-R121 VanDerWaalsContact C-N 3.32Å; N119-R121 PolarHBondContact O-N 3.34Å; N119-T122 WeakPolarHBondContact O-CB 3.05Å; N119-T122 PolarHBondContact O-N 3.38Å; N119-T122 VanDerWaalsContact O-N 3.08Å; N119-F123 PolarHBondContact O-N 3.14Å
120	I	93.4	Very high	85.1	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-59.7	-40.6	178.9	-64.6	163.7	0	0	0	111.7	C116 K118 F123 L124 F139 P141 L144 F145	C116-I120 VanDerWaalsContact O-CG1 3.28Å; C116-I120 WeakPolarHBondContact O-CG1 3.41Å; C116-I120 PolarHBondContact O-N 2.97Å; K118-I120 PolarHBondContact O-N 3.14Å; I120-F123 WeakPolarHBondContact O-CB 3.22Å; I120-F123 PolarHBondContact O-N 2.77Å; I120-L124 HydrophobicContact CG2-CD1 4.03Å; I120-L124 HydrophobicContact CG2-CG 4.41Å; I120-L124 WeakPolarHBondContact O-CG 3.27Å; I120-L124 PolarHBondContact O-N 3.09Å; I120-F139 HydrophobicContact CG2-CE2 3.86Å; I120-P141 HydrophobicContact CG2-CB 4.05Å; I120-L144 HydrophobicContact CD1-CB 4.44Å; I120-L144 HydrophobicContact CD1-CD2 3.95Å; I120-L144 HydrophobicContact CD1-CG 4.08Å; I120-L144 HydrophobicContact CG1-CD2 3.93Å; I120-L144 HydrophobicContact CG2-CD2 4.32Å; I120-F145 HydrophobicContact CD1-CB 4.04Å
121	R	90.8	Very high	86.1	Confident	52 Å²	52	33.6 Å²	33.6	20%	0.196	16%	0.157	C	C	.	.	H	α-helix	trans	-65.9	-37.1	175.4	-71.6	162.4	-167	153.4	0.4	112.2	L117 K118 N119 L124 K125 P141 Y488	L117-R121 WeakPolarHBondContact O-CB 3.29Å; L117-R121 WeakPolarHBondContact O-CD 3.49Å; L117-R121 WeakPolarHBondContact O-CG 3.35Å; L117-R121 PolarHBondContact O-N 2.71Å; K118-R121 PolarHBondContact O-N 3.04Å; N119-R121 VanDerWaalsContact C-N 3.32Å; N119-R121 PolarHBondContact O-N 3.34Å; R121-L124 PolarHBondContact O-N 3.19Å; R121-K125 VanDerWaalsContact O-CB 3.3Å; R121-K125 WeakPolarHBondContact O-CB 3.26Å; R121-K125 PolarHBondContact O-N 2.84Å; R121-P141 HydrophobicContact CG-CB 4.46Å; R121-P141 HydrophobicContact CG-CG 3.79Å; R121-Y488 HydrophobicContact CG-CE1 4.4Å
122	T	89.2	Confident	87	Confident	25 Å²	25	34 Å²	34	15%	0.153	18%	0.175	C	C	.	.	H	α-helix	trans	-63.5	-44.2	173.8	-58.8	0	0	0	0	111.2	V100 I105 K118 N119 K125 V126	V100-T122 HydrophobicContact CG1-CG2 4.23Å; I105-T122 HydrophobicContact CD1-CG2 3.77Å; K118-T122 PolarHBondContact O-N 3.15Å; K118-T122 PolarHBondContact O-OG1 2.94Å; N119-T122 WeakPolarHBondContact O-CB 3.05Å; N119-T122 PolarHBondContact O-N 3.38Å; N119-T122 VanDerWaalsContact O-N 3.08Å; T122-K125 PolarHBondContact O-N 2.76Å; T122-V126 WeakPolarHBondContact O-CG2 3.17Å; T122-V126 PolarHBondContact O-N 2.79Å; T122-V126 VanDerWaalsContact O-N 3.08Å
123	F	95.1	Very high	87.8	Confident	1 Å²	1	34 Å²	34	0%	0.004	17%	0.174	C	C	.	.	H	α-helix	trans	-55.4	-56.4	171.4	165	-96.6	0	0	0	111.8	L88 M91 L92 N119 I120 K125 V126 C127 F139 L157 I160	L88-F123 HydrophobicContact CB-CB 4.22Å; L88-F123 HydrophobicContact CB-CD1 4.43Å; L88-F123 HydrophobicContact CB-CD2 3.56Å; L88-F123 HydrophobicContact CB-CE2 3.98Å; L88-F123 HydrophobicContact CB-CG 3.81Å; L88-F123 HydrophobicContact CD1-CD1 4.13Å; L88-F123 HydrophobicContact CD1-CE1 4.24Å; L88-F123 HydrophobicContact CD1-CG 4.32Å; L88-F123 HydrophobicContact CD2-CE2 4.22Å; L88-F123 HydrophobicContact CD2-CZ 4.34Å; L88-F123 HydrophobicContact CG-CD2 4.5Å; L88-F123 WeakPolarHBondContact O-CD2 3.35Å; M91-F123 HydrophobicContact CE-CE2 3.87Å; L92-F123 HydrophobicContact CD1-CD2 3.38Å; L92-F123 HydrophobicContact CD1-CE2 3.88Å; L92-F123 HydrophobicContact CD1-CG 4.21Å; L92-F123 HydrophobicContact CD2-CD2 4.32Å; L92-F123 HydrophobicContact CD2-CE2 4Å; L92-F123 HydrophobicContact CG-CD2 3.71Å; L92-F123 HydrophobicContact CG-CE2 3.88Å; N119-F123 PolarHBondContact O-N 3.14Å; I120-F123 WeakPolarHBondContact O-CB 3.22Å; I120-F123 PolarHBondContact O-N 2.77Å; F123-K125 VanDerWaalsContact C-N 3.3Å; F123-K125 PolarHBondContact O-N 3.22Å; F123-V126 PolarHBondContact O-N 3.17Å; F123-C127 VanDerWaalsContact CE2-SG 3.52Å; F123-C127 WeakPolarHBondContact CZ-SG 3.38Å; F123-C127 PolarHBondContact O-N 3.47Å; F123-C127 PolarHBondContact O-SG 2.93Å; F123-F139 HydrophobicContact CD1-CE1 4.45Å; F123-F139 AromaticContact CD1-CZ 3.99Å; F123-F139 HydrophobicContact CD1-CZ 3.99Å; F123-F139 AromaticContact CE1-CE1 3.65Å; F123-F139 HydrophobicContact CE1-CE1 3.65Å; F123-F139 AromaticContact CE1-CZ 3.61Å; F123-F139 HydrophobicContact CE1-CZ 3.61Å; F123-L157 HydrophobicContact CE2-CD2 4.38Å; F123-L157 HydrophobicContact CZ-CD2 3.98Å; F123-I160 HydrophobicContact CE2-CD1 4.17Å; F123-I160 HydrophobicContact CZ-CD1 3.82Å
124	L	94.1	Very high	88.2	Confident	17 Å²	17	40.8 Å²	40.8	9%	0.089	20%	0.199	C	C	.	.	H	α-helix	trans	-59.7	-39	-177.6	-68.7	170	0	0	0	112.5	I120 R121 C127 H128 L138 F139 P141	I120-L124 HydrophobicContact CG2-CD1 4.03Å; I120-L124 HydrophobicContact CG2-CG 4.41Å; I120-L124 WeakPolarHBondContact O-CG 3.27Å; I120-L124 PolarHBondContact O-N 3.09Å; R121-L124 PolarHBondContact O-N 3.19Å; L124-C127 WeakPolarHBondContact O-CB 3.34Å; L124-C127 PolarHBondContact O-N 2.88Å; L124-H128 PolarHBondContact O-N 3.47Å; L124-H128 VanDerWaalsContact O-N 3.08Å; L124-L138 HydrophobicContact CD2-CB 4.21Å; L124-L138 HydrophobicContact CD2-CD2 3.99Å; L124-F139 HydrophobicContact CD1-CD2 4.38Å; L124-F139 HydrophobicContact CD1-CE2 4.3Å; L124-F139 VanDerWaalsContact CD1-O 3.32Å; L124-F139 WeakPolarHBondContact CD1-O 3.24Å; L124-F139 HydrophobicContact CD2-CD1 4Å; L124-F139 HydrophobicContact CD2-CD2 4.1Å; L124-F139 HydrophobicContact CD2-CE1 3.87Å; L124-F139 HydrophobicContact CD2-CE2 3.95Å; L124-F139 HydrophobicContact CD2-CG 4.12Å; L124-F139 HydrophobicContact CD2-CZ 3.85Å; L124-F139 HydrophobicContact CG-CE2 4.36Å; L124-F139 HydrophobicContact CG-CZ 4.48Å; L124-P141 HydrophobicContact CD1-CG 3.84Å
125	K	90.9	Very high	88.7	Confident	132 Å²	132	45.9 Å²	45.9	57%	0.574	23%	0.227	S	C	*	.	H	α-helix	trans	-60.8	-45.7	174.3	180	-174.3	172.8	-164.8	0	111.5	R121 T122 F123 H128 D129	R121-K125 VanDerWaalsContact O-CB 3.3Å; R121-K125 WeakPolarHBondContact O-CB 3.26Å; R121-K125 PolarHBondContact O-N 2.84Å; T122-K125 PolarHBondContact O-N 2.76Å; F123-K125 VanDerWaalsContact C-N 3.3Å; F123-K125 PolarHBondContact O-N 3.22Å; K125-H128 WeakPolarHBondContact O-CB 3.27Å; K125-H128 PolarHBondContact O-N 3.15Å; K125-D129 WeakPolarHBondContact CE-OD2 3.49Å; K125-D129 WeakPolarHBondContact CG-OD2 3.41Å; K125-D129 WeakPolarHBondContact O-CB 3.36Å; K125-D129 VanDerWaalsContact O-CG 3.3Å; K125-D129 PolarHBondContact O-N 2.89Å
126	V	92.1	Very high	89.2	Confident	15 Å²	15	50.2 Å²	50.2	9%	0.091	26%	0.258	C	S	.	.	H	α-helix	trans	-71.2	-32	179.5	176.4	0	0	0	0	111.4	L92 S99 V100 T122 F123 H128 D129 K130 F131	L92-V126 HydrophobicContact CD1-CB 3.8Å; L92-V126 HydrophobicContact CD1-CG1 3.77Å; S99-V126 WeakPolarHBondContact O-CG1 3.23Å; S99-V126 VanDerWaalsContact O-CG2 3.31Å; S99-V126 WeakPolarHBondContact O-CG2 3.22Å; V100-V126 HydrophobicContact CG2-CB 4.31Å; V100-V126 HydrophobicContact CG2-CG1 4.1Å; V100-V126 HydrophobicContact CG2-CG2 4.12Å; T122-V126 WeakPolarHBondContact O-CG2 3.17Å; T122-V126 PolarHBondContact O-N 2.79Å; T122-V126 VanDerWaalsContact O-N 3.08Å; F123-V126 PolarHBondContact O-N 3.17Å; V126-H128 VanDerWaalsContact C-N 3.32Å; V126-H128 PolarHBondContact O-N 2.82Å; V126-D129 PolarHBondContact O-N 2.84Å; V126-K130 HydrophobicContact CG1-CB 4.05Å; V126-K130 HydrophobicContact CG1-CG 3.93Å; V126-K130 WeakPolarHBondContact O-CA 3.29Å; V126-K130 WeakPolarHBondContact O-CB 2.96Å; V126-K130 PolarHBondContact O-N 3.39Å; V126-F131 HydrophobicContact CG1-CE2 4.44Å; V126-F131 PolarHBondContact O-N 2.98Å
127	C	92.8	Very high	89.3	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-59.9	-40.1	169.9	-67	0	0	0	0	112.8	F123 L124 F131 G132 L133 L138 I160	F123-C127 VanDerWaalsContact CE2-SG 3.52Å; F123-C127 WeakPolarHBondContact CZ-SG 3.38Å; F123-C127 PolarHBondContact O-N 3.47Å; F123-C127 PolarHBondContact O-SG 2.93Å; L124-C127 WeakPolarHBondContact O-CB 3.34Å; L124-C127 PolarHBondContact O-N 2.88Å; C127-F131 CarbonylContact O-C 3.59Å; C127-F131 VanDerWaalsContact O-C 3.3Å; C127-F131 WeakPolarHBondContact O-CA 3.18Å; C127-F131 WeakPolarHBondContact O-CB 3.47Å; C127-F131 PolarHBondContact O-N 3.15Å; C127-G132 PolarHBondContact O-N 3.2Å; C127-L133 HydrophobicContact CB-CD1 4.47Å; C127-L133 HydrophobicContact CB-CD2 4.35Å; C127-L133 PolarHBondContact O-N 2.83Å; C127-L133 VanDerWaalsContact O-N 3.11Å; C127-L138 HydrophobicContact CB-CD2 3.75Å; C127-I160 VanDerWaalsContact SG-CD1 3.54Å
128	H	92.4	Very high	89.5	Confident	84 Å²	84	53.3 Å²	53.3	39%	0.389	27%	0.273	S	S	.	.	H	α-helix	trans	-68.2	-59.2	171.4	-179.7	-92.2	0	0	0	111.4	L124 K125 V126 K130 G132 L138	L124-H128 PolarHBondContact O-N 3.47Å; L124-H128 VanDerWaalsContact O-N 3.08Å; K125-H128 WeakPolarHBondContact O-CB 3.27Å; K125-H128 PolarHBondContact O-N 3.15Å; V126-H128 VanDerWaalsContact C-N 3.32Å; V126-H128 PolarHBondContact O-N 2.82Å; H128-K130 PolarHBondContact O-N 3.06Å; H128-G132 WeakPolarHBondContact O-CA 3.36Å; H128-G132 PolarHBondContact O-N 2.99Å; H128-L138 HydrophobicContact CB-CD1 4.19Å
129	D	90	Very high	90	Very high	93 Å²	93	51 Å²	51	50%	0.497	26%	0.264	S	S	.	.	H	α-helix	trans	-74.5	-21.5	-166.6	-66.1	-9.7	0	0	0	114.6	K125 V126	K125-D129 WeakPolarHBondContact CE-OD2 3.49Å; K125-D129 WeakPolarHBondContact CG-OD2 3.41Å; K125-D129 WeakPolarHBondContact O-CB 3.36Å; K125-D129 VanDerWaalsContact O-CG 3.3Å; K125-D129 PolarHBondContact O-N 2.89Å; V126-D129 PolarHBondContact O-N 2.84Å
130	K	87.4	Confident	90.2	Very high	124 Å²	124	54.9 Å²	54.9	54%	0.539	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.9	-30.5	-177.3	-62.9	-68.5	-172.8	170.8	0	114.7	V126 H128	V126-K130 HydrophobicContact CG1-CB 4.05Å; V126-K130 HydrophobicContact CG1-CG 3.93Å; V126-K130 WeakPolarHBondContact O-CA 3.29Å; V126-K130 WeakPolarHBondContact O-CB 2.96Å; V126-K130 PolarHBondContact O-N 3.39Å; H128-K130 PolarHBondContact O-N 3.06Å
131	F	88.1	Confident	90	Very high	6 Å²	6	55.5 Å²	55.5	3%	0.026	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	-2.2	-179.5	-66.2	-105.5	0	0	0	112.9	L92 L95 V126 C127 L133 I160 H163 I165	L92-F131 HydrophobicContact CB-CE2 4.44Å; L92-F131 HydrophobicContact CD2-CD2 4.12Å; L92-F131 HydrophobicContact CD2-CE1 4.48Å; L92-F131 HydrophobicContact CD2-CE2 3.69Å; L92-F131 HydrophobicContact CD2-CZ 3.89Å; L95-F131 HydrophobicContact CB-CZ 4.22Å; L95-F131 HydrophobicContact CD1-CE1 4.41Å; V126-F131 HydrophobicContact CG1-CE2 4.44Å; V126-F131 PolarHBondContact O-N 2.98Å; C127-F131 CarbonylContact O-C 3.59Å; C127-F131 VanDerWaalsContact O-C 3.3Å; C127-F131 WeakPolarHBondContact O-CA 3.18Å; C127-F131 WeakPolarHBondContact O-CB 3.47Å; C127-F131 PolarHBondContact O-N 3.15Å; F131-L133 VanDerWaalsContact C-N 3.3Å; F131-L133 HydrophobicContact CB-CD1 3.74Å; F131-L133 PolarHBondContact O-N 3.12Å; F131-I160 HydrophobicContact CD1-CG2 4.02Å; F131-I160 HydrophobicContact CE1-CG2 4.05Å; F131-H163 HydrophobicContact CD1-CB 4.24Å; F131-H163 AromaticContact CD1-CG 3.97Å; F131-H163 AromaticContact CD1-ND1 3.5Å; F131-I165 HydrophobicContact CD1-CD1 4.4Å; F131-I165 HydrophobicContact CE1-CB 4.18Å; F131-I165 HydrophobicContact CE1-CD1 4.16Å; F131-I165 HydrophobicContact CE1-CG2 4.11Å; F131-I165 HydrophobicContact CZ-CD1 4.41Å; F131-I165 HydrophobicContact CZ-CG2 4.36Å
132	G	87.3	Confident	89.7	Confident	60 Å²	60	53.4 Å²	53.4	62%	0.619	28%	0.281	S	S	*	.			trans	71.4	15.7	170.5	0	0	0	0	0	115.6	C127 H128 R134	C127-G132 PolarHBondContact O-N 3.2Å; H128-G132 WeakPolarHBondContact O-CA 3.36Å; H128-G132 PolarHBondContact O-N 2.99Å; G132-R134 PolarHBondContact O-N 2.95Å
133	L	90.1	Very high	89.6	Confident	8 Å²	8	53.1 Å²	53.1	4%	0.042	28%	0.278	C	S	.	.			trans	-65.1	130.3	177.2	-82.5	73.8	0	0	0	110.1	C127 F131 L138 A156 R159 I160	C127-L133 HydrophobicContact CB-CD1 4.47Å; C127-L133 HydrophobicContact CB-CD2 4.35Å; C127-L133 PolarHBondContact O-N 2.83Å; C127-L133 VanDerWaalsContact O-N 3.11Å; F131-L133 VanDerWaalsContact C-N 3.3Å; F131-L133 HydrophobicContact CB-CD1 3.74Å; F131-L133 PolarHBondContact O-N 3.12Å; L133-L138 HydrophobicContact CB-CD2 3.78Å; L133-L138 HydrophobicContact CB-CG 4.26Å; L133-L138 HydrophobicContact CD2-CD2 3.92Å; L133-A156 HydrophobicContact CD2-CB 4.41Å; L133-R159 HydrophobicContact CD2-CB 4.49Å; L133-I160 HydrophobicContact CD1-CG1 4Å; L133-I160 HydrophobicContact CD2-CD1 4.41Å; L133-I160 HydrophobicContact CD2-CG1 4.19Å
134	R	88.6	Confident	89.4	Confident	156 Å²	156	53.1 Å²	53.1	59%	0.589	28%	0.278	S	S	*	.			trans	-74	156.2	177.6	-61.2	171.7	-72	174.8	-2.1	110.3	G132 S136 E137 L138	G132-R134 PolarHBondContact O-N 2.95Å; R134-S136 PolarHBondContact O-N 2.62Å; R134-E137 HydrophobicContact CB-CG 4.39Å; R134-E137 VanDerWaalsContact CB-OE2 3.31Å; R134-E137 WeakPolarHBondContact CB-OE2 3.46Å; R134-E137 WeakPolarHBondContact CG-OE2 3.27Å; R134-E137 IonicContact CZ-OE1 3.57Å; R134-E137 IonicContact CZ-OE2 3.81Å; R134-E137 PolarHBondContact N-OE2 3.47Å; R134-E137 VanDerWaalsContact N-OE2 3.16Å; R134-E137 VanDerWaalsContact NE-CD 3.34Å; R134-E137 IonicContact NE-OE1 2.72Å; R134-E137 IonicContact NE-OE2 2.7Å; R134-E137 PolarHBondContact NE-OE2 2.68Å; R134-E137 IonicContact NH2-OE1 3.69Å; R134-E137 PolarHBondContact NH2-OE1 2.9Å; R134-E137 IonicContact NH2-OE2 3.07Å; R134-E137 PolarHBondContact NH2-OE2 3.32Å; R134-E137 WeakPolarHBondContact O-CA 3.44Å; R134-E137 WeakPolarHBondContact O-CB 3.45Å; R134-E137 PolarHBondContact O-N 3.03Å; R134-L138 PolarHBondContact O-N 3.09Å
135	N	85.6	Confident	89	Confident	128 Å²	128	53 Å²	53	68%	0.684	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-17.4	176.7	-66.3	-18.6	0	0	0	114.7
136	S	85.4	Confident	88.4	Confident	99 Å²	99	47.2 Å²	47.2	69%	0.692	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-3.2	172.8	57.5	0	0	0	0	114.4	R134	R134-S136 PolarHBondContact O-N 2.62Å
137	E	86.6	Confident	88	Confident	35 Å²	35	46.6 Å²	46.6	16%	0.164	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.3	-1.8	-176.2	-60.6	175.6	125.5	0	0	112	R134 R159	R134-E137 HydrophobicContact CB-CG 4.39Å; R134-E137 VanDerWaalsContact CB-OE2 3.31Å; R134-E137 WeakPolarHBondContact CB-OE2 3.46Å; R134-E137 WeakPolarHBondContact CG-OE2 3.27Å; R134-E137 IonicContact CZ-OE1 3.57Å; R134-E137 IonicContact CZ-OE2 3.81Å; R134-E137 PolarHBondContact N-OE2 3.47Å; R134-E137 VanDerWaalsContact N-OE2 3.16Å; R134-E137 VanDerWaalsContact NE-CD 3.34Å; R134-E137 IonicContact NE-OE1 2.72Å; R134-E137 IonicContact NE-OE2 2.7Å; R134-E137 PolarHBondContact NE-OE2 2.68Å; R134-E137 IonicContact NH2-OE1 3.69Å; R134-E137 PolarHBondContact NH2-OE1 2.9Å; R134-E137 IonicContact NH2-OE2 3.07Å; R134-E137 PolarHBondContact NH2-OE2 3.32Å; R134-E137 WeakPolarHBondContact O-CA 3.44Å; R134-E137 WeakPolarHBondContact O-CB 3.45Å; R134-E137 PolarHBondContact O-N 3.03Å; E137-R159 IonicContact OE1-NE 2.71Å; E137-R159 PolarHBondContact OE1-NE 3.03Å
138	L	89.8	Confident	87.4	Confident	30 Å²	30	51.7 Å²	51.7	16%	0.157	27%	0.268	C	S	.	.	S	Bend	trans	-94.6	146.3	170.8	-63.9	174.5	0	0	0	109.2	L124 C127 H128 L133 R134	L124-L138 HydrophobicContact CD2-CB 4.21Å; L124-L138 HydrophobicContact CD2-CD2 3.99Å; C127-L138 HydrophobicContact CB-CD2 3.75Å; H128-L138 HydrophobicContact CB-CD1 4.19Å; L133-L138 HydrophobicContact CB-CD2 3.78Å; L133-L138 HydrophobicContact CB-CG 4.26Å; L133-L138 HydrophobicContact CD2-CD2 3.92Å; R134-L138 PolarHBondContact O-N 3.09Å
139	F	93.4	Very high	86.8	Confident	6 Å²	6	50.3 Å²	50.3	3%	0.026	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-85.8	155.9	170.6	57	-94.9	0	0	0	111.1	L88 I120 F123 L124 D143 L144 K152 V153 A156	L88-F139 HydrophobicContact CD1-CZ 4.3Å; I120-F139 HydrophobicContact CG2-CE2 3.86Å; F123-F139 HydrophobicContact CD1-CE1 4.45Å; F123-F139 AromaticContact CD1-CZ 3.99Å; F123-F139 HydrophobicContact CD1-CZ 3.99Å; F123-F139 AromaticContact CE1-CE1 3.65Å; F123-F139 HydrophobicContact CE1-CE1 3.65Å; F123-F139 AromaticContact CE1-CZ 3.61Å; F123-F139 HydrophobicContact CE1-CZ 3.61Å; L124-F139 HydrophobicContact CD1-CD2 4.38Å; L124-F139 HydrophobicContact CD1-CE2 4.3Å; L124-F139 VanDerWaalsContact CD1-O 3.32Å; L124-F139 WeakPolarHBondContact CD1-O 3.24Å; L124-F139 HydrophobicContact CD2-CD1 4Å; L124-F139 HydrophobicContact CD2-CD2 4.1Å; L124-F139 HydrophobicContact CD2-CE1 3.87Å; L124-F139 HydrophobicContact CD2-CE2 3.95Å; L124-F139 HydrophobicContact CD2-CG 4.12Å; L124-F139 HydrophobicContact CD2-CZ 3.85Å; L124-F139 HydrophobicContact CG-CE2 4.36Å; L124-F139 HydrophobicContact CG-CZ 4.48Å; F139-D143 HydrophobicContact CB-CB 4.03Å; F139-L144 HydrophobicContact CD2-CB 4.14Å; F139-L144 HydrophobicContact CE2-CB 3.7Å; F139-L144 HydrophobicContact CE2-CD2 3.81Å; F139-L144 HydrophobicContact CE2-CG 4.45Å; F139-L144 HydrophobicContact CZ-CB 4.48Å; F139-L144 HydrophobicContact CZ-CD2 3.94Å; F139-K152 HydrophobicContact CB-CB 3.78Å; F139-V153 HydrophobicContact CB-CG2 4.4Å; F139-V153 HydrophobicContact CD1-CB 4.21Å; F139-V153 HydrophobicContact CD1-CG1 4.38Å; F139-V153 HydrophobicContact CD1-CG2 4.01Å; F139-V153 HydrophobicContact CD2-CG2 3.97Å; F139-V153 HydrophobicContact CE1-CB 4.2Å; F139-V153 HydrophobicContact CE1-CG1 3.86Å; F139-V153 HydrophobicContact CE1-CG2 4.18Å; F139-V153 HydrophobicContact CE2-CG2 4.17Å; F139-V153 HydrophobicContact CG-CG2 3.89Å; F139-V153 HydrophobicContact CZ-CG1 4.04Å; F139-V153 HydrophobicContact CZ-CG2 4.26Å; F139-A156 HydrophobicContact CD1-CB 3.79Å; F139-A156 HydrophobicContact CE1-CB 4.05Å
140	D	90.5	Very high	86.7	Confident	81 Å²	81	46 Å²	46	43%	0.433	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-73	142	169.7	179	-78.9	0	0	0	109.3	F142 D143	D140-F142 PolarHBondContact O-N 3.46Å; D140-F142 WeakPolarHBondContact OD1-CB 3.34Å; D140-F142 VanDerWaalsContact OD1-CD2 3.29Å; D140-F142 WeakPolarHBondContact OD1-CD2 3.44Å; D140-F142 PolarHBondContact OD1-N 3.06Å; D140-D143 PolarHBondContact N-OD2 3.4Å; D140-D143 VanDerWaalsContact O-CB 3.23Å; D140-D143 WeakPolarHBondContact O-CB 3.43Å; D140-D143 PolarHBondContact O-N 2.84Å
141	P	90.5	Very high	86.6	Confident	14 Å²	14	41 Å²	41	9%	0.091	23%	0.225	C	C	.	.	H	α-helix	trans	-49.5	-27.9	179.7	-30.5	35.2	0	0	0	116.1	L117 I120 R121 L124 F145	L117-P141 HydrophobicContact CD2-CB 3.63Å; I120-P141 HydrophobicContact CG2-CB 4.05Å; R121-P141 HydrophobicContact CG-CB 4.46Å; R121-P141 HydrophobicContact CG-CG 3.79Å; L124-P141 HydrophobicContact CD1-CG 3.84Å; P141-F145 WeakPolarHBondContact O-CB 3.28Å; P141-F145 PolarHBondContact O-N 2.67Å; P141-F145 VanDerWaalsContact O-N 3.1Å
142	F	84.1	Confident	86.6	Confident	8 Å²	8	44.6 Å²	44.6	4%	0.035	24%	0.24	C	C	.	.	H	α-helix	trans	-82.1	-19.1	176.2	-65	-86.3	0	0	0	113.9	L117 D140 L144 D146 R485	L117-F142 HydrophobicContact CD1-CE1 3.63Å; L117-F142 HydrophobicContact CD1-CE2 4.24Å; L117-F142 HydrophobicContact CD1-CZ 3.44Å; L117-F142 VanDerWaalsContact CD1-CZ 3.44Å; L117-F142 HydrophobicContact CD2-CD1 4.33Å; L117-F142 HydrophobicContact CD2-CE1 4.19Å; L117-F142 HydrophobicContact CD2-CE2 4.4Å; L117-F142 HydrophobicContact CD2-CZ 4.21Å; D140-F142 PolarHBondContact O-N 3.46Å; D140-F142 WeakPolarHBondContact OD1-CB 3.34Å; D140-F142 VanDerWaalsContact OD1-CD2 3.29Å; D140-F142 WeakPolarHBondContact OD1-CD2 3.44Å; D140-F142 PolarHBondContact OD1-N 3.06Å; F142-L144 PolarHBondContact O-N 2.85Å; F142-D146 WeakPolarHBondContact O-CB 3.39Å; F142-D146 PolarHBondContact O-N 3.22Å; F142-D146 VanDerWaalsContact O-N 3.09Å; F142-R485 VanDerWaalsContact CE2-NH1 3.33Å
143	D	87.2	Confident	86.7	Confident	19 Å²	19	41.8 Å²	41.8	10%	0.102	21%	0.211	C	C	.	.	H	α-helix	trans	-59.5	-29.9	171.4	-67.4	-19.6	0	0	0	111.2	F139 D140 V147 R148 D149 K152	F139-D143 HydrophobicContact CB-CB 4.03Å; D140-D143 PolarHBondContact N-OD2 3.4Å; D140-D143 VanDerWaalsContact O-CB 3.23Å; D140-D143 WeakPolarHBondContact O-CB 3.43Å; D140-D143 PolarHBondContact O-N 2.84Å; D143-V147 CarbonylContact O-C 3.57Å; D143-V147 WeakPolarHBondContact O-CA 3.34Å; D143-R148 PolarHBondContact O-N 2.83Å; D143-R148 VanDerWaalsContact O-N 3.15Å; D143-D149 HydrophobicContact CB-CB 4.06Å; D143-D149 CarbonylContact O-C 3.55Å; D143-D149 PolarHBondContact O-N 2.96Å; D143-K152 VanDerWaalsContact CG-NZ 3.34Å; D143-K152 IonicContact OD1-NZ 3.87Å; D143-K152 PolarHBondContact OD1-NZ 2.9Å; D143-K152 IonicContact OD2-NZ 2.74Å; D143-K152 PolarHBondContact OD2-NZ 3.1Å
144	L	90.1	Very high	86.8	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-93.7	-53.5	172.9	176.2	54.8	0	0	0	113.2	L82 L88 I120 F139 F142 D146 V147 F150 V153	L82-L144 HydrophobicContact CB-CD1 4.13Å; L88-L144 HydrophobicContact CD1-CD2 3.39Å; I120-L144 HydrophobicContact CD1-CB 4.44Å; I120-L144 HydrophobicContact CD1-CD2 3.95Å; I120-L144 HydrophobicContact CD1-CG 4.08Å; I120-L144 HydrophobicContact CG1-CD2 3.93Å; I120-L144 HydrophobicContact CG2-CD2 4.32Å; F139-L144 HydrophobicContact CD2-CB 4.14Å; F139-L144 HydrophobicContact CE2-CB 3.7Å; F139-L144 HydrophobicContact CE2-CD2 3.81Å; F139-L144 HydrophobicContact CE2-CG 4.45Å; F139-L144 HydrophobicContact CZ-CB 4.48Å; F139-L144 HydrophobicContact CZ-CD2 3.94Å; F142-L144 PolarHBondContact O-N 2.85Å; L144-D146 PolarHBondContact O-N 3.08Å; L144-V147 WeakPolarHBondContact O-CG2 3.32Å; L144-V147 PolarHBondContact O-N 3.28Å; L144-F150 HydrophobicContact CD1-CD2 4.18Å; L144-F150 HydrophobicContact CD1-CE2 3.88Å; L144-V153 HydrophobicContact CB-CG2 3.86Å; L144-V153 HydrophobicContact CD1-CG1 4.28Å; L144-V153 HydrophobicContact CD1-CG2 4.35Å
145	F	86	Confident	86.8	Confident	14 Å²	14	36 Å²	36	6%	0.061	20%	0.195	C	C	.	.	H	α-helix	trans	-67.3	-41.7	-171.4	-177.9	-89.6	0	0	0	113.5	R83 M111 Q113 C116 L117 I120 P141 V147	R83-F145 HydrophobicContact CG-CD2 4.41Å; R83-F145 PolarHBondContact NE-O 2.79Å; R83-F145 PolarHBondContact NH2-O 2.82Å; R83-F145 VanDerWaalsContact NH2-O 3.15Å; M111-F145 HydrophobicContact SD-CE2 4.05Å; Q113-F145 HydrophobicContact CB-CE1 3.86Å; Q113-F145 HydrophobicContact CB-CE2 4.45Å; Q113-F145 HydrophobicContact CB-CZ 3.69Å; Q113-F145 HydrophobicContact CG-CD1 3.97Å; Q113-F145 HydrophobicContact CG-CE1 3.49Å; Q113-F145 VanDerWaalsContact CG-CE1 3.49Å; Q113-F145 HydrophobicContact CG-CZ 3.82Å; C116-F145 HydrophobicContact CB-CD2 3.53Å; C116-F145 HydrophobicContact CB-CE2 3.49Å; C116-F145 VanDerWaalsContact CB-CE2 3.49Å; L117-F145 HydrophobicContact CD2-CB 3.78Å; L117-F145 HydrophobicContact CD2-CG 4.16Å; L117-F145 HydrophobicContact CG-CG 4.4Å; I120-F145 HydrophobicContact CD1-CB 4.04Å; P141-F145 WeakPolarHBondContact O-CB 3.28Å; P141-F145 PolarHBondContact O-N 2.67Å; P141-F145 VanDerWaalsContact O-N 3.1Å; F145-V147 VanDerWaalsContact C-N 3.31Å
146	D	78.4	Confident	87.1	Confident	11 Å²	11	30 Å²	30	6%	0.059	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	-0.1	171.9	-83.9	42.6	0	0	0	111.3	F142 L144 R148 K541	F142-D146 WeakPolarHBondContact O-CB 3.39Å; F142-D146 PolarHBondContact O-N 3.22Å; F142-D146 VanDerWaalsContact O-N 3.09Å; L144-D146 PolarHBondContact O-N 3.08Å; D146-R148 HydrophobicContact CB-CG 3.58Å; D146-R148 PolarHBondContact O-N 2.81Å; D146-R148 IonicContact OD2-CZ 3.56Å; D146-R148 IonicContact OD2-NE 3.97Å; D146-R148 PolarHBondContact OD2-NE 3.43Å; D146-R148 VanDerWaalsContact OD2-NE 3.15Å; D146-R148 IonicContact OD2-NH2 3.82Å; D146-R148 PolarHBondContact OD2-NH2 2.9Å; D146-K541 IonicContact OD2-NZ 2.85Å; D146-K541 PolarHBondContact OD2-NZ 3.23Å
147	V	83.1	Confident	87.5	Confident	2 Å²	2	25.3 Å²	25.3	1%	0.012	13%	0.13	C	C	.	.			trans	53.4	32.3	-176.5	-154.2	0	0	0	0	113.6	A79 D143 L144 F145 D149 F150 L190 A194	A79-V147 HydrophobicContact CB-CG1 3.76Å; A79-V147 HydrophobicContact CB-CG2 4.4Å; D143-V147 CarbonylContact O-C 3.57Å; D143-V147 WeakPolarHBondContact O-CA 3.34Å; L144-V147 WeakPolarHBondContact O-CG2 3.32Å; L144-V147 PolarHBondContact O-N 3.28Å; F145-V147 VanDerWaalsContact C-N 3.31Å; V147-D149 PolarHBondContact O-N 3.2Å; V147-F150 HydrophobicContact CG1-CB 3.91Å; V147-F150 HydrophobicContact CG1-CD2 4.25Å; V147-F150 HydrophobicContact CG1-CG 4.23Å; V147-L190 HydrophobicContact CB-CB 4.36Å; V147-L190 HydrophobicContact CG1-CB 3.63Å; V147-L190 HydrophobicContact CG1-CD1 4.19Å; V147-A194 HydrophobicContact CB-CB 3.94Å; V147-A194 HydrophobicContact CG2-CB 3.52Å
148	R	80.1	Confident	87.7	Confident	107 Å²	107	24.3 Å²	24.3	40%	0.404	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-30.6	-174.7	-57.4	174.9	-176.2	174.7	3.5	113.9	D143 D146	D143-R148 PolarHBondContact O-N 2.83Å; D143-R148 VanDerWaalsContact O-N 3.15Å; D146-R148 HydrophobicContact CB-CG 3.58Å; D146-R148 PolarHBondContact O-N 2.81Å; D146-R148 IonicContact OD2-CZ 3.56Å; D146-R148 IonicContact OD2-NE 3.97Å; D146-R148 PolarHBondContact OD2-NE 3.43Å; D146-R148 VanDerWaalsContact OD2-NE 3.15Å; D146-R148 IonicContact OD2-NH2 3.82Å; D146-R148 PolarHBondContact OD2-NH2 2.9Å
149	D	80.6	Confident	87.8	Confident	56 Å²	56	27.3 Å²	27.3	30%	0.299	14%	0.136	S	C	.	.	T	Hydrogen-bonded Turn	trans	-153.2	70.6	-179	-168.7	-23.5	0	0	0	109.6	D143 V147 G151 K152	D143-D149 HydrophobicContact CB-CB 4.06Å; D143-D149 CarbonylContact O-C 3.55Å; D143-D149 PolarHBondContact O-N 2.96Å; V147-D149 PolarHBondContact O-N 3.2Å; D149-G151 PolarHBondContact O-N 2.88Å; D149-G151 PolarHBondContact OD1-N 2.92Å; D149-K152 VanDerWaalsContact CG-NZ 3.3Å; D149-K152 PolarHBondContact O-N 2.89Å; D149-K152 PolarHBondContact OD1-N 2.96Å; D149-K152 VanDerWaalsContact OD2-CE 3.26Å; D149-K152 WeakPolarHBondContact OD2-CE 3.41Å; D149-K152 IonicContact OD2-NZ 2.71Å; D149-K152 PolarHBondContact OD2-NZ 2.91Å
150	F	86.9	Confident	87.7	Confident	1 Å²	1	27 Å²	27	0%	0.004	14%	0.135	C	C	.	.	H	α-helix	trans	-66.2	-19.8	178.3	-162.7	-115.3	0	0	0	112.5	V75 L78 A79 L82 L144 V147 V153 I154 Y187 L190	V75-F150 HydrophobicContact CG2-CD1 3.84Å; V75-F150 HydrophobicContact CG2-CE1 3.86Å; L78-F150 HydrophobicContact CD2-CE1 4.43Å; L78-F150 HydrophobicContact CD2-CZ 4.47Å; L78-F150 HydrophobicContact CG-CE1 4.43Å; L78-F150 HydrophobicContact CG-CZ 4.14Å; A79-F150 VanDerWaalsContact CA-CZ 3.46Å; A79-F150 HydrophobicContact CB-CD1 4.26Å; A79-F150 HydrophobicContact CB-CD2 3.91Å; A79-F150 HydrophobicContact CB-CE1 4.06Å; A79-F150 HydrophobicContact CB-CE2 3.72Å; A79-F150 HydrophobicContact CB-CG 4.19Å; A79-F150 HydrophobicContact CB-CZ 3.8Å; L82-F150 HydrophobicContact CD1-CZ 4.26Å; L144-F150 HydrophobicContact CD1-CD2 4.18Å; L144-F150 HydrophobicContact CD1-CE2 3.88Å; V147-F150 HydrophobicContact CG1-CB 3.91Å; V147-F150 HydrophobicContact CG1-CD2 4.25Å; V147-F150 HydrophobicContact CG1-CG 4.23Å; F150-V153 HydrophobicContact CD2-CB 3.89Å; F150-V153 HydrophobicContact CD2-CG1 4.26Å; F150-V153 HydrophobicContact CD2-CG2 3.96Å; F150-V153 HydrophobicContact CE2-CB 4.1Å; F150-V153 HydrophobicContact CE2-CG1 3.97Å; F150-V153 HydrophobicContact CE2-CG2 4.47Å; F150-V153 WeakPolarHBondContact O-CB 3.14Å; F150-V153 PolarHBondContact O-N 3.15Å; F150-I154 HydrophobicContact CD1-CD1 4.35Å; F150-I154 HydrophobicContact CD1-CG1 4.07Å; F150-I154 HydrophobicContact CE1-CD1 3.7Å; F150-I154 HydrophobicContact CE1-CG1 3.93Å; F150-I154 HydrophobicContact CZ-CD1 4.04Å; F150-I154 PolarHBondContact O-N 2.91Å; F150-Y187 HydrophobicContact CB-CD1 4.02Å; F150-Y187 HydrophobicContact CD1-CD1 4.03Å; F150-Y187 AromaticContact CD1-CE1 3.95Å; F150-Y187 HydrophobicContact CD1-CE1 3.95Å; F150-L190 HydrophobicContact CB-CD1 4.01Å; F150-L190 HydrophobicContact CD1-CD1 4.3Å; F150-L190 HydrophobicContact CG-CD1 4.45Å
151	G	85.7	Confident	87.8	Confident	21 Å²	21	23.1 Å²	23.1	22%	0.216	11%	0.114	C	C	.	.	H	α-helix	trans	-59	-44.8	171.2	0	0	0	0	0	112.3	D149 V153 I154 S155	D149-G151 PolarHBondContact O-N 2.88Å; D149-G151 PolarHBondContact OD1-N 2.92Å; G151-V153 VanDerWaalsContact C-N 3.27Å; G151-V153 PolarHBondContact O-N 2.89Å; G151-I154 PolarHBondContact O-N 2.67Å; G151-S155 VanDerWaalsContact O-CB 3.32Å; G151-S155 WeakPolarHBondContact O-CB 3.49Å; G151-S155 PolarHBondContact O-N 2.88Å
152	K	87.7	Confident	87.8	Confident	81 Å²	81	26.7 Å²	26.7	35%	0.352	13%	0.129	S	C	.	.	H	α-helix	trans	-61.1	-34.4	171.6	-70.7	-162.4	-138	77.1	0	113	F139 D143 D149 S155 A156	F139-K152 HydrophobicContact CB-CB 3.78Å; D143-K152 VanDerWaalsContact CG-NZ 3.34Å; D143-K152 IonicContact OD1-NZ 3.87Å; D143-K152 PolarHBondContact OD1-NZ 2.9Å; D143-K152 IonicContact OD2-NZ 2.74Å; D143-K152 PolarHBondContact OD2-NZ 3.1Å; D149-K152 VanDerWaalsContact CG-NZ 3.3Å; D149-K152 PolarHBondContact O-N 2.89Å; D149-K152 PolarHBondContact OD1-N 2.96Å; D149-K152 VanDerWaalsContact OD2-CE 3.26Å; D149-K152 WeakPolarHBondContact OD2-CE 3.41Å; D149-K152 IonicContact OD2-NZ 2.71Å; D149-K152 PolarHBondContact OD2-NZ 2.91Å; K152-S155 PolarHBondContact O-N 2.66Å; K152-A156 WeakPolarHBondContact O-CB 3.38Å; K152-A156 PolarHBondContact O-N 3.27Å
153	V	91.3	Very high	88.1	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-64.9	-50.9	178.3	-175.4	0	0	0	0	110.5	F139 L144 F150 G151 S155 A156 L157	F139-V153 HydrophobicContact CB-CG2 4.4Å; F139-V153 HydrophobicContact CD1-CB 4.21Å; F139-V153 HydrophobicContact CD1-CG1 4.38Å; F139-V153 HydrophobicContact CD1-CG2 4.01Å; F139-V153 HydrophobicContact CD2-CG2 3.97Å; F139-V153 HydrophobicContact CE1-CB 4.2Å; F139-V153 HydrophobicContact CE1-CG1 3.86Å; F139-V153 HydrophobicContact CE1-CG2 4.18Å; F139-V153 HydrophobicContact CE2-CG2 4.17Å; F139-V153 HydrophobicContact CG-CG2 3.89Å; F139-V153 HydrophobicContact CZ-CG1 4.04Å; F139-V153 HydrophobicContact CZ-CG2 4.26Å; L144-V153 HydrophobicContact CB-CG2 3.86Å; L144-V153 HydrophobicContact CD1-CG1 4.28Å; L144-V153 HydrophobicContact CD1-CG2 4.35Å; F150-V153 HydrophobicContact CD2-CB 3.89Å; F150-V153 HydrophobicContact CD2-CG1 4.26Å; F150-V153 HydrophobicContact CD2-CG2 3.96Å; F150-V153 HydrophobicContact CE2-CB 4.1Å; F150-V153 HydrophobicContact CE2-CG1 3.97Å; F150-V153 HydrophobicContact CE2-CG2 4.47Å; F150-V153 WeakPolarHBondContact O-CB 3.14Å; F150-V153 PolarHBondContact O-N 3.15Å; G151-V153 VanDerWaalsContact C-N 3.27Å; G151-V153 PolarHBondContact O-N 2.89Å; V153-S155 VanDerWaalsContact C-N 3.31Å; V153-S155 PolarHBondContact O-N 2.83Å; V153-A156 PolarHBondContact O-N 3.03Å; V153-L157 HydrophobicContact CG1-CD1 4.32Å; V153-L157 WeakPolarHBondContact O-CG 3.43Å; V153-L157 PolarHBondContact O-N 3.49Å
154	I	91	Very high	88.1	Confident	1 Å²	1	31 Å²	31	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-58.5	-44.6	174.8	-62.1	-57.9	0	0	0	110.5	E48 W49 C52 L78 F150 G151 A156 L157 S158 F174 Y187	E48-I154 HydrophobicContact CB-CG2 4.41Å; E48-I154 HydrophobicContact CG-CG2 3.66Å; W49-I154 HydrophobicContact CB-CD1 4.21Å; W49-I154 HydrophobicContact CB-CG1 4.45Å; C52-I154 HydrophobicContact CB-CD1 3.94Å; L78-I154 HydrophobicContact CD2-CD1 4Å; F150-I154 HydrophobicContact CD1-CD1 4.35Å; F150-I154 HydrophobicContact CD1-CG1 4.07Å; F150-I154 HydrophobicContact CE1-CD1 3.7Å; F150-I154 HydrophobicContact CE1-CG1 3.93Å; F150-I154 HydrophobicContact CZ-CD1 4.04Å; F150-I154 PolarHBondContact O-N 2.91Å; G151-I154 PolarHBondContact O-N 2.67Å; I154-A156 VanDerWaalsContact C-N 3.33Å; I154-A156 PolarHBondContact O-N 3.19Å; I154-L157 PolarHBondContact O-N 2.98Å; I154-S158 VanDerWaalsContact O-CB 3.32Å; I154-S158 WeakPolarHBondContact O-CB 2.96Å; I154-S158 PolarHBondContact O-N 2.96Å; I154-F174 HydrophobicContact CG2-CE2 4.02Å; I154-Y187 HydrophobicContact CG1-CE1 4.35Å
155	S	88.6	Confident	88	Confident	43 Å²	43	33 Å²	33	30%	0.301	17%	0.166	S	C	.	.	H	α-helix	trans	-64	-32.4	178.9	-155.2	0	0	0	0	113.5	G151 K152 V153 R159	G151-S155 VanDerWaalsContact O-CB 3.32Å; G151-S155 WeakPolarHBondContact O-CB 3.49Å; G151-S155 PolarHBondContact O-N 2.88Å; K152-S155 PolarHBondContact O-N 2.66Å; V153-S155 VanDerWaalsContact C-N 3.31Å; V153-S155 PolarHBondContact O-N 2.83Å; S155-R159 PolarHBondContact O-N 2.87Å; S155-R159 PolarHBondContact O-NH1 2.7Å; S155-R159 PolarHBondContact OG-NH1 3.39Å
156	A	91.8	Very high	87.9	Confident	1 Å²	1	32.3 Å²	32.3	1%	0.008	16%	0.163	C	C	.	.	H	α-helix	trans	-71.4	-42.8	173	0	0	0	0	0	111.7	L133 F139 K152 V153 I154 R159 I160	L133-A156 HydrophobicContact CD2-CB 4.41Å; F139-A156 HydrophobicContact CD1-CB 3.79Å; F139-A156 HydrophobicContact CE1-CB 4.05Å; K152-A156 WeakPolarHBondContact O-CB 3.38Å; K152-A156 PolarHBondContact O-N 3.27Å; V153-A156 PolarHBondContact O-N 3.03Å; I154-A156 VanDerWaalsContact C-N 3.33Å; I154-A156 PolarHBondContact O-N 3.19Å; A156-R159 PolarHBondContact O-N 3.34Å; A156-I160 WeakPolarHBondContact O-CG1 3.43Å; A156-I160 PolarHBondContact O-N 2.94Å; A156-I160 VanDerWaalsContact O-N 3.12Å
157	L	93.8	Very high	88.3	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-65.2	-38.2	175.9	-65.6	174.4	0	0	0	112.2	W55 L82 L88 M91 F123 V153 I154 R159 I160 S161 F174	W55-L157 HydrophobicContact CZ3-CB 4.26Å; W55-L157 HydrophobicContact CZ3-CD2 4.31Å; L82-L157 HydrophobicContact CD1-CD1 4.02Å; L88-L157 HydrophobicContact CD2-CD1 4.22Å; L88-L157 HydrophobicContact CD2-CD2 3.82Å; M91-L157 HydrophobicContact CE-CD2 3.84Å; M91-L157 HydrophobicContact SD-CD2 3.8Å; F123-L157 HydrophobicContact CE2-CD2 4.38Å; F123-L157 HydrophobicContact CZ-CD2 3.98Å; V153-L157 HydrophobicContact CG1-CD1 4.32Å; V153-L157 WeakPolarHBondContact O-CG 3.43Å; V153-L157 PolarHBondContact O-N 3.49Å; I154-L157 PolarHBondContact O-N 2.98Å; L157-R159 PolarHBondContact O-N 3.4Å; L157-I160 HydrophobicContact CD2-CD1 4.36Å; L157-I160 PolarHBondContact O-N 3.12Å; L157-I160 VanDerWaalsContact O-N 3.12Å; L157-S161 PolarHBondContact O-N 2.89Å; L157-F174 HydrophobicContact CB-CE1 4.28Å; L157-F174 HydrophobicContact CB-CZ 3.84Å
158	S	91.9	Very high	88.5	Confident	15 Å²	15	43.2 Å²	43.2	11%	0.105	22%	0.217	C	C	.	.	H	α-helix	trans	-55.9	-46.8	173.1	167.4	0	0	0	0	111.5	I154 I160 S161 H162 F174 P175	I154-S158 VanDerWaalsContact O-CB 3.32Å; I154-S158 WeakPolarHBondContact O-CB 2.96Å; I154-S158 PolarHBondContact O-N 2.96Å; S158-I160 PolarHBondContact O-N 2.76Å; S158-S161 PolarHBondContact O-N 3.45Å; S158-S161 PolarHBondContact O-OG 3.42Å; S158-H162 PolarHBondContact O-N 3.36Å; S158-H162 VanDerWaalsContact O-N 3.17Å; S158-H162 PolarHBondContact O-ND1 3.18Å; S158-F174 VanDerWaalsContact CA-CZ 3.48Å; S158-F174 PolarHBondContact OG-O 2.81Å; S158-P175 WeakPolarHBondContact OG-CD 3.39Å
159	R	90.6	Very high	88.6	Confident	92 Å²	92	42.9 Å²	42.9	35%	0.347	22%	0.219	S	C	.	.	H	α-helix	trans	-62.2	-39.8	173.1	-72.6	174.6	-178.9	74.6	-2.5	113.2	L133 E137 S155 A156 L157 H162 H163	L133-R159 HydrophobicContact CD2-CB 4.49Å; E137-R159 IonicContact OE1-NE 2.71Å; E137-R159 PolarHBondContact OE1-NE 3.03Å; S155-R159 PolarHBondContact O-N 2.87Å; S155-R159 PolarHBondContact O-NH1 2.7Å; S155-R159 PolarHBondContact OG-NH1 3.39Å; A156-R159 PolarHBondContact O-N 3.34Å; L157-R159 PolarHBondContact O-N 3.4Å; R159-H162 PolarHBondContact O-N 3.49Å; R159-H163 PolarHBondContact O-N 3.28Å; R159-H163 VanDerWaalsContact O-N 3.13Å
160	I	92.5	Very high	88.8	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-68.1	-36.7	178.3	-63.9	160.5	0	0	0	110.8	W55 M91 L92 L95 F123 C127 F131 L133 A156 L157 S158 H162 H163	W55-I160 HydrophobicContact CH2-CB 4.31Å; W55-I160 HydrophobicContact CH2-CG2 3.97Å; W55-I160 HydrophobicContact CZ2-CG2 4.49Å; M91-I160 HydrophobicContact CE-CD1 4.26Å; M91-I160 HydrophobicContact CE-CG2 3.97Å; L92-I160 HydrophobicContact CD2-CD1 4.47Å; L92-I160 HydrophobicContact CD2-CG2 4.38Å; L95-I160 HydrophobicContact CD1-CG2 3.87Å; F123-I160 HydrophobicContact CE2-CD1 4.17Å; F123-I160 HydrophobicContact CZ-CD1 3.82Å; C127-I160 VanDerWaalsContact SG-CD1 3.54Å; F131-I160 HydrophobicContact CD1-CG2 4.02Å; F131-I160 HydrophobicContact CE1-CG2 4.05Å; L133-I160 HydrophobicContact CD1-CG1 4Å; L133-I160 HydrophobicContact CD2-CD1 4.41Å; L133-I160 HydrophobicContact CD2-CG1 4.19Å; A156-I160 WeakPolarHBondContact O-CG1 3.43Å; A156-I160 PolarHBondContact O-N 2.94Å; A156-I160 VanDerWaalsContact O-N 3.12Å; L157-I160 HydrophobicContact CD2-CD1 4.36Å; L157-I160 PolarHBondContact O-N 3.12Å; L157-I160 VanDerWaalsContact O-N 3.12Å; S158-I160 PolarHBondContact O-N 2.76Å; I160-H162 VanDerWaalsContact C-N 3.29Å; I160-H162 PolarHBondContact O-N 2.62Å; I160-H163 VanDerWaalsContact O-CB 3.3Å; I160-H163 WeakPolarHBondContact O-CB 3.3Å; I160-H163 PolarHBondContact O-N 3.47Å; I160-H163 VanDerWaalsContact O-N 3.09Å
161	S	92.5	Very high	88.8	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-62.8	-36	174.4	87.2	0	0	0	0	112.5	W55 L157 S158 H163 P173 F174	W55-S161 VanDerWaalsContact CZ2-CA 3.45Å; L157-S161 PolarHBondContact O-N 2.89Å; S158-S161 PolarHBondContact O-N 3.45Å; S158-S161 PolarHBondContact O-OG 3.42Å; S161-H163 VanDerWaalsContact C-N 3.32Å; S161-P173 WeakPolarHBondContact OG-CA 3.44Å; S161-F174 PolarHBondContact OG-N 3.36Å; S161-F174 PolarHBondContact OG-O 3.45Å; S161-F174 VanDerWaalsContact OG-O 3.13Å
162	H	90.1	Very high	88.7	Confident	88 Å²	88	53.5 Å²	53.5	41%	0.407	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-9.6	174.5	-76	93.5	0	0	0	114.1	S158 R159 I160 Q167 F174	S158-H162 PolarHBondContact O-N 3.36Å; S158-H162 VanDerWaalsContact O-N 3.17Å; S158-H162 PolarHBondContact O-ND1 3.18Å; R159-H162 PolarHBondContact O-N 3.49Å; I160-H162 VanDerWaalsContact C-N 3.29Å; I160-H162 PolarHBondContact O-N 2.62Å; H162-Q167 PolarHBondContact O-NE2 2.72Å; H162-F174 PolarHBondContact CE1-O 2.87Å; H162-F174 PolarHBondContact ND1-O 3.13Å
163	H	91	Very high	88.8	Confident	53 Å²	53	52.1 Å²	52.1	25%	0.245	27%	0.269	C	S	.	.	S	Bend	trans	-70.7	143.8	179.7	-167.7	-108.2	0	0	0	111.3	F131 R159 I160 S161 I165 A166 Q167	F131-H163 HydrophobicContact CD1-CB 4.24Å; F131-H163 AromaticContact CD1-CG 3.97Å; F131-H163 AromaticContact CD1-ND1 3.5Å; R159-H163 PolarHBondContact O-N 3.28Å; R159-H163 VanDerWaalsContact O-N 3.13Å; I160-H163 VanDerWaalsContact O-CB 3.3Å; I160-H163 WeakPolarHBondContact O-CB 3.3Å; I160-H163 PolarHBondContact O-N 3.47Å; I160-H163 VanDerWaalsContact O-N 3.09Å; S161-H163 VanDerWaalsContact C-N 3.32Å; H163-I165 PolarHBondContact O-N 2.84Å; H163-I165 VanDerWaalsContact O-N 3.11Å; H163-A166 PolarHBondContact O-N 3.2Å; H163-Q167 PolarHBondContact O-N 3.26Å
164	S	86.6	Confident	88.7	Confident	64 Å²	64	52.3 Å²	52.3	45%	0.448	27%	0.27	S	S	.	.	H	α-helix	trans	-54.7	-36.4	-174.1	57	0	0	0	0	113.5	A166 Q167 I168	S164-A166 VanDerWaalsContact C-N 3.3Å; S164-A166 PolarHBondContact O-N 2.85Å; S164-Q167 PolarHBondContact O-N 2.96Å; S164-I168 WeakPolarHBondContact O-CB 3.4Å; S164-I168 WeakPolarHBondContact O-CD1 3.49Å; S164-I168 WeakPolarHBondContact O-CG1 3.38Å; S164-I168 PolarHBondContact O-N 2.74Å
165	I	86.8	Confident	88.3	Confident	42 Å²	42	54.1 Å²	54.1	22%	0.215	28%	0.282	C	S	.	.	H	α-helix	trans	-56.3	-41.3	175.6	-64.7	175.6	0	0	0	112	L95 F131 H163	L95-I165 HydrophobicContact CB-CG2 4.42Å; F131-I165 HydrophobicContact CD1-CD1 4.4Å; F131-I165 HydrophobicContact CE1-CB 4.18Å; F131-I165 HydrophobicContact CE1-CD1 4.16Å; F131-I165 HydrophobicContact CE1-CG2 4.11Å; F131-I165 HydrophobicContact CZ-CD1 4.41Å; F131-I165 HydrophobicContact CZ-CG2 4.36Å; H163-I165 PolarHBondContact O-N 2.84Å; H163-I165 VanDerWaalsContact O-N 3.11Å
166	A	85.8	Confident	87.6	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-74.3	-43.2	179.5	0	0	0	0	0	111.5	L95 H163 S164 I168 K169	L95-A166 HydrophobicContact CD2-CB 3.87Å; H163-A166 PolarHBondContact O-N 3.2Å; S164-A166 VanDerWaalsContact C-N 3.3Å; S164-A166 PolarHBondContact O-N 2.85Å; A166-I168 VanDerWaalsContact C-N 3.32Å; A166-I168 PolarHBondContact O-N 3.4Å; A166-K169 PolarHBondContact O-N 3.34Å
167	Q	85.4	Confident	86	Confident	100 Å²	100	64.5 Å²	64.5	47%	0.467	33%	0.332	S	S	.	.	H	α-helix	trans	-61.9	-37.3	177.3	-63.4	-176	-4.8	0	0	112.5	H162 H163 S164 K169 G170	H162-Q167 PolarHBondContact O-NE2 2.72Å; H163-Q167 PolarHBondContact O-N 3.26Å; S164-Q167 PolarHBondContact O-N 2.96Å; Q167-K169 PolarHBondContact O-N 3.26Å; Q167-G170 PolarHBondContact O-N 2.85Å
168	I	87	Confident	84.1	Confident	142 Å²	142	71.3 Å²	71.3	73%	0.728	37%	0.369	S	S	*	.	H	α-helix	trans	-60.8	-26.8	175.5	-74	163.6	0	0	0	112.1	S164 A166 G170	S164-I168 WeakPolarHBondContact O-CB 3.4Å; S164-I168 WeakPolarHBondContact O-CD1 3.49Å; S164-I168 WeakPolarHBondContact O-CG1 3.38Å; S164-I168 PolarHBondContact O-N 2.74Å; A166-I168 VanDerWaalsContact C-N 3.32Å; A166-I168 PolarHBondContact O-N 3.4Å; I168-G170 PolarHBondContact O-N 3.38Å
169	K	83.5	Confident	82.4	Confident	101 Å²	101	72.5 Å²	72.5	44%	0.439	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	2.9	174.2	-65.2	-149.5	170.4	-178.4	0	114.2	N94 L95 A166 Q167 I171	N94-K169 PolarHBondContact O-NZ 3.37Å; L95-K169 WeakPolarHBondContact O-CE 3.44Å; L95-K169 PolarHBondContact O-NZ 3.44Å; A166-K169 PolarHBondContact O-N 3.34Å; Q167-K169 PolarHBondContact O-N 3.26Å; K169-I171 HydrophobicContact CB-CD1 4.18Å; K169-I171 HydrophobicContact CB-CG1 4.19Å; K169-I171 PolarHBondContact O-N 3.39Å
170	G	83.8	Confident	80.2	Confident	66 Å²	66	72.2 Å²	72.2	68%	0.68	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.8	8.8	179.7	0	0	0	0	0	114.4	Q167 I168	Q167-G170 PolarHBondContact O-N 2.85Å; I168-G170 PolarHBondContact O-N 3.38Å
171	I	87.1	Confident	78.2	Confident	26 Å²	26	78.6 Å²	78.6	13%	0.133	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-77	135.1	177	-56.4	174	0	0	0	108.2	W55 D58 L95 K169	W55-I171 VanDerWaalsContact NE1-CG2 3.34Å; D58-I171 HydrophobicContact CB-CG2 3.89Å; L95-I171 HydrophobicContact CD2-CD1 4.03Å; K169-I171 HydrophobicContact CB-CD1 4.18Å; K169-I171 HydrophobicContact CB-CG1 4.19Å; K169-I171 PolarHBondContact O-N 3.39Å
172	R	84.8	Confident	76.3	Confident	209 Å²	209	85.5 Å²	85.5	79%	0.789	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-76.7	132.8	179.5	-65.6	-176.4	178	-161.1	-1.5	110.2
173	P	88.3	Confident	74.8	Confident	51 Å²	51	83 Å²	83	33%	0.331	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-69.9	165.1	174.5	31.3	-36	0	0	0	111.6	S161	S161-P173 WeakPolarHBondContact OG-CA 3.44Å
174	F	90.1	Very high	73.2	Confident	4 Å²	4	85.5 Å²	85.5	2%	0.018	47%	0.467	C	S	.	.	S	Bend	trans	-135	153.5	171.7	80.8	-85.7	0	0	0	110.2	E48 Q51 C52 W55 I154 L157 S158 S161 H162	E48-F174 HydrophobicContact CG-CD2 3.95Å; E48-F174 HydrophobicContact CG-CE2 4.02Å; Q51-F174 HydrophobicContact CB-CB 3.82Å; Q51-F174 HydrophobicContact CB-CD2 4.26Å; Q51-F174 HydrophobicContact CB-CG 4.28Å; C52-F174 HydrophobicContact CB-CD2 4.18Å; C52-F174 HydrophobicContact CB-CE1 4.11Å; C52-F174 HydrophobicContact CB-CE2 3.57Å; C52-F174 HydrophobicContact CB-CZ 3.52Å; C52-F174 WeakPolarHBondContact SG-CZ 3.37Å; W55-F174 HydrophobicContact CB-CD1 3.76Å; W55-F174 HydrophobicContact CB-CE1 4.24Å; W55-F174 AromaticContact CD2-CD1 3.92Å; W55-F174 HydrophobicContact CD2-CD1 3.92Å; W55-F174 AromaticContact CD2-CE1 3.81Å; W55-F174 HydrophobicContact CD2-CE1 3.81Å; W55-F174 HydrophobicContact CE3-CD1 4.15Å; W55-F174 AromaticContact CE3-CE1 3.57Å; W55-F174 HydrophobicContact CE3-CE1 3.57Å; W55-F174 AromaticContact CG-CD1 3.73Å; W55-F174 HydrophobicContact CG-CD1 3.73Å; W55-F174 HydrophobicContact CG-CE1 4.09Å; W55-F174 HydrophobicContact CZ3-CE1 4.19Å; I154-F174 HydrophobicContact CG2-CE2 4.02Å; L157-F174 HydrophobicContact CB-CE1 4.28Å; L157-F174 HydrophobicContact CB-CZ 3.84Å; S158-F174 VanDerWaalsContact CA-CZ 3.48Å; S158-F174 PolarHBondContact OG-O 2.81Å; S161-F174 PolarHBondContact OG-N 3.36Å; S161-F174 PolarHBondContact OG-O 3.45Å; S161-F174 VanDerWaalsContact OG-O 3.13Å; H162-F174 PolarHBondContact CE1-O 2.87Å; H162-F174 PolarHBondContact ND1-O 3.13Å
175	P	81.9	Confident	71.9	Confident	39 Å²	39	87.6 Å²	87.6	25%	0.253	47%	0.473	S	S	.	.	S	Bend	cis	-74.1	159.2	-3.4	29.5	-33.7	0	0	0	113.3	E48 Q51 S158 T179	E48-P175 HydrophobicContact CG-CB 4.2Å; E48-P175 HydrophobicContact CG-CG 4.5Å; E48-P175 WeakPolarHBondContact OE1-CD 3.37Å; Q51-P175 VanDerWaalsContact OE1-CA 3.29Å; S158-P175 WeakPolarHBondContact OG-CD 3.39Å; P175-T179 HydrophobicContact CB-CG2 4.44Å
176	S	74.4	Confident	70.8	Confident	63 Å²	63	88.6 Å²	88.6	44%	0.441	48%	0.481	S	S	.	.			trans	-70.8	150	164.3	49.8	0	0	0	0	111.8	Q51 D178 T179	Q51-S176 PolarHBondContact OE1-OG 3.44Å; S176-D178 PolarHBondContact O-N 3.16Å; S176-T179 WeakPolarHBondContact O-CB 3.44Å; S176-T179 PolarHBondContact O-N 3.22Å; S176-T179 PolarHBondContact O-OG1 3.19Å
177	E	59.2	Low	70.1	Confident	200 Å²	200	89.8 Å²	89.8	94%	0.935	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-23.4	-168.9	-60.7	-173.9	146.5	0	0	115.4	T179	E177-T179 VanDerWaalsContact C-N 3.25Å; E177-T179 PolarHBondContact O-N 3.11Å
178	D	52.7	Low	69.1	Low	143 Å²	143	93.6 Å²	93.6	77%	0.765	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-1.1	177.4	-61.3	-56.6	0	0	0	114.7	S176 A180	S176-D178 PolarHBondContact O-N 3.16Å; D178-A180 PolarHBondContact O-N 3.48Å
179	T	56.2	Low	68	Low	39 Å²	39	89.4 Å²	89.4	24%	0.239	48%	0.479	C	S	.	.			trans	-93.8	78.6	-170.4	-32.8	0	0	0	0	111.9	M46 Q51 P175 S176 E177	M46-T179 WeakPolarHBondContact O-CG2 3.42Å; Q51-T179 PolarHBondContact NE2-OG1 2.78Å; P175-T179 HydrophobicContact CB-CG2 4.44Å; S176-T179 WeakPolarHBondContact O-CB 3.44Å; S176-T179 PolarHBondContact O-N 3.22Å; S176-T179 PolarHBondContact O-OG1 3.19Å; E177-T179 VanDerWaalsContact C-N 3.25Å; E177-T179 PolarHBondContact O-N 3.11Å
180	A	44.5	Very low	67.2	Low	86 Å²	86	84.7 Å²	84.7	71%	0.711	46%	0.459	S	S	*	.			trans	-124.9	59.3	-167.8	0	0	0	0	0	115.1	D178	D178-A180 PolarHBondContact O-N 3.48Å
181	L	51.1	Low	66.3	Low	134 Å²	134	84.1 Å²	84.1	70%	0.702	44%	0.438	S	S	*	.	S	Bend	trans	-134.4	148.4	170.1	-69.7	175.4	0	0	0	111.1	E183	L181-E183 PolarHBondContact O-N 2.75Å; L181-E183 VanDerWaalsContact O-N 3.11Å
182	N	51.6	Low	65.3	Low	145 Å²	145	89.2 Å²	89.2	78%	0.775	46%	0.462	S	S	*	.			trans	-72.4	102.5	177.1	-72.1	17.1	0	0	0	110.4	D184	N182-D184 VanDerWaalsContact C-N 3.26Å; N182-D184 PolarHBondContact O-N 3.46Å
183	E	58.3	Low	64.3	Low	35 Å²	35	82 Å²	82	16%	0.164	44%	0.438	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-0.9	178.3	-67.8	-168	175.2	0	0	114.5	E47 E48 L181 D185 V186 Y187	E47-E183 WeakPolarHBondContact CA-OE1 2.93Å; E48-E183 PolarHBondContact N-OE1 2.9Å; L181-E183 PolarHBondContact O-N 2.75Å; L181-E183 VanDerWaalsContact O-N 3.11Å; E183-D185 PolarHBondContact O-N 3.29Å; E183-V186 VanDerWaalsContact O-CB 3.32Å; E183-V186 WeakPolarHBondContact O-CB 3.46Å; E183-V186 PolarHBondContact O-N 2.71Å; E183-Y187 HydrophobicContact CB-CD2 4.44Å; E183-Y187 HydrophobicContact CB-CE2 3.58Å; E183-Y187 VanDerWaalsContact O-CD2 3.25Å; E183-Y187 WeakPolarHBondContact O-CD2 3.33Å; E183-Y187 WeakPolarHBondContact O-CE2 2.88Å; E183-Y187 PolarHBondContact OE2-OH 3.41Å
184	D	57.8	Low	63	Low	106 Å²	106	79.6 Å²	79.6	57%	0.567	42%	0.423	S	S	*	.	H	α-helix	trans	-43.3	-42	-176.1	-63.7	-36.4	0	0	0	113.4	N182 V186 Y187 R188	N182-D184 VanDerWaalsContact C-N 3.26Å; N182-D184 PolarHBondContact O-N 3.46Å; D184-V186 VanDerWaalsContact C-N 3.27Å; D184-V186 PolarHBondContact O-N 3.2Å; D184-Y187 PolarHBondContact O-N 2.71Å; D184-R188 WeakPolarHBondContact O-CG 3.46Å; D184-R188 PolarHBondContact O-N 2.81Å
185	D	59.9	Low	61.4	Low	108 Å²	108	80.3 Å²	80.3	58%	0.578	43%	0.427	S	S	*	.	H	α-helix	trans	-64.5	-24	-178.9	-88.2	14.6	0	0	0	114.8	E183 R188	E183-D185 PolarHBondContact O-N 3.29Å; D185-R188 IonicContact OD1-CZ 3.15Å; D185-R188 IonicContact OD1-NE 3.55Å; D185-R188 PolarHBondContact OD1-NE 2.97Å; D185-R188 IonicContact OD1-NH2 2.89Å; D185-R188 PolarHBondContact OD1-NH2 3.13Å; D185-R188 IonicContact OD2-NH2 2.91Å; D185-R188 PolarHBondContact OD2-NH2 2.94Å
186	V	62.9	Low	60.1	Low	63 Å²	63	84.4 Å²	84.4	38%	0.382	44%	0.443	S	S	.	.	H	α-helix	trans	-73.2	-33.7	176.6	-179.1	0	0	0	0	111	V75 E183 D184	V75-V186 HydrophobicContact CG1-CG1 3.9Å; E183-V186 VanDerWaalsContact O-CB 3.32Å; E183-V186 WeakPolarHBondContact O-CB 3.46Å; E183-V186 PolarHBondContact O-N 2.71Å; D184-V186 VanDerWaalsContact C-N 3.27Å; D184-V186 PolarHBondContact O-N 3.2Å
187	Y	70.9	Confident	59.1	Low	26 Å²	26	86 Å²	86	10%	0.102	44%	0.443	C	S	.	.	H	α-helix	trans	-83.9	-21.5	-176.1	-55	-76	0	0	0	113.1	V75 F150 I154 E183 D184 S189 L190	V75-Y187 HydrophobicContact CG2-CD1 4.2Å; V75-Y187 HydrophobicContact CG2-CE1 3.75Å; F150-Y187 HydrophobicContact CB-CD1 4.02Å; F150-Y187 HydrophobicContact CD1-CD1 4.03Å; F150-Y187 AromaticContact CD1-CE1 3.95Å; F150-Y187 HydrophobicContact CD1-CE1 3.95Å; I154-Y187 HydrophobicContact CG1-CE1 4.35Å; E183-Y187 HydrophobicContact CB-CD2 4.44Å; E183-Y187 HydrophobicContact CB-CE2 3.58Å; E183-Y187 VanDerWaalsContact O-CD2 3.25Å; E183-Y187 WeakPolarHBondContact O-CD2 3.33Å; E183-Y187 WeakPolarHBondContact O-CE2 2.88Å; E183-Y187 PolarHBondContact OE2-OH 3.41Å; D184-Y187 PolarHBondContact O-N 2.71Å; Y187-S189 PolarHBondContact O-N 2.96Å; Y187-L190 HydrophobicContact CD1-CD1 3.87Å; Y187-L190 WeakPolarHBondContact O-CG 3.28Å; Y187-L190 PolarHBondContact O-N 3.08Å; Y187-L190 VanDerWaalsContact O-N 3.16Å
188	R	64.9	Low	58.7	Low	179 Å²	179	78 Å²	78	68%	0.675	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-10.9	-173.5	-71.7	-165.7	-66.6	101.2	-11.1	116.4	D184 D185	D184-R188 WeakPolarHBondContact O-CG 3.46Å; D184-R188 PolarHBondContact O-N 2.81Å; D185-R188 IonicContact OD1-CZ 3.15Å; D185-R188 IonicContact OD1-NE 3.55Å; D185-R188 PolarHBondContact OD1-NE 2.97Å; D185-R188 IonicContact OD1-NH2 2.89Å; D185-R188 PolarHBondContact OD1-NH2 3.13Å; D185-R188 IonicContact OD2-NH2 2.91Å; D185-R188 PolarHBondContact OD2-NH2 2.94Å
189	S	63.1	Low	58.5	Low	55 Å²	55	76.9 Å²	76.9	39%	0.385	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.6	1.1	177.7	55.4	0	0	0	0	114.3	Y187 L193	Y187-S189 PolarHBondContact O-N 2.96Å; S189-L193 PolarHBondContact O-N 2.82Å
190	L	68.4	Low	58	Low	2 Å²	2	77.9 Å²	77.9	1%	0.01	42%	0.418	C	S	.	.	H	α-helix	trans	-79	-29	-169.1	-61.1	174.6	0	0	0	114.8	V75 F76 V147 F150 Y187 E192 L193 A194	V75-L190 HydrophobicContact CG1-CD1 3.83Å; V75-L190 HydrophobicContact CG1-CD2 3.63Å; V75-L190 HydrophobicContact CG1-CG 4.25Å; V75-L190 HydrophobicContact CG2-CD1 4.3Å; F76-L190 HydrophobicContact CB-CD2 3.88Å; F76-L190 HydrophobicContact CD2-CD2 4.23Å; V147-L190 HydrophobicContact CB-CB 4.36Å; V147-L190 HydrophobicContact CG1-CB 3.63Å; V147-L190 HydrophobicContact CG1-CD1 4.19Å; F150-L190 HydrophobicContact CB-CD1 4.01Å; F150-L190 HydrophobicContact CD1-CD1 4.3Å; F150-L190 HydrophobicContact CG-CD1 4.45Å; Y187-L190 HydrophobicContact CD1-CD1 3.87Å; Y187-L190 WeakPolarHBondContact O-CG 3.28Å; Y187-L190 PolarHBondContact O-N 3.08Å; Y187-L190 VanDerWaalsContact O-N 3.16Å; L190-E192 VanDerWaalsContact C-N 3.3Å; L190-E192 PolarHBondContact O-N 2.71Å; L190-L193 HydrophobicContact CD2-CD1 4.24Å; L190-L193 PolarHBondContact O-N 3.38Å; L190-A194 WeakPolarHBondContact O-CB 3.35Å; L190-A194 PolarHBondContact O-N 2.85Å
191	E	65.1	Low	58.3	Low	54 Å²	54	76.9 Å²	76.9	25%	0.252	40%	0.399	S	S	.	.	H	α-helix	trans	-62.7	-38.2	173.4	-177.9	171.3	-164.3	0	0	111.1	A194 D195 M520 K541	E191-A194 PolarHBondContact O-N 2.76Å; E191-D195 PolarHBondContact O-N 3.06Å; E191-M520 HydrophobicContact CG-CE 4.5Å; E191-K541 IonicContact OE1-NZ 3.68Å; E191-K541 PolarHBondContact OE1-NZ 2.9Å
192	E	64.5	Low	57.9	Low	133 Å²	133	77.1 Å²	77.1	62%	0.621	40%	0.401	S	S	*	.	H	α-helix	trans	-66.9	-44.9	177.2	-60.8	-170.7	147.5	0	0	111.3	L190 A194 D195 E196	L190-E192 VanDerWaalsContact C-N 3.3Å; L190-E192 PolarHBondContact O-N 2.71Å; E192-A194 VanDerWaalsContact C-N 3.33Å; E192-A194 PolarHBondContact O-N 3.11Å; E192-D195 PolarHBondContact O-N 2.87Å; E192-E196 PolarHBondContact O-N 3.24Å
193	L	63.8	Low	57.6	Low	57 Å²	57	76 Å²	76	30%	0.298	40%	0.395	S	S	.	.	H	α-helix	trans	-65.3	-33.9	175.2	-68.5	171.2	0	0	0	112.6	F76 S189 L190 D195 E196 H197	F76-L193 HydrophobicContact CB-CD1 4.46Å; F76-L193 HydrophobicContact CD2-CB 3.9Å; F76-L193 HydrophobicContact CE2-CB 4.12Å; F76-L193 HydrophobicContact CG-CB 4.18Å; S189-L193 PolarHBondContact O-N 2.82Å; L190-L193 HydrophobicContact CD2-CD1 4.24Å; L190-L193 PolarHBondContact O-N 3.38Å; L193-D195 VanDerWaalsContact C-N 3.28Å; L193-D195 PolarHBondContact O-N 3.44Å; L193-E196 PolarHBondContact O-N 2.7Å; L193-H197 PolarHBondContact O-N 2.79Å
194	A	61.8	Low	57.3	Low	1 Å²	1	75 Å²	75	1%	0.008	39%	0.39	C	S	.	.	H	α-helix	trans	-69.8	-22	178.8	0	0	0	0	0	114.3	F76 R83 V147 L190 E191 E192	F76-A194 VanDerWaalsContact CE2-CA 3.48Å; F76-A194 HydrophobicContact CE2-CB 3.86Å; R83-A194 PolarHBondContact NH1-O 3.26Å; R83-A194 PolarHBondContact NH2-O 2.7Å; V147-A194 HydrophobicContact CB-CB 3.94Å; V147-A194 HydrophobicContact CG2-CB 3.52Å; L190-A194 WeakPolarHBondContact O-CB 3.35Å; L190-A194 PolarHBondContact O-N 2.85Å; E191-A194 PolarHBondContact O-N 2.76Å; E192-A194 VanDerWaalsContact C-N 3.33Å; E192-A194 PolarHBondContact O-N 3.11Å
195	D	55.8	Low	57.1	Low	19 Å²	19	72.2 Å²	72.2	10%	0.102	37%	0.372	C	S	.	.	H	α-helix	trans	-95.1	-11.3	173.9	-71.8	-35.7	0	0	0	113.4	E191 E192 L193 K541 T542	E191-D195 PolarHBondContact O-N 3.06Å; E192-D195 PolarHBondContact O-N 2.87Å; L193-D195 VanDerWaalsContact C-N 3.28Å; L193-D195 PolarHBondContact O-N 3.44Å; D195-K541 IonicContact OD1-NZ 2.72Å; D195-K541 WeakPolarHBondContact OD2-CD 3.48Å; D195-K541 IonicContact OD2-NZ 3.17Å; D195-T542 HydrophobicContact CB-CG2 3.46Å; D195-T542 VanDerWaalsContact CB-CG2 3.46Å; D195-T542 WeakPolarHBondContact O-CB 3.29Å; D195-T542 PolarHBondContact O-OG1 2.94Å
196	E	54.3	Low	56.6	Low	125 Å²	125	72 Å²	72	58%	0.584	37%	0.371	S	S	*	.	H	α-helix	trans	-102.3	-41.6	176.2	-71.5	-167.1	163.2	0	0	113.6	E192 L193 T542	E192-E196 PolarHBondContact O-N 3.24Å; L193-E196 PolarHBondContact O-N 2.7Å; E196-T542 HydrophobicContact CG-CG2 4.38Å
197	H	54.2	Low	55.6	Low	95 Å²	95	71.8 Å²	71.8	44%	0.44	37%	0.372	S	S	.	.			trans	-103.7	37	-171.7	-82.4	-71.1	0	0	0	114.3	F76 Q80 L193 L199	F76-H197 HydrophobicContact CD1-CB 4.48Å; F76-H197 HydrophobicContact CE1-CB 3.61Å; F76-H197 HydrophobicContact CZ-CB 4.09Å; Q80-H197 PolarHBondContact NE2-O 3.28Å; L193-H197 PolarHBondContact O-N 2.79Å; H197-L199 PolarHBondContact O-N 3.14Å
198	D	51.7	Low	54.4	Low	33 Å²	33	71.4 Å²	71.4	18%	0.176	37%	0.372	C	S	.	.			trans	-75.4	57.5	177.8	-167.1	51.4	0	0	0	112.6	R83 K548	R83-D198 IonicContact CZ-OD1 2.69Å; R83-D198 IonicContact NH1-OD1 2.74Å; R83-D198 PolarHBondContact NH1-OD1 3.36Å; D198-K548 PolarHBondContact O-NZ 3.46Å; D198-K548 IonicContact OD2-NZ 3.87Å; D198-K548 PolarHBondContact OD2-NZ 3.21Å
199	L	46.6	Very low	53.3	Low	119 Å²	119	67 Å²	67	62%	0.623	37%	0.366	S	S	*	.			trans	-84.5	131.9	168.6	-62.1	175.8	0	0	0	108.9	Q80 H197 E201	Q80-L199 PolarHBondContact NE2-O 2.68Å; H197-L199 PolarHBondContact O-N 3.14Å; L199-E201 PolarHBondContact O-N 3.17Å
200	G	47	Very low	52.3	Low	61 Å²	61	68.8 Å²	68.8	63%	0.629	38%	0.378	S	S	*	.			trans	-75.9	113.7	167.7	0	0	0	0	0	109.6	D202	G200-D202 PolarHBondContact O-N 3.02Å
201	E	50.7	Low	51	Low	64 Å²	64	75.2 Å²	75.2	30%	0.299	41%	0.408	S	S	.	.			trans	-82.6	86.3	164.7	-68.8	-166.1	153.3	0	0	108.1	R67 L199 D203 I204	R67-E201 IonicContact CZ-OE1 2.64Å; R67-E201 IonicContact NH1-OE1 2.66Å; R67-E201 PolarHBondContact NH1-OE1 3.08Å; L199-E201 PolarHBondContact O-N 3.17Å; E201-D203 PolarHBondContact O-N 3.14Å; E201-D203 VanDerWaalsContact O-N 3.1Å; E201-I204 HydrophobicContact CB-CD1 3.74Å; E201-I204 HydrophobicContact CB-CG1 3.76Å; E201-I204 WeakPolarHBondContact O-CG1 3.44Å; E201-I204 PolarHBondContact O-N 3.14Å; E201-I204 VanDerWaalsContact O-N 3.16Å
202	D	41.8	Very low	50	Low	140 Å²	140	78.3 Å²	78.3	75%	0.749	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-55.6	-26.9	-178.3	-74.8	-49.6	0	0	0	113	G200 I204	G200-D202 PolarHBondContact O-N 3.02Å; D202-I204 VanDerWaalsContact C-N 3.31Å; D202-I204 PolarHBondContact O-N 2.98Å
203	D	45.7	Very low	49	Very low	121 Å²	121	77.9 Å²	77.9	65%	0.647	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-72	-11.1	-179.1	-64.8	-7.7	0	0	0	114.4	E201 Y205 D206	E201-D203 PolarHBondContact O-N 3.14Å; E201-D203 VanDerWaalsContact O-N 3.1Å; D203-Y205 VanDerWaalsContact C-N 3.27Å; D203-Y205 PolarHBondContact O-N 3.44Å; D203-D206 PolarHBondContact O-N 2.83Å
204	I	52.1	Low	48.3	Very low	14 Å²	14	75.7 Å²	75.7	7%	0.072	42%	0.419	C	S	.	.	G	3₁₀ helix	trans	-62.4	-33.3	-175	-72.1	-178.3	0	0	0	112.5	A81 L87 E201 D202 D206	A81-I204 HydrophobicContact CB-CD1 4.11Å; L87-I204 HydrophobicContact CD1-CG2 4.04Å; E201-I204 HydrophobicContact CB-CD1 3.74Å; E201-I204 HydrophobicContact CB-CG1 3.76Å; E201-I204 WeakPolarHBondContact O-CG1 3.44Å; E201-I204 PolarHBondContact O-N 3.14Å; E201-I204 VanDerWaalsContact O-N 3.16Å; D202-I204 VanDerWaalsContact C-N 3.31Å; D202-I204 PolarHBondContact O-N 2.98Å; I204-D206 PolarHBondContact O-N 3.4Å
205	Y	53.5	Low	47.7	Very low	48 Å²	48	78.5 Å²	78.5	19%	0.188	43%	0.434	C	S	.	.	G	3₁₀ helix	trans	-86.2	1.5	-172.4	-48.7	-72.8	0	0	0	114.5	D84 V86 D203 C207 V208	D84-Y205 WeakPolarHBondContact OD2-CE1 3.38Å; D84-Y205 PolarHBondContact OD2-OH 3.44Å; V86-Y205 HydrophobicContact CB-CE1 4.15Å; V86-Y205 HydrophobicContact CG1-CD1 4.38Å; V86-Y205 HydrophobicContact CG1-CE1 4.26Å; V86-Y205 HydrophobicContact CG2-CE1 4.34Å; D203-Y205 VanDerWaalsContact C-N 3.27Å; D203-Y205 PolarHBondContact O-N 3.44Å; Y205-C207 PolarHBondContact O-N 2.95Å; Y205-V208 HydrophobicContact CD1-CG2 4.28Å; Y205-V208 WeakPolarHBondContact O-CB 3.44Å; Y205-V208 PolarHBondContact O-N 3.42Å
206	D	49.2	Very low	48	Very low	104 Å²	104	84 Å²	84	56%	0.556	46%	0.463	S	S	*	.	G	3₁₀ helix	trans	-60.1	-12.7	178	-95.5	12.7	0	0	0	113.7	D203 I204	D203-D206 PolarHBondContact O-N 2.83Å; I204-D206 PolarHBondContact O-N 3.4Å
207	C	42.4	Very low	48.8	Very low	58 Å²	58	79.5 Å²	79.5	39%	0.392	44%	0.443	S	S	.	.	G	3₁₀ helix	trans	-104.6	-2.5	174.4	-69.1	0	0	0	0	114.4	P63 Y205	P63-C207 VanDerWaalsContact CB-SG 3.53Å; Y205-C207 PolarHBondContact O-N 2.95Å
208	V	46.3	Very low	49.7	Very low	17 Å²	17	75.3 Å²	75.3	10%	0.103	42%	0.424	C	S	.	.	S	Bend	trans	-83.9	125.1	171.3	179.3	0	0	0	0	107.8	L87 F107 Y205 C210	L87-V208 HydrophobicContact CD2-CG2 3.89Å; F107-V208 HydrophobicContact CD1-CG1 3.67Å; F107-V208 HydrophobicContact CE1-CG1 3.54Å; Y205-V208 HydrophobicContact CD1-CG2 4.28Å; Y205-V208 WeakPolarHBondContact O-CB 3.44Å; Y205-V208 PolarHBondContact O-N 3.42Å; V208-C210 PolarHBondContact O-N 3.27Å
209	P	40.8	Very low	50.9	Low	86 Å²	86	77.6 Å²	77.6	56%	0.558	43%	0.433	S	S	*	.			trans	-62.6	111	169.1	-18.7	31.9	0	0	0	109.4
210	C	42.6	Very low	52.4	Low	93 Å²	93	75.4 Å²	75.4	63%	0.628	42%	0.422	S	S	*	.			trans	-59.9	149.8	140.8	-67.1	0	0	0	0	107.6	V208 D212	V208-C210 PolarHBondContact O-N 3.27Å; C210-D212 PolarHBondContact O-N 3.3Å
211	E	42.3	Very low	53.8	Low	137 Å²	137	73.3 Å²	73.3	64%	0.64	40%	0.396	S	S	*	.	S	Bend	trans	-73	65.2	176	-64.6	-178.3	154.6	0	0	109.7	D213	E211-D213 VanDerWaalsContact C-N 3.26Å; E211-D213 PolarHBondContact O-N 2.89Å
212	D	42.1	Very low	54.9	Low	120 Å²	120	70.4 Å²	70.4	64%	0.642	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	4.6	-174.4	-145.8	27.8	0	0	0	112.5	C210 G214 D215	C210-D212 PolarHBondContact O-N 3.3Å; D212-G214 PolarHBondContact O-N 3.21Å; D212-D215 PolarHBondContact O-N 3.21Å
213	D	44.8	Very low	56.1	Low	124 Å²	124	68.6 Å²	68.6	66%	0.663	37%	0.368	S	S	*	.	H	α-helix	trans	-46.1	-28.4	167.2	-66.3	-37.4	0	0	0	111.8	E211 D215 I217	E211-D213 VanDerWaalsContact C-N 3.26Å; E211-D213 PolarHBondContact O-N 2.89Å; D213-D215 PolarHBondContact O-N 3.43Å; D213-I217 VanDerWaalsContact O-CD1 3.29Å; D213-I217 WeakPolarHBondContact O-CD1 3.32Å; D213-I217 VanDerWaalsContact O-CG1 3.26Å; D213-I217 WeakPolarHBondContact O-CG1 3.25Å; D213-I217 PolarHBondContact O-N 2.91Å
214	G	48.3	Very low	56.6	Low	10 Å²	10	64.7 Å²	64.7	10%	0.103	35%	0.349	C	S	.	.	H	α-helix	trans	-56.2	-44.1	174.8	0	0	0	0	0	114.5	D212 I217 Y218 Q380	D212-G214 PolarHBondContact O-N 3.21Å; G214-I217 WeakPolarHBondContact O-CA 3.44Å; G214-I217 WeakPolarHBondContact O-CB 3.4Å; G214-I217 PolarHBondContact O-N 2.9Å; G214-I217 VanDerWaalsContact O-N 3.11Å; G214-Y218 PolarHBondContact O-N 3.45Å; G214-Q380 PolarHBondContact O-NE2 3.17Å
215	D	50.5	Low	56.6	Low	60 Å²	60	71.8 Å²	71.8	32%	0.321	38%	0.381	S	S	.	.	H	α-helix	trans	-75.1	-30.8	-171.1	-121.8	55.3	0	0	0	112.7	D212 D213 Y218 E219 Q380 K384	D212-D215 PolarHBondContact O-N 3.21Å; D213-D215 PolarHBondContact O-N 3.43Å; D215-Y218 PolarHBondContact O-N 3.1Å; D215-E219 WeakPolarHBondContact O-CG 3.38Å; D215-E219 PolarHBondContact O-N 2.69Å; D215-E219 VanDerWaalsContact O-N 3.13Å; D215-Q380 VanDerWaalsContact CA-NE2 3.27Å; D215-Q380 PolarHBondContact OD1-NE2 3.11Å; D215-K384 IonicContact OD1-NZ 3.48Å; D215-K384 IonicContact OD2-NZ 2.67Å; D215-K384 PolarHBondContact OD2-NZ 3.15Å
216	D	60.4	Low	56.3	Low	134 Å²	134	72.8 Å²	72.8	72%	0.717	39%	0.393	S	S	*	.	H	α-helix	trans	-60.8	-44	164.1	-89.4	-20.2	0	0	0	111.3	Y218 E219 D220	D216-Y218 PolarHBondContact O-N 3.3Å; D216-E219 PolarHBondContact O-N 2.8Å; D216-D220 WeakPolarHBondContact O-CB 3.41Å; D216-D220 PolarHBondContact O-N 3.15Å; D216-D220 VanDerWaalsContact O-N 3.08Å
217	I	71.2	Confident	56	Low	31 Å²	31	76.9 Å²	76.9	16%	0.159	40%	0.4	C	S	.	.	H	α-helix	trans	-61.3	-44.7	178	-70	161.6	0	0	0	111.5	D213 G214 D220 I221 F369 D373	D213-I217 VanDerWaalsContact O-CD1 3.29Å; D213-I217 WeakPolarHBondContact O-CD1 3.32Å; D213-I217 VanDerWaalsContact O-CG1 3.26Å; D213-I217 WeakPolarHBondContact O-CG1 3.25Å; D213-I217 PolarHBondContact O-N 2.91Å; G214-I217 WeakPolarHBondContact O-CA 3.44Å; G214-I217 WeakPolarHBondContact O-CB 3.4Å; G214-I217 PolarHBondContact O-N 2.9Å; G214-I217 VanDerWaalsContact O-N 3.11Å; I217-D220 PolarHBondContact O-N 2.87Å; I217-I221 HydrophobicContact CG2-CD1 3.6Å; I217-I221 HydrophobicContact CG2-CG1 4.47Å; I217-I221 WeakPolarHBondContact O-CG1 3.17Å; I217-I221 PolarHBondContact O-N 3.16Å; I217-F369 HydrophobicContact CB-CE1 4.43Å; I217-F369 HydrophobicContact CG1-CD1 4.45Å; I217-F369 HydrophobicContact CG1-CE1 4.32Å; I217-F369 HydrophobicContact CG2-CD1 3.95Å; I217-F369 HydrophobicContact CG2-CE1 4Å; I217-D373 HydrophobicContact CD1-CB 4.09Å; I217-D373 HydrophobicContact CG2-CB 4.27Å
218	Y	74.8	Confident	55.9	Low	8 Å²	8	79.5 Å²	79.5	3%	0.031	41%	0.407	C	S	.	.	H	α-helix	trans	-61.9	-49.3	178.2	178.7	-84.5	0	0	0	111.7	G214 D215 D216 D220 I221 I222 V377 Q380 R381 K384	G214-Y218 PolarHBondContact O-N 3.45Å; D215-Y218 PolarHBondContact O-N 3.1Å; D216-Y218 PolarHBondContact O-N 3.3Å; Y218-D220 PolarHBondContact O-N 2.93Å; Y218-I221 PolarHBondContact O-N 2.95Å; Y218-I222 HydrophobicContact CD1-CB 4.4Å; Y218-I222 HydrophobicContact CD2-CG1 3.97Å; Y218-I222 HydrophobicContact CE1-CB 4.01Å; Y218-I222 HydrophobicContact CE1-CG1 4.33Å; Y218-I222 HydrophobicContact CE1-CG2 4.14Å; Y218-I222 HydrophobicContact CE2-CB 4.26Å; Y218-I222 HydrophobicContact CE2-CG1 3.7Å; Y218-I222 HydrophobicContact CE2-CG2 4.47Å; Y218-I222 HydrophobicContact CG-CG1 4.39Å; Y218-I222 WeakPolarHBondContact O-CB 3.35Å; Y218-I222 PolarHBondContact O-N 2.65Å; Y218-V377 HydrophobicContact CD2-CG1 3.86Å; Y218-V377 HydrophobicContact CE2-CG1 4.22Å; Y218-Q380 HydrophobicContact CD2-CB 3.61Å; Y218-Q380 HydrophobicContact CE2-CB 4.21Å; Y218-Q380 HydrophobicContact CG-CB 4.05Å; Y218-R381 HydrophobicContact CE2-CB 3.98Å; Y218-R381 VanDerWaalsContact OH-CD 3.23Å; Y218-R381 WeakPolarHBondContact OH-CD 3.25Å; Y218-R381 PolarHBondContact OH-NH1 2.82Å; Y218-K384 HydrophobicContact CD1-CD 4.21Å; Y218-K384 HydrophobicContact CE1-CD 3.76Å; Y218-K384 HydrophobicContact CE1-CG 3.82Å
219	E	77	Confident	55.7	Low	80 Å²	80	83.8 Å²	83.8	37%	0.374	44%	0.435	S	S	.	.	H	α-helix	trans	-68.7	-14.1	-179.4	-65.3	-57.2	149.1	0	0	112.8	D215 D216 K223 K384	D215-E219 WeakPolarHBondContact O-CG 3.38Å; D215-E219 PolarHBondContact O-N 2.69Å; D215-E219 VanDerWaalsContact O-N 3.13Å; D216-E219 PolarHBondContact O-N 2.8Å; E219-K223 WeakPolarHBondContact O-CB 3.22Å; E219-K223 WeakPolarHBondContact O-CD 3.37Å; E219-K223 WeakPolarHBondContact O-CG 3.05Å; E219-K223 PolarHBondContact O-NZ 2.83Å; E219-K384 IonicContact OE1-NZ 3.18Å; E219-K384 PolarHBondContact OE1-NZ 2.84Å
220	D	77.4	Confident	55.9	Low	74 Å²	74	84.8 Å²	84.8	40%	0.396	43%	0.433	S	S	.	.	H	α-helix	trans	-102.5	-9.7	176.4	-131.5	50.8	0	0	0	114.6	D216 I217 Y218 K223 K368 F369	D216-D220 WeakPolarHBondContact O-CB 3.41Å; D216-D220 PolarHBondContact O-N 3.15Å; D216-D220 VanDerWaalsContact O-N 3.08Å; I217-D220 PolarHBondContact O-N 2.87Å; Y218-D220 PolarHBondContact O-N 2.93Å; D220-K223 IonicContact OD1-NZ 3.53Å; D220-K223 PolarHBondContact OD1-NZ 2.8Å; D220-K368 PolarHBondContact O-NZ 2.74Å; D220-K368 IonicContact OD2-NZ 3.52Å; D220-K368 PolarHBondContact OD2-NZ 3.27Å; D220-F369 HydrophobicContact CB-CZ 4.33Å
221	I	76.6	Confident	56.1	Low	17 Å²	17	83.2 Å²	83.2	9%	0.087	42%	0.418	C	S	.	.	H	α-helix	trans	-94.6	-50.2	167.6	-65.7	166	0	0	0	111	I217 Y218 T262 F369 L374 V377	I217-I221 HydrophobicContact CG2-CD1 3.6Å; I217-I221 HydrophobicContact CG2-CG1 4.47Å; I217-I221 WeakPolarHBondContact O-CG1 3.17Å; I217-I221 PolarHBondContact O-N 3.16Å; Y218-I221 PolarHBondContact O-N 2.95Å; I221-T262 HydrophobicContact CG2-CG2 4.11Å; I221-F369 HydrophobicContact CD1-CD1 4.19Å; I221-F369 HydrophobicContact CD1-CD2 4Å; I221-F369 HydrophobicContact CD1-CE1 4.23Å; I221-F369 HydrophobicContact CD1-CE2 4.05Å; I221-F369 HydrophobicContact CD1-CG 4.06Å; I221-F369 HydrophobicContact CD1-CZ 4.15Å; I221-F369 HydrophobicContact CG1-CD1 4.35Å; I221-F369 HydrophobicContact CG1-CD2 3.71Å; I221-F369 HydrophobicContact CG1-CE1 3.99Å; I221-F369 HydrophobicContact CG1-CE2 3.28Å; I221-F369 HydrophobicContact CG1-CG 4.21Å; I221-F369 HydrophobicContact CG1-CZ 3.42Å; I221-F369 VanDerWaalsContact CG1-CZ 3.42Å; I221-L374 HydrophobicContact CD1-CD2 3.85Å; I221-V377 HydrophobicContact CD1-CG2 3.7Å
222	I	74.2	Confident	56.4	Low	3 Å²	3	84.5 Å²	84.5	2%	0.015	42%	0.417	C	S	.	.	S	Bend	trans	-89.8	-12.4	-169.3	-56.5	-63.1	0	0	0	112.2	Y218 V224 T255 K258 Y259 V377	Y218-I222 HydrophobicContact CD1-CB 4.4Å; Y218-I222 HydrophobicContact CD2-CG1 3.97Å; Y218-I222 HydrophobicContact CE1-CB 4.01Å; Y218-I222 HydrophobicContact CE1-CG1 4.33Å; Y218-I222 HydrophobicContact CE1-CG2 4.14Å; Y218-I222 HydrophobicContact CE2-CB 4.26Å; Y218-I222 HydrophobicContact CE2-CG1 3.7Å; Y218-I222 HydrophobicContact CE2-CG2 4.47Å; Y218-I222 HydrophobicContact CG-CG1 4.39Å; Y218-I222 WeakPolarHBondContact O-CB 3.35Å; Y218-I222 PolarHBondContact O-N 2.65Å; I222-V224 PolarHBondContact O-N 2.9Å; I222-T255 HydrophobicContact CG2-CG2 3.94Å; I222-K258 HydrophobicContact CD1-CB 4.28Å; I222-Y259 HydrophobicContact CD1-CD2 4.31Å; I222-V377 HydrophobicContact CD1-CG1 4.26Å; I222-V377 HydrophobicContact CG1-CG1 4.16Å
223	K	66.3	Low	56.7	Low	101 Å²	101	86.5 Å²	86.5	44%	0.439	42%	0.417	S	S	.	.			trans	-33.2	118.9	176.1	-136.4	176.9	-141	89	0	111.8	E219 D220 E225 K258	E219-K223 WeakPolarHBondContact O-CB 3.22Å; E219-K223 WeakPolarHBondContact O-CD 3.37Å; E219-K223 WeakPolarHBondContact O-CG 3.05Å; E219-K223 PolarHBondContact O-NZ 2.83Å; D220-K223 IonicContact OD1-NZ 3.53Å; D220-K223 PolarHBondContact OD1-NZ 2.8Å; K223-E225 PolarHBondContact O-N 3.38Å; K223-K258 PolarHBondContact O-NZ 3.11Å
224	V	56.9	Low	57.1	Low	39 Å²	39	83.1 Å²	83.1	24%	0.236	40%	0.398	C	S	.	.			trans	-59.1	127	163.3	172.2	0	0	0	0	106.6	I222 V226 E251 T255	I222-V224 PolarHBondContact O-N 2.9Å; V224-V226 HydrophobicContact CG1-CG2 4.18Å; V224-V226 PolarHBondContact O-N 3.03Å; V224-E251 HydrophobicContact CG2-CG 4.2Å; V224-T255 HydrophobicContact CG2-CG2 3.7Å
225	E	52.1	Low	57.2	Low	163 Å²	163	89.1 Å²	89.1	76%	0.762	42%	0.423	S	S	*	.			trans	-73.7	79.2	168.2	-81.4	-160.4	143	0	0	107.1	K223 R227	K223-E225 PolarHBondContact O-N 3.38Å; E225-R227 PolarHBondContact O-N 2.93Å
226	V	46	Very low	57.1	Low	70 Å²	70	95.3 Å²	95.3	42%	0.424	45%	0.447	S	S	.	.			trans	-51.8	108.2	171.3	167.2	0	0	0	0	106.2	V224 Q228 I231	V224-V226 HydrophobicContact CG1-CG2 4.18Å; V224-V226 PolarHBondContact O-N 3.03Å; V226-Q228 PolarHBondContact O-N 3.15Å; V226-I231 HydrophobicContact CG1-CB 4.05Å; V226-I231 HydrophobicContact CG1-CD1 3.59Å; V226-I231 HydrophobicContact CG1-CG1 3.86Å; V226-I231 HydrophobicContact CG2-CD1 4.22Å
227	R	43.5	Very low	56.7	Low	189 Å²	189	96 Å²	96	71%	0.713	45%	0.448	S	S	*	.			trans	-61.1	91	167.4	-73.3	-177	176.1	179.5	0.9	106.1	E225 P229 M230 I231	E225-R227 PolarHBondContact O-N 2.93Å; R227-P229 VanDerWaalsContact O-N 3.1Å; R227-M230 HydrophobicContact CB-CB 4.11Å; R227-M230 WeakPolarHBondContact O-CA 3.25Å; R227-M230 WeakPolarHBondContact O-CB 3.2Å; R227-M230 PolarHBondContact O-N 2.87Å; R227-I231 PolarHBondContact O-N 3.09Å
228	Q	39.4	Very low	56	Low	114 Å²	114	97.2 Å²	97.2	53%	0.533	47%	0.467	S	S	.	.	H	α-helix	trans	-51.3	-32.9	-179.4	-63.7	-170.2	9.7	0	0	112.7	V226 M230 R232	V226-Q228 PolarHBondContact O-N 3.15Å; Q228-M230 PolarHBondContact O-N 3.06Å; Q228-R232 WeakPolarHBondContact O-CB 3.44Å; Q228-R232 VanDerWaalsContact O-CG 3.22Å; Q228-R232 WeakPolarHBondContact O-CG 3.28Å; Q228-R232 PolarHBondContact O-N 3.26Å
229	P	42.2	Very low	55.8	Low	106 Å²	106	99.2 Å²	99.2	69%	0.688	48%	0.478	S	S	*	.	H	α-helix	trans	-56.2	-44.6	168.4	-27.7	37	0	0	0	113.6	R227 Y233	R227-P229 VanDerWaalsContact O-N 3.1Å; P229-Y233 VanDerWaalsContact O-CB 3.26Å; P229-Y233 WeakPolarHBondContact O-CB 3.19Å; P229-Y233 PolarHBondContact O-N 2.63Å
230	M	44.4	Very low	55.9	Low	107 Å²	107	99 Å²	99	53%	0.527	48%	0.482	S	S	.	.	H	α-helix	trans	-70.2	-51.6	-176.2	-158	110.3	91.3	0	0	111.7	R227 Q228 R232 Y233 M234	R227-M230 HydrophobicContact CB-CB 4.11Å; R227-M230 WeakPolarHBondContact O-CA 3.25Å; R227-M230 WeakPolarHBondContact O-CB 3.2Å; R227-M230 PolarHBondContact O-N 2.87Å; Q228-M230 PolarHBondContact O-N 3.06Å; M230-R232 PolarHBondContact O-N 3.21Å; M230-Y233 WeakPolarHBondContact O-CA 3.5Å; M230-Y233 WeakPolarHBondContact O-CB 3.31Å; M230-Y233 PolarHBondContact O-N 3.5Å; M230-M234 HydrophobicContact CG-SD 3.87Å; M230-M234 WeakPolarHBondContact O-CG 3.4Å; M230-M234 PolarHBondContact O-N 2.67Å
231	I	47.2	Very low	55.9	Low	60 Å²	60	99.9 Å²	99.9	31%	0.308	48%	0.484	S	S	.	.	H	α-helix	trans	-64.9	-38.6	179.5	-70.9	-161.4	0	0	0	111.4	V226 R227 Y233 M234 Q235	V226-I231 HydrophobicContact CG1-CB 4.05Å; V226-I231 HydrophobicContact CG1-CD1 3.59Å; V226-I231 HydrophobicContact CG1-CG1 3.86Å; V226-I231 HydrophobicContact CG2-CD1 4.22Å; R227-I231 PolarHBondContact O-N 3.09Å; I231-Y233 PolarHBondContact O-N 2.88Å; I231-M234 PolarHBondContact O-N 2.84Å; I231-Q235 HydrophobicContact CG2-CG 4.01Å; I231-Q235 VanDerWaalsContact O-CB 3.24Å; I231-Q235 WeakPolarHBondContact O-CB 3.41Å; I231-Q235 WeakPolarHBondContact O-CG 3.48Å; I231-Q235 PolarHBondContact O-N 3.15Å
232	R	49.2	Very low	56.1	Low	164 Å²	164	102.6 Å²	102.6	62%	0.619	50%	0.499	S	S	*	.	H	α-helix	trans	-66	-24.1	173	-70.6	177.5	177.8	169.4	4.2	113.5	Q228 M230	Q228-R232 WeakPolarHBondContact O-CB 3.44Å; Q228-R232 VanDerWaalsContact O-CG 3.22Å; Q228-R232 WeakPolarHBondContact O-CG 3.28Å; Q228-R232 PolarHBondContact O-N 3.26Å; M230-R232 PolarHBondContact O-N 3.21Å
233	Y	49.3	Very low	56.4	Low	163 Å²	163	105.3 Å²	105.3	64%	0.639	51%	0.513	S	S	*	.	H	α-helix	trans	-80.1	-44.1	175	-159.6	-89.5	0	0	0	111.3	P229 M230 I231 K236 M237	P229-Y233 VanDerWaalsContact O-CB 3.26Å; P229-Y233 WeakPolarHBondContact O-CB 3.19Å; P229-Y233 PolarHBondContact O-N 2.63Å; M230-Y233 WeakPolarHBondContact O-CA 3.5Å; M230-Y233 WeakPolarHBondContact O-CB 3.31Å; M230-Y233 PolarHBondContact O-N 3.5Å; I231-Y233 PolarHBondContact O-N 2.88Å; Y233-K236 WeakPolarHBondContact O-CB 3.34Å; Y233-K236 PolarHBondContact O-N 2.66Å; Y233-M237 HydrophobicContact CE1-CE 4.26Å; Y233-M237 PolarHBondContact O-N 3.44Å
234	M	51.5	Low	57	Low	52 Å²	52	103.3 Å²	103.3	26%	0.256	50%	0.504	S	S	.	.	H	α-helix	trans	-68.7	-40.6	178.1	-64.9	171.8	79.4	0	0	112.1	M230 I231 K236 M237 G238 M239 D243	M230-M234 HydrophobicContact CG-SD 3.87Å; M230-M234 WeakPolarHBondContact O-CG 3.4Å; M230-M234 PolarHBondContact O-N 2.67Å; I231-M234 PolarHBondContact O-N 2.84Å; M234-K236 PolarHBondContact O-N 3.31Å; M234-M237 PolarHBondContact O-N 3.2Å; M234-M237 VanDerWaalsContact O-N 3.12Å; M234-G238 PolarHBondContact O-N 3.23Å; M234-G238 VanDerWaalsContact O-N 3.09Å; M234-M239 HydrophobicContact CB-CG 3.89Å; M234-M239 HydrophobicContact CB-SD 4.11Å; M234-M239 HydrophobicContact CE-CE 4.02Å; M234-M239 HydrophobicContact CE-CG 4.46Å; M234-M239 HydrophobicContact CE-SD 4.5Å; M234-D243 HydrophobicContact CE-CB 4.3Å
235	Q	51.1	Low	58.4	Low	136 Å²	136	101.9 Å²	101.9	64%	0.636	50%	0.495	S	S	*	.	H	α-helix	trans	-60.5	-26.1	171.3	-74.7	172.8	-19.2	0	0	113	I231	I231-Q235 HydrophobicContact CG2-CG 4.01Å; I231-Q235 VanDerWaalsContact O-CB 3.24Å; I231-Q235 WeakPolarHBondContact O-CB 3.41Å; I231-Q235 WeakPolarHBondContact O-CG 3.48Å; I231-Q235 PolarHBondContact O-N 3.15Å
236	K	48.9	Very low	60	Low	191 Å²	191	97.7 Å²	97.7	83%	0.83	48%	0.478	S	S	*	.	H	α-helix	trans	-80.1	-21.3	175.8	-101	-174.5	172.8	-174.6	0	114.5	Y233 M234	Y233-K236 WeakPolarHBondContact O-CB 3.34Å; Y233-K236 PolarHBondContact O-N 2.66Å; M234-K236 PolarHBondContact O-N 3.31Å
237	M	52.3	Low	61.6	Low	149 Å²	149	96.7 Å²	96.7	73%	0.734	47%	0.473	S	S	*	.	H	α-helix	trans	-95.7	-25	179.6	-74	-76.4	-170.7	0	0	112.9	Y233 M234	Y233-M237 HydrophobicContact CE1-CE 4.26Å; Y233-M237 PolarHBondContact O-N 3.44Å; M234-M237 PolarHBondContact O-N 3.2Å; M234-M237 VanDerWaalsContact O-N 3.12Å
238	G	56.1	Low	63.6	Low	55 Å²	55	88.1 Å²	88.1	57%	0.567	44%	0.442	S	S	*	.			trans	86.9	102.2	-172.3	0	0	0	0	0	111.1	M234	M234-G238 PolarHBondContact O-N 3.23Å; M234-G238 VanDerWaalsContact O-N 3.09Å
239	M	69.4	Low	65.9	Low	51 Å²	51	83 Å²	83	25%	0.251	42%	0.418	S	S	.	.			trans	-70	133.3	-178.8	-69.5	174.3	67.8	0	0	112	M234 D243 K244	M234-M239 HydrophobicContact CB-CG 3.89Å; M234-M239 HydrophobicContact CB-SD 4.11Å; M234-M239 HydrophobicContact CE-CE 4.02Å; M234-M239 HydrophobicContact CE-CG 4.46Å; M234-M239 HydrophobicContact CE-SD 4.5Å; M239-D243 HydrophobicContact CB-CB 4.13Å; M239-D243 HydrophobicContact CE-CB 3.97Å; M239-D243 HydrophobicContact CG-CB 4.4Å; M239-K244 HydrophobicContact CB-CG 4.27Å; M239-K244 HydrophobicContact CE-CG 3.93Å; M239-K244 WeakPolarHBondContact O-CE 3.22Å
240	T	79.7	Confident	68	Low	76 Å²	76	80.8 Å²	80.8	47%	0.466	40%	0.403	S	S	.	.			trans	-69.9	165.4	167.4	69.5	0	0	0	0	110.8	D242 D243 K244	T240-D242 PolarHBondContact O-N 3Å; T240-D242 PolarHBondContact OG1-N 2.93Å; T240-D243 WeakPolarHBondContact CB-OD2 3.25Å; T240-D243 PolarHBondContact N-OD2 3.48Å; T240-D243 PolarHBondContact O-N 3.15Å; T240-D243 PolarHBondContact OG1-N 2.74Å; T240-D243 VanDerWaalsContact OG1-N 3.09Å; T240-D243 PolarHBondContact OG1-OD2 2.76Å; T240-K244 WeakPolarHBondContact O-CG 3.39Å; T240-K244 PolarHBondContact O-N 3.14Å
241	E	78.3	Confident	69.9	Low	91 Å²	91	79.5 Å²	79.5	43%	0.425	40%	0.395	S	S	.	.	H	α-helix	trans	-64.3	-29.7	172.3	-61.9	-56.1	126.2	0	0	112	K244 R245 H395	E241-K244 PolarHBondContact O-N 2.67Å; E241-K244 IonicContact OE1-NZ 2.74Å; E241-K244 PolarHBondContact OE1-NZ 3.02Å; E241-K244 IonicContact OE2-NZ 3.7Å; E241-R245 WeakPolarHBondContact O-CB 3.36Å; E241-R245 PolarHBondContact O-N 3.44Å; E241-H395 IonicContact OE2-CE1 3.31Å; E241-H395 IonicContact OE2-CG 2.66Å; E241-H395 IonicContact OE2-ND1 2.8Å; E241-H395 PolarHBondContact OE2-ND1 3.38Å
242	D	80.9	Confident	71.9	Confident	75 Å²	75	76.7 Å²	76.7	40%	0.401	38%	0.381	S	S	.	.	H	α-helix	trans	-67.2	-40.5	174.7	-88	23.3	0	0	0	112	T240 K244 R245 N246 R399	T240-D242 PolarHBondContact O-N 3Å; T240-D242 PolarHBondContact OG1-N 2.93Å; D242-K244 VanDerWaalsContact C-N 3.32Å; D242-K244 PolarHBondContact O-N 2.79Å; D242-R245 PolarHBondContact O-N 3.27Å; D242-N246 WeakPolarHBondContact O-CB 3.3Å; D242-N246 PolarHBondContact O-N 3Å; D242-N246 PolarHBondContact O-ND2 3.24Å; D242-N246 VanDerWaalsContact O-ND2 3.13Å; D242-R399 IonicContact OD1-CZ 2.63Å; D242-R399 IonicContact OD1-NE 3.69Å; D242-R399 IonicContact OD1-NH2 3.66Å; D242-R399 PolarHBondContact OD1-NH2 3.25Å; D242-R399 IonicContact OD2-NH2 2.66Å; D242-R399 PolarHBondContact OD2-NH2 2.69Å
243	D	80.3	Confident	74	Confident	59 Å²	59	71.2 Å²	71.2	32%	0.316	36%	0.363	S	S	.	.	H	α-helix	trans	-60.2	-43.5	173	-61.7	-58	0	0	0	111	M234 M239 T240 N246 C247	M234-D243 HydrophobicContact CE-CB 4.3Å; M239-D243 HydrophobicContact CB-CB 4.13Å; M239-D243 HydrophobicContact CE-CB 3.97Å; M239-D243 HydrophobicContact CG-CB 4.4Å; T240-D243 WeakPolarHBondContact CB-OD2 3.25Å; T240-D243 PolarHBondContact N-OD2 3.48Å; T240-D243 PolarHBondContact O-N 3.15Å; T240-D243 PolarHBondContact OG1-N 2.74Å; T240-D243 VanDerWaalsContact OG1-N 3.09Å; T240-D243 PolarHBondContact OG1-OD2 2.76Å; D243-N246 PolarHBondContact O-N 3.07Å; D243-C247 PolarHBondContact O-N 2.82Å; D243-C247 PolarHBondContact O-SG 3.04Å; D243-C247 VanDerWaalsContact O-SG 3.35Å
244	K	77.9	Confident	75.9	Confident	60 Å²	60	67.4 Å²	67.4	26%	0.261	35%	0.35	S	S	.	.	H	α-helix	trans	-65.7	-47.8	179.1	-62.9	169.8	-160.4	170.8	0	111.7	M239 T240 E241 D242 N246 C247 C248 H395	M239-K244 HydrophobicContact CB-CG 4.27Å; M239-K244 HydrophobicContact CE-CG 3.93Å; M239-K244 WeakPolarHBondContact O-CE 3.22Å; T240-K244 WeakPolarHBondContact O-CG 3.39Å; T240-K244 PolarHBondContact O-N 3.14Å; E241-K244 PolarHBondContact O-N 2.67Å; E241-K244 IonicContact OE1-NZ 2.74Å; E241-K244 PolarHBondContact OE1-NZ 3.02Å; E241-K244 IonicContact OE2-NZ 3.7Å; D242-K244 VanDerWaalsContact C-N 3.32Å; D242-K244 PolarHBondContact O-N 2.79Å; K244-N246 PolarHBondContact O-N 2.89Å; K244-C247 WeakPolarHBondContact O-CB 3.17Å; K244-C247 PolarHBondContact O-N 3.38Å; K244-C247 VanDerWaalsContact O-N 3.11Å; K244-C248 PolarHBondContact O-N 3.06Å; K244-C248 PolarHBondContact O-SG 3Å; K244-C248 VanDerWaalsContact O-SG 3.34Å; K244-H395 HydrophobicContact CB-CB 4.35Å; K244-H395 VanDerWaalsContact CD-CE1 3.48Å; K244-H395 WeakPolarHBondContact CD-CE1 3.3Å
245	R	86.8	Confident	77.7	Confident	8 Å²	8	65.4 Å²	65.4	3%	0.03	34%	0.341	C	S	.	.	H	α-helix	trans	-54.4	-44	173.5	-178.3	-172	161.4	-77.6	1	110.9	E241 D242 C248 L249 G311 L392 H395 E401	E241-R245 WeakPolarHBondContact O-CB 3.36Å; E241-R245 PolarHBondContact O-N 3.44Å; D242-R245 PolarHBondContact O-N 3.27Å; R245-C248 PolarHBondContact O-N 2.95Å; R245-L249 VanDerWaalsContact NH1-CD1 3.28Å; R245-L249 WeakPolarHBondContact O-CG 3.23Å; R245-L249 PolarHBondContact O-N 3.1Å; R245-G311 PolarHBondContact NH2-O 3.01Å; R245-G311 VanDerWaalsContact NH2-O 3.08Å; R245-L392 HydrophobicContact CG-CD1 3.73Å; R245-H395 HydrophobicContact CB-CB 3.98Å; R245-E401 IonicContact CZ-OE1 3.3Å; R245-E401 VanDerWaalsContact CZ-OE1 3.27Å; R245-E401 IonicContact NE-OE1 3.41Å; R245-E401 PolarHBondContact NE-OE1 3.14Å; R245-E401 IonicContact NH2-OE1 2.7Å; R245-E401 PolarHBondContact NH2-OE1 3.4Å; R245-E401 IonicContact NH2-OE2 3.43Å
246	N	84.7	Confident	79.8	Confident	76 Å²	76	58.9 Å²	58.9	41%	0.406	31%	0.311	S	S	.	.	H	α-helix	trans	-68.7	-36.1	179.2	-66.8	-21	0	0	0	112.2	D242 D243 K244 L249 V250	D242-N246 WeakPolarHBondContact O-CB 3.3Å; D242-N246 PolarHBondContact O-N 3Å; D242-N246 PolarHBondContact O-ND2 3.24Å; D242-N246 VanDerWaalsContact O-ND2 3.13Å; D243-N246 PolarHBondContact O-N 3.07Å; K244-N246 PolarHBondContact O-N 2.89Å; N246-L249 PolarHBondContact O-N 3.26Å; N246-V250 WeakPolarHBondContact O-CG2 3.32Å; N246-V250 PolarHBondContact O-N 3.03Å
247	C	81.2	Confident	82	Confident	49 Å²	49	52.6 Å²	52.6	33%	0.331	29%	0.291	S	S	.	.	H	α-helix	trans	-59.9	-47.9	169.5	-72.6	0	0	0	0	112	D243 K244 L249 V250 E251	D243-C247 PolarHBondContact O-N 2.82Å; D243-C247 PolarHBondContact O-SG 3.04Å; D243-C247 VanDerWaalsContact O-SG 3.35Å; K244-C247 WeakPolarHBondContact O-CB 3.17Å; K244-C247 PolarHBondContact O-N 3.38Å; K244-C247 VanDerWaalsContact O-N 3.11Å; C247-L249 VanDerWaalsContact C-N 3.3Å; C247-L249 PolarHBondContact O-N 2.89Å; C247-V250 PolarHBondContact O-N 2.91Å; C247-E251 WeakPolarHBondContact O-CB 3.48Å; C247-E251 PolarHBondContact O-N 2.86Å
248	C	85.4	Confident	83.9	Confident	9 Å²	9	48.5 Å²	48.5	6%	0.061	27%	0.269	C	S	.	.	H	α-helix	trans	-61.2	-36.8	177.4	-60.1	0	0	0	0	112.7	K244 R245 I252 L392	K244-C248 PolarHBondContact O-N 3.06Å; K244-C248 PolarHBondContact O-SG 3Å; K244-C248 VanDerWaalsContact O-SG 3.34Å; R245-C248 PolarHBondContact O-N 2.95Å; C248-I252 VanDerWaalsContact O-CG1 3.28Å; C248-I252 WeakPolarHBondContact O-CG1 3.35Å; C248-I252 PolarHBondContact O-N 2.91Å; C248-L392 HydrophobicContact CB-CB 4.1Å; C248-L392 HydrophobicContact CB-CD1 3.93Å
249	L	87.9	Confident	85.7	Confident	6 Å²	6	45.9 Å²	45.9	3%	0.031	24%	0.242	C	C	.	.	H	α-helix	trans	-65.2	-45.2	174.9	-74.6	177.9	0	0	0	112.4	R245 N246 C247 I252 Q253 M308 L315 L392	R245-L249 VanDerWaalsContact NH1-CD1 3.28Å; R245-L249 WeakPolarHBondContact O-CG 3.23Å; R245-L249 PolarHBondContact O-N 3.1Å; N246-L249 PolarHBondContact O-N 3.26Å; C247-L249 VanDerWaalsContact C-N 3.3Å; C247-L249 PolarHBondContact O-N 2.89Å; L249-I252 PolarHBondContact O-N 3.22Å; L249-Q253 PolarHBondContact O-N 3.02Å; L249-Q253 VanDerWaalsContact O-N 3.13Å; L249-M308 HydrophobicContact CB-CE 3.82Å; L249-M308 HydrophobicContact CB-SD 3.84Å; L249-M308 HydrophobicContact CD2-SD 4.43Å; L249-M308 HydrophobicContact CG-SD 4.5Å; L249-L315 HydrophobicContact CD2-CD2 3.76Å; L249-L392 HydrophobicContact CD2-CD1 3.86Å; L249-L392 HydrophobicContact CD2-CD2 3.82Å; L249-L392 HydrophobicContact CG-CD1 3.84Å
250	V	84.8	Confident	87	Confident	60 Å²	60	44.9 Å²	44.9	36%	0.364	24%	0.236	S	C	.	.	H	α-helix	trans	-65.6	-40.7	176.5	171.1	0	0	0	0	110.9	N246 C247 I252 Q253 E254 M308	N246-V250 WeakPolarHBondContact O-CG2 3.32Å; N246-V250 PolarHBondContact O-N 3.03Å; C247-V250 PolarHBondContact O-N 2.91Å; V250-I252 PolarHBondContact O-N 2.85Å; V250-Q253 PolarHBondContact O-N 2.78Å; V250-E254 HydrophobicContact CG1-CG 4.01Å; V250-E254 WeakPolarHBondContact O-CB 3.35Å; V250-E254 WeakPolarHBondContact O-CG 3.2Å; V250-E254 PolarHBondContact O-N 3.45Å; V250-M308 HydrophobicContact CG2-CE 4.05Å
251	E	85.2	Confident	87.7	Confident	79 Å²	79	47.2 Å²	47.2	37%	0.369	24%	0.239	S	C	.	.	H	α-helix	trans	-60	-44.2	175.4	177.3	174.5	-152.4	0	0	112.2	V224 C247 Q253 T255 L388	V224-E251 HydrophobicContact CG2-CG 4.2Å; C247-E251 WeakPolarHBondContact O-CB 3.48Å; C247-E251 PolarHBondContact O-N 2.86Å; E251-Q253 VanDerWaalsContact C-N 3.35Å; E251-Q253 PolarHBondContact O-N 2.91Å; E251-T255 HydrophobicContact CG-CG2 4.31Å; E251-T255 VanDerWaalsContact O-CB 3.29Å; E251-T255 WeakPolarHBondContact O-CB 3.27Å; E251-T255 VanDerWaalsContact O-CG2 3.22Å; E251-T255 WeakPolarHBondContact O-CG2 3.38Å; E251-T255 PolarHBondContact O-N 2.72Å; E251-T255 PolarHBondContact O-OG1 3.27Å; E251-L388 HydrophobicContact CG-CD2 3.98Å
252	I	89.8	Confident	88.3	Confident	1 Å²	1	43.2 Å²	43.2	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-60.4	-45.2	174.5	-70.9	165.9	0	0	0	110.7	C248 L249 V250 T255 E256 I304 L315 F319 L388 L392	C248-I252 VanDerWaalsContact O-CG1 3.28Å; C248-I252 WeakPolarHBondContact O-CG1 3.35Å; C248-I252 PolarHBondContact O-N 2.91Å; L249-I252 PolarHBondContact O-N 3.22Å; V250-I252 PolarHBondContact O-N 2.85Å; I252-T255 PolarHBondContact O-OG1 3.21Å; I252-E256 VanDerWaalsContact O-CB 3.23Å; I252-E256 WeakPolarHBondContact O-CB 3.35Å; I252-E256 PolarHBondContact O-N 2.93Å; I252-I304 HydrophobicContact CG2-CD1 4.35Å; I252-L315 HydrophobicContact CD1-CD2 3.76Å; I252-L315 HydrophobicContact CG2-CD2 4.24Å; I252-F319 HydrophobicContact CG2-CE2 4.44Å; I252-F319 HydrophobicContact CG2-CZ 4.41Å; I252-L388 HydrophobicContact CD1-CB 4.11Å; I252-L388 HydrophobicContact CG1-CB 3.81Å; I252-L388 HydrophobicContact CG1-CD1 4.23Å; I252-L388 HydrophobicContact CG1-CD2 4.29Å; I252-L388 HydrophobicContact CG1-CG 4.34Å; I252-L392 HydrophobicContact CD1-CD2 4.06Å
253	Q	92.9	Very high	89	Confident	50 Å²	50	39.7 Å²	39.7	23%	0.234	20%	0.202	C	C	.	.	H	α-helix	trans	-66.6	-49	179.5	-172.9	-177.3	16.8	0	0	112.7	L249 V250 E251 E256 S257 I304 D305 M308	L249-Q253 PolarHBondContact O-N 3.02Å; L249-Q253 VanDerWaalsContact O-N 3.13Å; V250-Q253 PolarHBondContact O-N 2.78Å; E251-Q253 VanDerWaalsContact C-N 3.35Å; E251-Q253 PolarHBondContact O-N 2.91Å; Q253-E256 PolarHBondContact O-N 2.88Å; Q253-S257 WeakPolarHBondContact O-CB 3.28Å; Q253-S257 PolarHBondContact O-N 3.32Å; Q253-I304 HydrophobicContact CB-CG2 4.11Å; Q253-I304 HydrophobicContact CG-CG2 4.22Å; Q253-D305 PolarHBondContact NE2-OD1 3.49Å; Q253-M308 HydrophobicContact CB-CE 4.36Å; Q253-M308 HydrophobicContact CB-CG 4.41Å; Q253-M308 HydrophobicContact CG-CG 4.4Å; Q253-M308 VanDerWaalsContact OE1-CE 3.28Å
254	E	88	Confident	89.7	Confident	82 Å²	82	39.2 Å²	39.2	38%	0.383	20%	0.198	S	C	.	.	H	α-helix	trans	-67.5	-42	-178.1	-73.2	-170.4	-176.8	0	0	111.8	V250 E256 S257 K258	V250-E254 HydrophobicContact CG1-CG 4.01Å; V250-E254 WeakPolarHBondContact O-CB 3.35Å; V250-E254 WeakPolarHBondContact O-CG 3.2Å; V250-E254 PolarHBondContact O-N 3.45Å; E254-E256 VanDerWaalsContact C-N 3.33Å; E254-E256 PolarHBondContact O-N 2.68Å; E254-S257 PolarHBondContact O-N 2.83Å; E254-K258 WeakPolarHBondContact O-CG 3.47Å; E254-K258 PolarHBondContact O-N 3.29Å
255	T	90.4	Very high	90.4	Very high	10 Å²	10	37.9 Å²	37.9	6%	0.061	19%	0.194	C	C	.	.	H	α-helix	trans	-68.3	-32.5	176	60.7	0	0	0	0	112.2	I222 V224 E251 I252 Y259 R381	I222-T255 HydrophobicContact CG2-CG2 3.94Å; V224-T255 HydrophobicContact CG2-CG2 3.7Å; E251-T255 HydrophobicContact CG-CG2 4.31Å; E251-T255 VanDerWaalsContact O-CB 3.29Å; E251-T255 WeakPolarHBondContact O-CB 3.27Å; E251-T255 VanDerWaalsContact O-CG2 3.22Å; E251-T255 WeakPolarHBondContact O-CG2 3.38Å; E251-T255 PolarHBondContact O-N 2.72Å; E251-T255 PolarHBondContact O-OG1 3.27Å; I252-T255 PolarHBondContact O-OG1 3.21Å; T255-Y259 WeakPolarHBondContact O-CB 3.15Å; T255-Y259 PolarHBondContact O-N 3.38Å; T255-R381 VanDerWaalsContact CB-NH1 3.26Å; T255-R381 PolarHBondContact OG1-NH1 2.79Å; T255-R381 PolarHBondContact OG1-NH2 2.97Å; T255-R381 VanDerWaalsContact OG1-NH2 3.13Å
256	E	95.6	Very high	90.8	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-69.5	-40.8	173.1	-168.6	67.4	-166	0	0	111.6	I252 Q253 E254 Y259 Y260 H297 L301 I304 R381 Y385	I252-E256 VanDerWaalsContact O-CB 3.23Å; I252-E256 WeakPolarHBondContact O-CB 3.35Å; I252-E256 PolarHBondContact O-N 2.93Å; Q253-E256 PolarHBondContact O-N 2.88Å; E254-E256 VanDerWaalsContact C-N 3.33Å; E254-E256 PolarHBondContact O-N 2.68Å; E256-Y259 PolarHBondContact O-N 3.04Å; E256-Y260 WeakPolarHBondContact O-CB 3.26Å; E256-Y260 PolarHBondContact O-N 3.07Å; E256-H297 IonicContact OE1-CE1 3.62Å; E256-H297 IonicContact OE1-CG 2.67Å; E256-H297 IonicContact OE1-ND1 3.99Å; E256-H297 PolarHBondContact OE1-ND1 3.05Å; E256-L301 HydrophobicContact CB-CD1 4.2Å; E256-L301 HydrophobicContact CG-CB 4.1Å; E256-L301 HydrophobicContact CG-CD1 4.09Å; E256-I304 HydrophobicContact CB-CD1 4.48Å; E256-I304 HydrophobicContact CG-CD1 4.13Å; E256-R381 VanDerWaalsContact CA-NH2 3.34Å; E256-R381 VanDerWaalsContact N-NH2 3.15Å; E256-R381 IonicContact OE2-CZ 2.84Å; E256-R381 VanDerWaalsContact OE2-CZ 3.31Å; E256-R381 IonicContact OE2-NE 2.7Å; E256-R381 PolarHBondContact OE2-NE 2.97Å; E256-R381 VanDerWaalsContact OE2-NE 3.08Å; E256-R381 IonicContact OE2-NH2 3.04Å; E256-R381 PolarHBondContact OE2-NH2 2.93Å; E256-Y385 VanDerWaalsContact CD-OH 3.26Å; E256-Y385 PolarHBondContact OE1-OH 3.31Å; E256-Y385 VanDerWaalsContact OE2-CE1 3.31Å; E256-Y385 WeakPolarHBondContact OE2-CE1 3.27Å; E256-Y385 PolarHBondContact OE2-OH 3.02Å
257	S	94.9	Very high	91.3	Very high	59 Å²	59	36.4 Å²	36.4	41%	0.413	19%	0.185	S	C	.	.	H	α-helix	trans	-63.3	-44	176.5	-173.3	0	0	0	0	111.8	Q253 E254 K261	Q253-S257 WeakPolarHBondContact O-CB 3.28Å; Q253-S257 PolarHBondContact O-N 3.32Å; E254-S257 PolarHBondContact O-N 2.83Å; S257-K261 WeakPolarHBondContact O-CB 3.25Å; S257-K261 PolarHBondContact O-N 2.83Å
258	K	91.2	Very high	91.9	Very high	62 Å²	62	38.7 Å²	38.7	27%	0.27	19%	0.189	S	C	.	.	H	α-helix	trans	-64.6	-39.7	173.1	-71.9	-174.9	179.1	-153.4	0	112.6	I222 K223 E254 K261 T262	I222-K258 HydrophobicContact CD1-CB 4.28Å; K223-K258 PolarHBondContact O-NZ 3.11Å; E254-K258 WeakPolarHBondContact O-CG 3.47Å; E254-K258 PolarHBondContact O-N 3.29Å; K258-K261 PolarHBondContact O-N 3.4Å; K258-T262 PolarHBondContact O-N 2.8Å; K258-T262 PolarHBondContact O-OG1 3.44Å
259	Y	95	Very high	92.3	Very high	1 Å²	1	40.2 Å²	40.2	0%	0.004	20%	0.197	C	C	.	.	H	α-helix	trans	-65.1	-51.5	176.9	177.3	-113.3	0	0	0	112	I222 T255 E256 K261 T262 L263 H297 Y329 V377 P378 R381	I222-Y259 HydrophobicContact CD1-CD2 4.31Å; T255-Y259 WeakPolarHBondContact O-CB 3.15Å; T255-Y259 PolarHBondContact O-N 3.38Å; E256-Y259 PolarHBondContact O-N 3.04Å; Y259-K261 VanDerWaalsContact C-N 3.31Å; Y259-K261 PolarHBondContact O-N 2.98Å; Y259-T262 WeakPolarHBondContact O-CB 3.36Å; Y259-T262 PolarHBondContact O-N 3.26Å; Y259-T262 VanDerWaalsContact O-N 3.07Å; Y259-L263 HydrophobicContact CD1-CD1 4.13Å; Y259-L263 HydrophobicContact CE1-CD1 3.51Å; Y259-L263 HydrophobicContact CE1-CG 4.11Å; Y259-L263 HydrophobicContact CE2-CD1 4.39Å; Y259-L263 HydrophobicContact CE2-CD2 4.18Å; Y259-L263 HydrophobicContact CE2-CG 4.1Å; Y259-L263 PolarHBondContact O-N 2.81Å; Y259-H297 AromaticContact CD1-ND1 3.89Å; Y259-H297 HydrophobicContact CE1-CB 4.32Å; Y259-H297 AromaticContact CE1-CG 3.66Å; Y259-H297 AromaticContact CE1-ND1 3.63Å; Y259-Y329 PolarHBondContact OH-OH 3.46Å; Y259-V377 HydrophobicContact CD2-CG1 4.01Å; Y259-V377 HydrophobicContact CE2-CG1 4.08Å; Y259-P378 HydrophobicContact CE2-CB 4.46Å; Y259-P378 HydrophobicContact CE2-CG 4.41Å; Y259-P378 VanDerWaalsContact OH-CA 3.25Å; Y259-P378 WeakPolarHBondContact OH-CA 3.44Å; Y259-P378 WeakPolarHBondContact OH-CB 3.32Å; Y259-R381 HydrophobicContact CD1-CB 4.34Å; Y259-R381 HydrophobicContact CD1-CG 3.61Å; Y259-R381 HydrophobicContact CD2-CB 3.83Å; Y259-R381 HydrophobicContact CD2-CG 3.88Å; Y259-R381 HydrophobicContact CE1-CB 4.16Å; Y259-R381 HydrophobicContact CE1-CG 3.73Å; Y259-R381 HydrophobicContact CE2-CB 3.68Å; Y259-R381 HydrophobicContact CE2-CG 4.04Å; Y259-R381 HydrophobicContact CG-CB 4.17Å; Y259-R381 HydrophobicContact CG-CG 3.67Å
260	Y	96.2	Very high	92.6	Very high	30 Å²	30	39.9 Å²	39.9	12%	0.118	20%	0.195	C	C	.	.	H	α-helix	trans	-58.9	-41.7	175.4	173.3	-98.7	0	0	0	111.8	E256 T262 L263 E264 I294 H297 F298 L301	E256-Y260 WeakPolarHBondContact O-CB 3.26Å; E256-Y260 PolarHBondContact O-N 3.07Å; Y260-T262 VanDerWaalsContact C-N 3.32Å; Y260-T262 PolarHBondContact O-N 3.12Å; Y260-L263 WeakPolarHBondContact O-CB 3.16Å; Y260-L263 PolarHBondContact O-N 3.34Å; Y260-E264 HydrophobicContact CE1-CB 4.24Å; Y260-E264 HydrophobicContact CE1-CG 4.43Å; Y260-E264 WeakPolarHBondContact O-CB 3.48Å; Y260-E264 PolarHBondContact O-N 2.88Å; Y260-E264 PolarHBondContact OH-OE1 3.47Å; Y260-I294 HydrophobicContact CE2-CG2 4.34Å; Y260-H297 HydrophobicContact CD2-CB 4.44Å; Y260-F298 HydrophobicContact CD2-CB 4.15Å; Y260-F298 HydrophobicContact CE1-CD2 4.29Å; Y260-F298 HydrophobicContact CE2-CB 3.59Å; Y260-F298 HydrophobicContact CE2-CD2 4.08Å; Y260-F298 HydrophobicContact CE2-CG 4.31Å; Y260-F298 AromaticContact CZ-CD2 3.78Å; Y260-L301 HydrophobicContact CD1-CD2 3.89Å; Y260-L301 HydrophobicContact CG-CD2 4.04Å
261	K	93.6	Very high	93.1	Very high	124 Å²	124	37.3 Å²	37.3	54%	0.539	18%	0.179	S	C	.	.	H	α-helix	trans	-59.3	-43.3	174	-175.8	-174.8	171.4	-168	0	111.7	S257 K258 Y259 L263 E264 D265	S257-K261 WeakPolarHBondContact O-CB 3.25Å; S257-K261 PolarHBondContact O-N 2.83Å; K258-K261 PolarHBondContact O-N 3.4Å; Y259-K261 VanDerWaalsContact C-N 3.31Å; Y259-K261 PolarHBondContact O-N 2.98Å; K261-L263 VanDerWaalsContact C-N 3.34Å; K261-L263 PolarHBondContact O-N 2.82Å; K261-E264 PolarHBondContact O-N 2.87Å; K261-D265 WeakPolarHBondContact CE-OD2 3.27Å; K261-D265 WeakPolarHBondContact O-CB 3.48Å; K261-D265 PolarHBondContact O-N 2.95Å
262	T	92.6	Very high	93.5	Very high	7 Å²	7	38 Å²	38	4%	0.043	18%	0.184	C	C	.	.	H	α-helix	trans	-61.9	-42.4	178.1	-55.3	0	0	0	0	111.2	I221 K258 Y259 Y260 D265 I266 L374	I221-T262 HydrophobicContact CG2-CG2 4.11Å; K258-T262 PolarHBondContact O-N 2.8Å; K258-T262 PolarHBondContact O-OG1 3.44Å; Y259-T262 WeakPolarHBondContact O-CB 3.36Å; Y259-T262 PolarHBondContact O-N 3.26Å; Y259-T262 VanDerWaalsContact O-N 3.07Å; Y260-T262 VanDerWaalsContact C-N 3.32Å; Y260-T262 PolarHBondContact O-N 3.12Å; T262-D265 PolarHBondContact O-N 2.78Å; T262-I266 VanDerWaalsContact O-CG1 3.31Å; T262-I266 WeakPolarHBondContact O-CG1 3.3Å; T262-I266 PolarHBondContact O-N 2.84Å; T262-L374 HydrophobicContact CG2-CD2 3.97Å
263	L	95.5	Very high	93.7	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.005	19%	0.19	C	C	.	.	H	α-helix	trans	-60.3	-43.7	172.3	-68.6	179.4	0	0	0	112.6	Y259 Y260 K261 I266 E267 L290 I293 I294 H297 P378	Y259-L263 HydrophobicContact CD1-CD1 4.13Å; Y259-L263 HydrophobicContact CE1-CD1 3.51Å; Y259-L263 HydrophobicContact CE1-CG 4.11Å; Y259-L263 HydrophobicContact CE2-CD1 4.39Å; Y259-L263 HydrophobicContact CE2-CD2 4.18Å; Y259-L263 HydrophobicContact CE2-CG 4.1Å; Y259-L263 PolarHBondContact O-N 2.81Å; Y260-L263 WeakPolarHBondContact O-CB 3.16Å; Y260-L263 PolarHBondContact O-N 3.34Å; K261-L263 VanDerWaalsContact C-N 3.34Å; K261-L263 PolarHBondContact O-N 2.82Å; L263-I266 PolarHBondContact O-N 2.93Å; L263-E267 PolarHBondContact O-N 3.25Å; L263-L290 HydrophobicContact CD2-CD1 3.66Å; L263-I293 HydrophobicContact CD1-CG2 3.89Å; L263-I293 HydrophobicContact CD2-CG2 4.32Å; L263-I294 HydrophobicContact CB-CG1 3.86Å; L263-I294 HydrophobicContact CD1-CG1 4.5Å; L263-H297 HydrophobicContact CD1-CB 3.95Å; L263-P378 HydrophobicContact CD2-CG 4.06Å
264	E	95	Very high	93.7	Very high	50 Å²	50	36.5 Å²	36.5	23%	0.234	18%	0.179	C	C	.	.	H	α-helix	trans	-67.6	-36	179.4	-161.3	-170.3	-120.6	0	0	112.1	Y260 K261 E267 K268	Y260-E264 HydrophobicContact CE1-CB 4.24Å; Y260-E264 HydrophobicContact CE1-CG 4.43Å; Y260-E264 WeakPolarHBondContact O-CB 3.48Å; Y260-E264 PolarHBondContact O-N 2.88Å; Y260-E264 PolarHBondContact OH-OE1 3.47Å; K261-E264 PolarHBondContact O-N 2.87Å; E264-E267 PolarHBondContact O-N 3.1Å; E264-K268 HydrophobicContact CG-CD 3.95Å; E264-K268 VanDerWaalsContact CG-CE 3.45Å; E264-K268 WeakPolarHBondContact O-CB 3.32Å; E264-K268 WeakPolarHBondContact O-CG 3.28Å; E264-K268 PolarHBondContact O-N 3.36Å; E264-K268 IonicContact OE1-NZ 3.59Å; E264-K268 PolarHBondContact OE1-NZ 3.05Å; E264-K268 VanDerWaalsContact OE1-NZ 3.12Å; E264-K268 IonicContact OE2-NZ 2.69Å; E264-K268 PolarHBondContact OE2-NZ 3.13Å
265	D	92.7	Very high	93.9	Very high	32 Å²	32	37.5 Å²	37.5	17%	0.171	18%	0.182	C	C	.	.	H	α-helix	trans	-66.2	-36	172.5	-79.8	-35.1	0	0	0	111.2	K261 T262 N269 V364	K261-D265 WeakPolarHBondContact CE-OD2 3.27Å; K261-D265 WeakPolarHBondContact O-CB 3.48Å; K261-D265 PolarHBondContact O-N 2.95Å; T262-D265 PolarHBondContact O-N 2.78Å; D265-N269 WeakPolarHBondContact CA-ND2 3.47Å; D265-N269 VanDerWaalsContact O-CB 3.24Å; D265-N269 WeakPolarHBondContact O-CB 3.48Å; D265-N269 PolarHBondContact O-N 3.06Å; D265-N269 PolarHBondContact O-ND2 3.11Å; D265-N269 PolarHBondContact OD1-ND2 2.9Å; D265-V364 HydrophobicContact CB-CG1 4.36Å
266	I	94.4	Very high	93.9	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-65.3	-46.1	171.8	-62.6	160.8	0	0	0	110.8	T262 L263 Y270 M271 F287 L290 L371 L374	T262-I266 VanDerWaalsContact O-CG1 3.31Å; T262-I266 WeakPolarHBondContact O-CG1 3.3Å; T262-I266 PolarHBondContact O-N 2.84Å; L263-I266 PolarHBondContact O-N 2.93Å; I266-Y270 WeakPolarHBondContact O-CA 3.32Å; I266-Y270 WeakPolarHBondContact O-CB 3.2Å; I266-Y270 PolarHBondContact O-N 2.97Å; I266-M271 HydrophobicContact CG2-CG 4.31Å; I266-M271 HydrophobicContact CG2-SD 4.5Å; I266-M271 PolarHBondContact O-N 2.76Å; I266-F287 HydrophobicContact CG2-CD1 4.38Å; I266-F287 HydrophobicContact CG2-CE1 3.9Å; I266-L290 HydrophobicContact CB-CD2 4.43Å; I266-L290 HydrophobicContact CG2-CD2 3.66Å; I266-L371 HydrophobicContact CG2-CD1 4.34Å; I266-L374 HydrophobicContact CD1-CB 4.01Å; I266-L374 HydrophobicContact CG1-CB 4.17Å; I266-L374 HydrophobicContact CG1-CD1 4.45Å
267	E	95	Very high	93.7	Very high	51 Å²	51	46.3 Å²	46.3	24%	0.238	23%	0.225	C	C	.	.	I	π-helix	trans	-59.5	-54.2	178.8	-170.5	-177.1	-142.7	0	0	111.7	L263 E264 M271 I272 I294	L263-E267 PolarHBondContact O-N 3.25Å; E264-E267 PolarHBondContact O-N 3.1Å; E267-M271 HydrophobicContact CB-SD 4.39Å; E267-M271 HydrophobicContact CG-SD 4.49Å; E267-M271 WeakPolarHBondContact O-CB 3.2Å; E267-M271 PolarHBondContact O-N 3.13Å; E267-I272 WeakPolarHBondContact O-CG1 3.48Å; E267-I272 PolarHBondContact O-N 2.94Å; E267-I294 HydrophobicContact CB-CD1 3.82Å; E267-I294 HydrophobicContact CG-CD1 4.19Å
268	K	94.3	Very high	93.6	Very high	98 Å²	98	44.1 Å²	44.1	43%	0.426	21%	0.209	S	C	.	.	I	π-helix	trans	-72.5	-40.9	-172.2	-69.6	173.9	-177.8	172	0	113	E264 P273	E264-K268 HydrophobicContact CG-CD 3.95Å; E264-K268 VanDerWaalsContact CG-CE 3.45Å; E264-K268 WeakPolarHBondContact O-CB 3.32Å; E264-K268 WeakPolarHBondContact O-CG 3.28Å; E264-K268 PolarHBondContact O-N 3.36Å; E264-K268 IonicContact OE1-NZ 3.59Å; E264-K268 PolarHBondContact OE1-NZ 3.05Å; E264-K268 VanDerWaalsContact OE1-NZ 3.12Å; E264-K268 IonicContact OE2-NZ 2.69Å; E264-K268 PolarHBondContact OE2-NZ 3.13Å; K268-P273 WeakPolarHBondContact O-CD 3.31Å
269	N	93.8	Very high	93.7	Very high	40 Å²	40	43.8 Å²	43.8	21%	0.214	21%	0.214	C	C	.	.	I	π-helix	trans	-101.5	-20.9	-169.9	-53.5	-70.8	0	0	0	114	D265 P273 C360 V364	D265-N269 WeakPolarHBondContact CA-ND2 3.47Å; D265-N269 VanDerWaalsContact O-CB 3.24Å; D265-N269 WeakPolarHBondContact O-CB 3.48Å; D265-N269 PolarHBondContact O-N 3.06Å; D265-N269 PolarHBondContact O-ND2 3.11Å; D265-N269 PolarHBondContact OD1-ND2 2.9Å; N269-P273 WeakPolarHBondContact O-CG 3.4Å; N269-C360 VanDerWaalsContact O-CB 3.27Å; N269-C360 WeakPolarHBondContact O-CB 3.49Å; N269-C360 PolarHBondContact O-SG 2.95Å; N269-V364 HydrophobicContact CB-CG2 3.38Å
270	Y	94.3	Very high	93.6	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.249	C	C	.	.	I	π-helix	trans	-112.7	-55.8	174.3	-68.2	-85	0	0	0	112.6	I266 I272 P273 L274 C360 T361 V364 L371 L374	I266-Y270 WeakPolarHBondContact O-CA 3.32Å; I266-Y270 WeakPolarHBondContact O-CB 3.2Å; I266-Y270 PolarHBondContact O-N 2.97Å; Y270-I272 PolarHBondContact O-N 3.3Å; Y270-P273 WeakPolarHBondContact O-CD 3.39Å; Y270-L274 HydrophobicContact CD1-CD1 4.42Å; Y270-L274 WeakPolarHBondContact O-CB 3.41Å; Y270-L274 WeakPolarHBondContact O-CG 3.46Å; Y270-L274 PolarHBondContact O-N 2.87Å; Y270-C360 HydrophobicContact CD1-CB 3.39Å; Y270-C360 HydrophobicContact CE1-CB 3.57Å; Y270-C360 HydrophobicContact CG-CB 4.11Å; Y270-T361 VanDerWaalsContact OH-CA 3.25Å; Y270-T361 WeakPolarHBondContact OH-CA 3.43Å; Y270-T361 WeakPolarHBondContact OH-CB 3.28Å; Y270-T361 PolarHBondContact OH-OG1 3.15Å; Y270-V364 HydrophobicContact CD2-CG2 4.07Å; Y270-V364 HydrophobicContact CE2-CB 3.99Å; Y270-V364 HydrophobicContact CE2-CG1 4.29Å; Y270-V364 HydrophobicContact CE2-CG2 3.65Å; Y270-L371 HydrophobicContact CD1-CB 4.07Å; Y270-L371 HydrophobicContact CD1-CD1 4.04Å; Y270-L371 HydrophobicContact CD1-CD2 3.89Å; Y270-L371 HydrophobicContact CD1-CG 4.22Å; Y270-L371 HydrophobicContact CD2-CD1 4.05Å; Y270-L371 HydrophobicContact CE1-CB 3.71Å; Y270-L371 HydrophobicContact CE1-CD1 4.36Å; Y270-L371 HydrophobicContact CE1-CD2 4.36Å; Y270-L371 HydrophobicContact CE1-CG 4.36Å; Y270-L371 HydrophobicContact CE2-CD1 4.34Å; Y270-L371 HydrophobicContact CG-CD1 3.85Å; Y270-L371 HydrophobicContact CG-CD2 4.35Å; Y270-L371 PolarHBondContact OH-N 3.13Å; Y270-L374 HydrophobicContact CE2-CD1 3.66Å
271	M	94.8	Very high	93.4	Very high	6 Å²	6	54.8 Å²	54.8	3%	0.03	28%	0.278	C	S	.	.	I	π-helix	trans	-63.6	-44.2	-173	-62.9	174.8	69.3	0	0	112.5	I266 E267 K275 M283 F287 L290 E291 I294	I266-M271 HydrophobicContact CG2-CG 4.31Å; I266-M271 HydrophobicContact CG2-SD 4.5Å; I266-M271 PolarHBondContact O-N 2.76Å; E267-M271 HydrophobicContact CB-SD 4.39Å; E267-M271 HydrophobicContact CG-SD 4.49Å; E267-M271 WeakPolarHBondContact O-CB 3.2Å; E267-M271 PolarHBondContact O-N 3.13Å; M271-K275 WeakPolarHBondContact O-CB 3.41Å; M271-K275 WeakPolarHBondContact O-CG 3.26Å; M271-K275 PolarHBondContact O-N 3.12Å; M271-K275 VanDerWaalsContact O-N 3.09Å; M271-M283 HydrophobicContact CB-CE 4.31Å; M271-F287 HydrophobicContact CE-CB 4.1Å; M271-F287 HydrophobicContact CE-CD1 4.4Å; M271-F287 HydrophobicContact CE-CG 4.23Å; M271-F287 HydrophobicContact CG-CD1 3.48Å; M271-F287 VanDerWaalsContact CG-CD1 3.48Å; M271-F287 HydrophobicContact CG-CD2 4.27Å; M271-F287 HydrophobicContact CG-CE1 3.41Å; M271-F287 VanDerWaalsContact CG-CE1 3.41Å; M271-F287 HydrophobicContact CG-CE2 4.21Å; M271-F287 HydrophobicContact CG-CG 3.91Å; M271-F287 HydrophobicContact CG-CZ 3.8Å; M271-F287 HydrophobicContact SD-CD1 3.92Å; M271-F287 HydrophobicContact SD-CE1 4.37Å; M271-F287 HydrophobicContact SD-CG 4.34Å; M271-L290 HydrophobicContact SD-CD2 4.07Å; M271-E291 HydrophobicContact CE-CB 4.46Å; M271-I294 HydrophobicContact SD-CD1 4.24Å
272	I	93.8	Very high	93.5	Very high	92 Å²	92	50.8 Å²	50.8	47%	0.472	26%	0.261	S	S	.	.	H	α-helix	trans	-66.5	-46.6	179.3	-68.8	175	0	0	0	112.3	E267 Y270	E267-I272 WeakPolarHBondContact O-CG1 3.48Å; E267-I272 PolarHBondContact O-N 2.94Å; Y270-I272 PolarHBondContact O-N 3.3Å
273	P	93.1	Very high	93.6	Very high	21 Å²	21	51.3 Å²	51.3	14%	0.136	26%	0.264	C	S	.	.	H	α-helix	trans	-67.4	-36.6	175	-27.8	39.4	0	0	0	114.6	K268 N269 Y270 Q276	K268-P273 WeakPolarHBondContact O-CD 3.31Å; N269-P273 WeakPolarHBondContact O-CG 3.4Å; Y270-P273 WeakPolarHBondContact O-CD 3.39Å; P273-Q276 WeakPolarHBondContact O-CB 3.37Å; P273-Q276 PolarHBondContact O-N 2.93Å
274	L	93.4	Very high	93.5	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-74.9	-25.3	-178.5	-66.9	173.6	0	0	0	113	Y270 Q276 V277 L278 M283 F287 M353 K356 V357 L371	Y270-L274 HydrophobicContact CD1-CD1 4.42Å; Y270-L274 WeakPolarHBondContact O-CB 3.41Å; Y270-L274 WeakPolarHBondContact O-CG 3.46Å; Y270-L274 PolarHBondContact O-N 2.87Å; L274-Q276 PolarHBondContact O-N 3.2Å; L274-V277 PolarHBondContact O-N 3.41Å; L274-L278 HydrophobicContact CB-CD1 4.1Å; L274-L278 HydrophobicContact CB-CG 4.45Å; L274-L278 WeakPolarHBondContact O-CB 3.49Å; L274-L278 PolarHBondContact O-N 2.94Å; L274-M283 HydrophobicContact CB-SD 4.17Å; L274-F287 HydrophobicContact CD1-CE2 4.26Å; L274-F287 HydrophobicContact CD1-CZ 4Å; L274-M353 HydrophobicContact CD1-CE 4.38Å; L274-M353 HydrophobicContact CD2-CE 4.09Å; L274-M353 HydrophobicContact CD2-SD 3.66Å; L274-K356 HydrophobicContact CD2-CB 4.22Å; L274-K356 HydrophobicContact CD2-CG 3.87Å; L274-V357 HydrophobicContact CD1-CG2 4.47Å; L274-V357 HydrophobicContact CD2-CG2 4.17Å; L274-L371 HydrophobicContact CD1-CD2 3.91Å
275	K	93.2	Very high	93.4	Very high	103 Å²	103	56.9 Å²	56.9	45%	0.448	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-8.8	166.8	-79.5	170	-178	-179.8	0	113.9	M271 M283 E291	M271-K275 WeakPolarHBondContact O-CB 3.41Å; M271-K275 WeakPolarHBondContact O-CG 3.26Å; M271-K275 PolarHBondContact O-N 3.12Å; M271-K275 VanDerWaalsContact O-N 3.09Å; K275-M283 HydrophobicContact CD-CE 4.39Å; K275-M283 HydrophobicContact CG-CE 3.7Å; K275-M283 HydrophobicContact CG-CG 4.18Å; K275-M283 HydrophobicContact CG-SD 3.94Å; K275-E291 IonicContact NZ-OE2 2.66Å; K275-E291 PolarHBondContact NZ-OE2 3.1Å
276	Q	90.7	Very high	93.5	Very high	154 Å²	154	55.4 Å²	55.4	72%	0.72	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-13.8	174.5	-54.3	-179.5	-1.1	0	0	114	P273 L274	P273-Q276 WeakPolarHBondContact O-CB 3.37Å; P273-Q276 PolarHBondContact O-N 2.93Å; L274-Q276 PolarHBondContact O-N 3.2Å
277	V	90.9	Very high	93.6	Very high	40 Å²	40	55.6 Å²	55.6	24%	0.242	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.6	-29.3	-171.6	-179.8	0	0	0	0	111.6	L274 R350 D352 K356	L274-V277 PolarHBondContact O-N 3.41Å; V277-R350 PolarHBondContact O-NH1 2.86Å; V277-R350 PolarHBondContact O-NH2 2.86Å; V277-D352 WeakPolarHBondContact CG1-OD2 3.39Å; V277-K356 HydrophobicContact CG2-CB 4.49Å; V277-K356 HydrophobicContact CG2-CD 4.3Å; V277-K356 HydrophobicContact CG2-CG 4.05Å
278	L	91.4	Very high	93.6	Very high	13 Å²	13	54.4 Å²	54.4	7%	0.068	28%	0.284	C	S	.	.	S	Bend	trans	-100	144.4	178.1	-62.2	-177.4	0	0	0	111.4	L274 E282 M283 I286 L346 M353	L274-L278 HydrophobicContact CB-CD1 4.1Å; L274-L278 HydrophobicContact CB-CG 4.45Å; L274-L278 WeakPolarHBondContact O-CB 3.49Å; L274-L278 PolarHBondContact O-N 2.94Å; L278-E282 HydrophobicContact CB-CB 3.99Å; L278-E282 HydrophobicContact CD1-CB 4.48Å; L278-E282 HydrophobicContact CD2-CB 4.11Å; L278-E282 HydrophobicContact CG-CB 4.42Å; L278-M283 HydrophobicContact CB-CG 3.92Å; L278-M283 HydrophobicContact CB-SD 4.04Å; L278-M283 HydrophobicContact CD1-SD 3.89Å; L278-I286 HydrophobicContact CD1-CD1 3.67Å; L278-L346 HydrophobicContact CD2-CD1 4.18Å; L278-M353 HydrophobicContact CD1-CE 3.92Å; L278-M353 HydrophobicContact CD1-SD 4.34Å; L278-M353 HydrophobicContact CD2-CE 4.08Å; L278-M353 HydrophobicContact CD2-CG 4.46Å; L278-M353 HydrophobicContact CD2-SD 3.76Å; L278-M353 HydrophobicContact CG-CE 4.35Å; L278-M353 HydrophobicContact CG-SD 4.15Å
279	S	93.3	Very high	93.7	Very high	55 Å²	55	50.2 Å²	50.2	39%	0.385	27%	0.266	S	S	.	.			trans	-67.6	162.7	166.5	66.2	0	0	0	0	111.7	Q281 E282 M283	S279-Q281 PolarHBondContact O-N 3Å; S279-E282 VanDerWaalsContact CB-OE2 3.23Å; S279-E282 WeakPolarHBondContact CB-OE2 3.44Å; S279-E282 PolarHBondContact N-OE2 3.15Å; S279-E282 PolarHBondContact O-N 2.87Å; S279-E282 WeakPolarHBondContact OG-CG 3.29Å; S279-E282 PolarHBondContact OG-N 2.84Å; S279-E282 PolarHBondContact OG-OE2 2.9Å; S279-M283 WeakPolarHBondContact O-CG 3.27Å; S279-M283 PolarHBondContact O-N 3Å
280	S	93	Very high	93.8	Very high	105 Å²	105	48.3 Å²	48.3	73%	0.734	26%	0.257	S	S	*	.	H	α-helix	trans	-57.4	-32.3	176.6	-48.6	0	0	0	0	113.2	E284	S280-E284 WeakPolarHBondContact O-CB 3.24Å; S280-E284 PolarHBondContact O-N 3.44Å
281	Q	93.8	Very high	93.9	Very high	157 Å²	157	51.5 Å²	51.5	73%	0.734	27%	0.271	S	S	*	.	H	α-helix	trans	-74.6	-40.6	178.3	-69.9	-179.9	-18.5	0	0	112.2	S279 M283 E284 A285	S279-Q281 PolarHBondContact O-N 3Å; Q281-M283 VanDerWaalsContact C-N 3.33Å; Q281-E284 PolarHBondContact O-N 2.97Å; Q281-A285 VanDerWaalsContact O-CB 3.26Å; Q281-A285 WeakPolarHBondContact O-CB 3.33Å; Q281-A285 PolarHBondContact O-N 2.83Å
282	E	93.6	Very high	94	Very high	40 Å²	40	54.4 Å²	54.4	19%	0.187	29%	0.287	C	S	.	.	H	α-helix	trans	-64.6	-39.3	172.3	-70	161.1	115.2	0	0	111	L278 S279 A285 I286 L346 R350	L278-E282 HydrophobicContact CB-CB 3.99Å; L278-E282 HydrophobicContact CD1-CB 4.48Å; L278-E282 HydrophobicContact CD2-CB 4.11Å; L278-E282 HydrophobicContact CG-CB 4.42Å; S279-E282 VanDerWaalsContact CB-OE2 3.23Å; S279-E282 WeakPolarHBondContact CB-OE2 3.44Å; S279-E282 PolarHBondContact N-OE2 3.15Å; S279-E282 PolarHBondContact O-N 2.87Å; S279-E282 WeakPolarHBondContact OG-CG 3.29Å; S279-E282 PolarHBondContact OG-N 2.84Å; S279-E282 PolarHBondContact OG-OE2 2.9Å; E282-A285 PolarHBondContact O-N 2.91Å; E282-I286 WeakPolarHBondContact O-CB 3.11Å; E282-I286 WeakPolarHBondContact O-CG1 3.45Å; E282-I286 PolarHBondContact O-N 2.82Å; E282-L346 HydrophobicContact CB-CD1 4.3Å; E282-L346 HydrophobicContact CG-CD1 4.09Å; E282-L346 VanDerWaalsContact OE1-CD2 3.26Å; E282-L346 WeakPolarHBondContact OE1-CD2 3.5Å; E282-R350 IonicContact OE1-NH1 2.74Å; E282-R350 PolarHBondContact OE1-NH1 2.83Å; E282-R350 IonicContact OE2-NH1 3.12Å
283	M	94.7	Very high	94.2	Very high	18 Å²	18	50 Å²	50	9%	0.089	27%	0.265	C	S	.	.	H	α-helix	trans	-61.7	-46.7	174.4	-77.4	-63.1	-49.3	0	0	112.5	M271 L274 K275 L278 S279 Q281 I286 F287	M271-M283 HydrophobicContact CB-CE 4.31Å; L274-M283 HydrophobicContact CB-SD 4.17Å; K275-M283 HydrophobicContact CD-CE 4.39Å; K275-M283 HydrophobicContact CG-CE 3.7Å; K275-M283 HydrophobicContact CG-CG 4.18Å; K275-M283 HydrophobicContact CG-SD 3.94Å; L278-M283 HydrophobicContact CB-CG 3.92Å; L278-M283 HydrophobicContact CB-SD 4.04Å; L278-M283 HydrophobicContact CD1-SD 3.89Å; S279-M283 WeakPolarHBondContact O-CG 3.27Å; S279-M283 PolarHBondContact O-N 3Å; Q281-M283 VanDerWaalsContact C-N 3.33Å; M283-I286 PolarHBondContact O-N 2.7Å; M283-F287 HydrophobicContact CE-CD2 3.38Å; M283-F287 HydrophobicContact CE-CE2 3.61Å; M283-F287 HydrophobicContact CE-CG 4.28Å; M283-F287 WeakPolarHBondContact O-CB 3.27Å; M283-F287 PolarHBondContact O-N 3.3Å; M283-F287 HydrophobicContact SD-CD2 4.09Å; M283-F287 HydrophobicContact SD-CE2 3.96Å
284	E	93.8	Very high	94.4	Very high	137 Å²	137	49.4 Å²	49.4	64%	0.64	26%	0.26	S	S	*	.	H	α-helix	trans	-65.3	-39.4	176.3	-173.7	173.5	-168.3	0	0	111.5	S280 Q281 V288	S280-E284 WeakPolarHBondContact O-CB 3.24Å; S280-E284 PolarHBondContact O-N 3.44Å; Q281-E284 PolarHBondContact O-N 2.97Å; E284-V288 WeakPolarHBondContact O-CA 3.42Å; E284-V288 PolarHBondContact O-N 3.07Å
285	A	93.3	Very high	94.6	Very high	32 Å²	32	55.1 Å²	55.1	26%	0.264	28%	0.281	S	S	.	.	H	α-helix	trans	-67.4	-34.5	177.9	0	0	0	0	0	113.8	Q281 E282 A339 T342	Q281-A285 VanDerWaalsContact O-CB 3.26Å; Q281-A285 WeakPolarHBondContact O-CB 3.33Å; Q281-A285 PolarHBondContact O-N 2.83Å; E282-A285 PolarHBondContact O-N 2.91Å; A285-A339 VanDerWaalsContact O-CA 3.22Å; A285-A339 WeakPolarHBondContact O-CA 3.28Å; A285-A339 WeakPolarHBondContact O-CB 3.41Å; A285-T342 HydrophobicContact CB-CG2 4.08Å
286	I	95.3	Very high	94.9	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-87.8	-39.9	-178.8	-67.4	164	0	0	0	112.6	L278 E282 M283 A339 T342 L343 L346 M353 L375	L278-I286 HydrophobicContact CD1-CD1 3.67Å; E282-I286 WeakPolarHBondContact O-CB 3.11Å; E282-I286 WeakPolarHBondContact O-CG1 3.45Å; E282-I286 PolarHBondContact O-N 2.82Å; M283-I286 PolarHBondContact O-N 2.7Å; I286-A339 WeakPolarHBondContact O-CB 3.36Å; I286-T342 HydrophobicContact CD1-CG2 4.48Å; I286-T342 HydrophobicContact CG1-CG2 4Å; I286-L343 HydrophobicContact CD1-CB 4.41Å; I286-L343 HydrophobicContact CD1-CD1 4.24Å; I286-L343 HydrophobicContact CG1-CB 4.25Å; I286-L343 HydrophobicContact CG2-CB 4.35Å; I286-L343 HydrophobicContact CG2-CD1 4.48Å; I286-L343 HydrophobicContact CG2-CD2 4.49Å; I286-L346 HydrophobicContact CD1-CD1 3.7Å; I286-M353 HydrophobicContact CD1-CE 4.41Å; I286-L375 HydrophobicContact CG2-CD1 4.32Å
287	F	96.1	Very high	95.2	Very high	5 Å²	5	43.3 Å²	43.3	2%	0.022	23%	0.229	C	C	.	.	H	α-helix	trans	-102.8	-7.7	-174.4	-65.3	-81.3	0	0	0	113.9	I266 M271 L274 M283 N289 L290 L371 L375	I266-F287 HydrophobicContact CG2-CD1 4.38Å; I266-F287 HydrophobicContact CG2-CE1 3.9Å; M271-F287 HydrophobicContact CE-CB 4.1Å; M271-F287 HydrophobicContact CE-CD1 4.4Å; M271-F287 HydrophobicContact CE-CG 4.23Å; M271-F287 HydrophobicContact CG-CD1 3.48Å; M271-F287 VanDerWaalsContact CG-CD1 3.48Å; M271-F287 HydrophobicContact CG-CD2 4.27Å; M271-F287 HydrophobicContact CG-CE1 3.41Å; M271-F287 VanDerWaalsContact CG-CE1 3.41Å; M271-F287 HydrophobicContact CG-CE2 4.21Å; M271-F287 HydrophobicContact CG-CG 3.91Å; M271-F287 HydrophobicContact CG-CZ 3.8Å; M271-F287 HydrophobicContact SD-CD1 3.92Å; M271-F287 HydrophobicContact SD-CE1 4.37Å; M271-F287 HydrophobicContact SD-CG 4.34Å; L274-F287 HydrophobicContact CD1-CE2 4.26Å; L274-F287 HydrophobicContact CD1-CZ 4Å; M283-F287 HydrophobicContact CE-CD2 3.38Å; M283-F287 HydrophobicContact CE-CE2 3.61Å; M283-F287 HydrophobicContact CE-CG 4.28Å; M283-F287 WeakPolarHBondContact O-CB 3.27Å; M283-F287 PolarHBondContact O-N 3.3Å; M283-F287 HydrophobicContact SD-CD2 4.09Å; M283-F287 HydrophobicContact SD-CE2 3.96Å; F287-N289 PolarHBondContact O-N 2.67Å; F287-N289 VanDerWaalsContact O-N 3.07Å; F287-L290 HydrophobicContact CD1-CD2 4.02Å; F287-L290 WeakPolarHBondContact O-CB 3.12Å; F287-L290 PolarHBondContact O-N 3.16Å; F287-L371 HydrophobicContact CE1-CD1 4.09Å; F287-L371 HydrophobicContact CE1-CD2 4.46Å; F287-L371 HydrophobicContact CZ-CD1 4.41Å; F287-L371 HydrophobicContact CZ-CD2 4Å; F287-L375 HydrophobicContact CD1-CD2 4.21Å; F287-L375 HydrophobicContact CE1-CD2 4.42Å
288	V	95.1	Very high	95.5	Very high	27 Å²	27	45.9 Å²	45.9	16%	0.164	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.7	-113.1	176.3	-164.4	0	0	0	0	110.5	E284 Q331 Y332 H335 A339	E284-V288 WeakPolarHBondContact O-CA 3.42Å; E284-V288 PolarHBondContact O-N 3.07Å; V288-Q331 HydrophobicContact CG1-CG 4.06Å; V288-Y332 HydrophobicContact CB-CD2 4.15Å; V288-H335 HydrophobicContact CG1-CB 3.95Å; V288-H335 HydrophobicContact CG2-CB 3.79Å; V288-A339 HydrophobicContact CG2-CB 4.21Å
289	N	95.6	Very high	95.9	Very high	9 Å²	9	46.6 Å²	46.6	5%	0.048	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.7	28	177.6	64.8	-12.4	0	0	0	112.6	F287 E291 D292 I293 I328 Q331 Y332	F287-N289 PolarHBondContact O-N 2.67Å; F287-N289 VanDerWaalsContact O-N 3.07Å; N289-E291 PolarHBondContact O-N 3.1Å; N289-E291 VanDerWaalsContact O-N 3.14Å; N289-D292 PolarHBondContact O-N 2.81Å; N289-I293 PolarHBondContact O-N 2.55Å; N289-I328 PolarHBondContact ND2-O 3.06Å; N289-Q331 PolarHBondContact ND2-OE1 3.24Å; N289-Y332 WeakPolarHBondContact OD1-CB 3.48Å; N289-Y332 WeakPolarHBondContact OD1-CD2 3.47Å
290	L	96.3	Very high	96.1	Very high	1 Å²	1	44 Å²	44	1%	0.005	23%	0.226	C	C	.	.	H	α-helix	trans	-56.3	-31.7	-178.4	-168.2	64.7	0	0	0	113	L263 I266 M271 F287 D292 I293 I294 Y332 L375 P378	L263-L290 HydrophobicContact CD2-CD1 3.66Å; I266-L290 HydrophobicContact CB-CD2 4.43Å; I266-L290 HydrophobicContact CG2-CD2 3.66Å; M271-L290 HydrophobicContact SD-CD2 4.07Å; F287-L290 HydrophobicContact CD1-CD2 4.02Å; F287-L290 WeakPolarHBondContact O-CB 3.12Å; F287-L290 PolarHBondContact O-N 3.16Å; L290-D292 VanDerWaalsContact C-N 3.27Å; L290-D292 PolarHBondContact O-N 2.87Å; L290-I293 HydrophobicContact CD1-CB 4.35Å; L290-I293 HydrophobicContact CD1-CD1 4.34Å; L290-I293 WeakPolarHBondContact O-CB 3.4Å; L290-I293 PolarHBondContact O-N 3.04Å; L290-I293 VanDerWaalsContact O-N 3.12Å; L290-I294 HydrophobicContact CG-CD1 4.19Å; L290-I294 WeakPolarHBondContact O-CD1 3.44Å; L290-I294 WeakPolarHBondContact O-CG1 3.43Å; L290-I294 PolarHBondContact O-N 2.89Å; L290-Y332 HydrophobicContact CB-CE2 4.07Å; L290-Y332 HydrophobicContact CD1-CE2 3.85Å; L290-Y332 HydrophobicContact CG-CE2 4.5Å; L290-L375 HydrophobicContact CD2-CD2 4.35Å; L290-P378 HydrophobicContact CD1-CG 4.05Å
291	E	96	Very high	96.3	Very high	67 Å²	67	39.7 Å²	39.7	31%	0.313	20%	0.195	S	C	.	.	H	α-helix	trans	-61.4	-33.8	175.8	-151.1	-176.5	92.9	0	0	112.3	M271 K275 N289 R295	M271-E291 HydrophobicContact CE-CB 4.46Å; K275-E291 IonicContact NZ-OE2 2.66Å; K275-E291 PolarHBondContact NZ-OE2 3.1Å; N289-E291 PolarHBondContact O-N 3.1Å; N289-E291 VanDerWaalsContact O-N 3.14Å; E291-R295 WeakPolarHBondContact O-CG 3.25Å; E291-R295 PolarHBondContact O-N 3.25Å; E291-R295 VanDerWaalsContact O-N 3.11Å; E291-R295 IonicContact OE1-CZ 3.7Å; E291-R295 IonicContact OE1-NH1 2.81Å; E291-R295 PolarHBondContact OE1-NH1 3.42Å; E291-R295 IonicContact OE1-NH2 2.67Å; E291-R295 PolarHBondContact OE1-NH2 3.3Å
292	D	97.3	Very high	96.4	Very high	67 Å²	67	39 Å²	39	36%	0.358	19%	0.186	S	C	.	.	H	α-helix	trans	-76.9	-32.7	173.2	-72.4	-50.6	0	0	0	112.5	N289 L290 R295 V296 I328	N289-D292 PolarHBondContact O-N 2.81Å; L290-D292 VanDerWaalsContact C-N 3.27Å; L290-D292 PolarHBondContact O-N 2.87Å; D292-R295 PolarHBondContact O-N 2.93Å; D292-R295 IonicContact OD1-CZ 3.44Å; D292-R295 VanDerWaalsContact OD1-CZ 3.23Å; D292-R295 IonicContact OD1-NE 2.64Å; D292-R295 PolarHBondContact OD1-NE 3.28Å; D292-R295 IonicContact OD1-NH2 3.58Å; D292-R295 PolarHBondContact OD1-NH2 2.67Å; D292-R295 IonicContact OD2-NH2 3.53Å; D292-V296 WeakPolarHBondContact O-CG2 3.45Å; D292-V296 PolarHBondContact O-N 3.27Å; D292-I328 HydrophobicContact CB-CD1 3.93Å
293	I	97.8	Very high	96.6	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62.7	-48.9	171.5	-62.2	177.5	0	0	0	109.5	L263 N289 L290 R295 V296 H297 I328 Y329 Y332	L263-I293 HydrophobicContact CD1-CG2 3.89Å; L263-I293 HydrophobicContact CD2-CG2 4.32Å; N289-I293 PolarHBondContact O-N 2.55Å; L290-I293 HydrophobicContact CD1-CB 4.35Å; L290-I293 HydrophobicContact CD1-CD1 4.34Å; L290-I293 WeakPolarHBondContact O-CB 3.4Å; L290-I293 PolarHBondContact O-N 3.04Å; L290-I293 VanDerWaalsContact O-N 3.12Å; I293-R295 VanDerWaalsContact C-N 3.32Å; I293-R295 PolarHBondContact O-N 2.81Å; I293-V296 PolarHBondContact O-N 2.98Å; I293-V296 VanDerWaalsContact O-N 3.09Å; I293-H297 PolarHBondContact O-CD2 3.07Å; I293-H297 VanDerWaalsContact O-CD2 3.23Å; I293-H297 PolarHBondContact O-N 2.96Å; I293-I328 HydrophobicContact CB-CD1 4.48Å; I293-I328 HydrophobicContact CG1-CD1 3.81Å; I293-I328 HydrophobicContact CG1-CG1 4.18Å; I293-Y329 HydrophobicContact CD1-CD1 4.11Å; I293-Y329 HydrophobicContact CD1-CE1 3.92Å; I293-Y329 HydrophobicContact CG2-CE1 4.29Å; I293-Y329 HydrophobicContact CG2-CE2 4.44Å; I293-Y329 WeakPolarHBondContact CG2-OH 3.41Å; I293-Y332 HydrophobicContact CD1-CD1 4.17Å; I293-Y332 HydrophobicContact CD1-CD2 3.63Å; I293-Y332 HydrophobicContact CD1-CE2 4.27Å; I293-Y332 HydrophobicContact CD1-CG 3.58Å
294	I	97.9	Very high	96.6	Very high	8 Å²	8	37.5 Å²	37.5	4%	0.041	18%	0.183	C	C	.	.	H	α-helix	trans	-52	-49.6	173	-69.1	152.4	0	0	0	110.7	Y260 L263 E267 M271 L290 V296 H297 F298	Y260-I294 HydrophobicContact CE2-CG2 4.34Å; L263-I294 HydrophobicContact CB-CG1 3.86Å; L263-I294 HydrophobicContact CD1-CG1 4.5Å; E267-I294 HydrophobicContact CB-CD1 3.82Å; E267-I294 HydrophobicContact CG-CD1 4.19Å; M271-I294 HydrophobicContact SD-CD1 4.24Å; L290-I294 HydrophobicContact CG-CD1 4.19Å; L290-I294 WeakPolarHBondContact O-CD1 3.44Å; L290-I294 WeakPolarHBondContact O-CG1 3.43Å; L290-I294 PolarHBondContact O-N 2.89Å; I294-V296 PolarHBondContact O-N 3.25Å; I294-H297 PolarHBondContact O-N 3.14Å; I294-F298 WeakPolarHBondContact O-CB 3.49Å; I294-F298 PolarHBondContact O-N 3.06Å
295	R	97.9	Very high	96.7	Very high	119 Å²	119	33.4 Å²	33.4	45%	0.449	17%	0.166	S	C	.	.	H	α-helix	trans	-61.9	-35.6	177.2	-76.7	-172.5	-81.7	-99.4	5.8	114.1	E291 D292 I293	E291-R295 WeakPolarHBondContact O-CG 3.25Å; E291-R295 PolarHBondContact O-N 3.25Å; E291-R295 VanDerWaalsContact O-N 3.11Å; E291-R295 IonicContact OE1-CZ 3.7Å; E291-R295 IonicContact OE1-NH1 2.81Å; E291-R295 PolarHBondContact OE1-NH1 3.42Å; E291-R295 IonicContact OE1-NH2 2.67Å; E291-R295 PolarHBondContact OE1-NH2 3.3Å; D292-R295 PolarHBondContact O-N 2.93Å; D292-R295 IonicContact OD1-CZ 3.44Å; D292-R295 VanDerWaalsContact OD1-CZ 3.23Å; D292-R295 IonicContact OD1-NE 2.64Å; D292-R295 PolarHBondContact OD1-NE 3.28Å; D292-R295 IonicContact OD1-NH2 3.58Å; D292-R295 PolarHBondContact OD1-NH2 2.67Å; D292-R295 IonicContact OD2-NH2 3.53Å; I293-R295 VanDerWaalsContact C-N 3.32Å; I293-R295 PolarHBondContact O-N 2.81Å
296	V	98.1	Very high	96.7	Very high	10 Å²	10	37.7 Å²	37.7	6%	0.061	18%	0.181	C	C	.	.	H	α-helix	trans	-73.6	-45.7	177.1	170.7	0	0	0	0	110.9	D292 I293 I294 A299 L300 F322 R325 L326 I328	D292-V296 WeakPolarHBondContact O-CG2 3.45Å; D292-V296 PolarHBondContact O-N 3.27Å; I293-V296 PolarHBondContact O-N 2.98Å; I293-V296 VanDerWaalsContact O-N 3.09Å; I294-V296 PolarHBondContact O-N 3.25Å; V296-A299 WeakPolarHBondContact O-CB 3.28Å; V296-A299 PolarHBondContact O-N 3.21Å; V296-A299 VanDerWaalsContact O-N 3.16Å; V296-L300 PolarHBondContact O-N 3.43Å; V296-F322 HydrophobicContact CG1-CD1 4.17Å; V296-F322 HydrophobicContact CG1-CE1 4.49Å; V296-R325 HydrophobicContact CG1-CB 4.19Å; V296-R325 HydrophobicContact CG2-CB 4.19Å; V296-L326 HydrophobicContact CG1-CD2 3.97Å; V296-I328 HydrophobicContact CB-CD1 4.29Å; V296-I328 HydrophobicContact CG2-CD1 3.75Å
297	H	98.2	Very high	96.6	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-74.7	-31.9	-175.4	-75.5	-82.1	0	0	0	113.5	E256 Y259 Y260 L263 I293 I294 A299 L300 L301 L326 Y329 Y385	E256-H297 IonicContact OE1-CE1 3.62Å; E256-H297 IonicContact OE1-CG 2.67Å; E256-H297 IonicContact OE1-ND1 3.99Å; E256-H297 PolarHBondContact OE1-ND1 3.05Å; Y259-H297 AromaticContact CD1-ND1 3.89Å; Y259-H297 HydrophobicContact CE1-CB 4.32Å; Y259-H297 AromaticContact CE1-CG 3.66Å; Y259-H297 AromaticContact CE1-ND1 3.63Å; Y260-H297 HydrophobicContact CD2-CB 4.44Å; L263-H297 HydrophobicContact CD1-CB 3.95Å; I293-H297 PolarHBondContact O-CD2 3.07Å; I293-H297 VanDerWaalsContact O-CD2 3.23Å; I293-H297 PolarHBondContact O-N 2.96Å; I294-H297 PolarHBondContact O-N 3.14Å; H297-A299 VanDerWaalsContact C-N 3.25Å; H297-A299 PolarHBondContact O-N 2.88Å; H297-L300 PolarHBondContact O-N 3.35Å; H297-L301 WeakPolarHBondContact O-CB 3.46Å; H297-L301 PolarHBondContact O-N 2.93Å; H297-L326 WeakPolarHBondContact NE2-CD2 3.27Å; H297-Y329 AromaticContact NE2-CE2 3.39Å; H297-Y329 WeakPolarHBondContact NE2-CE2 3.37Å; H297-Y329 AromaticContact NE2-CZ 3.66Å; H297-Y329 PolarHBondContact NE2-OH 3.41Å; H297-Y385 AromaticContact CE1-CZ 3.99Å; H297-Y385 PolarHBondContact CE1-OH 3.07Å; H297-Y385 PolarHBondContact ND1-OH 3.37Å
298	F	97.9	Very high	96.3	Very high	93 Å²	93	40.8 Å²	40.8	41%	0.408	20%	0.197	S	C	.	.	H	α-helix	trans	-55.8	-42.1	166.3	179	-114.5	0	0	0	112.1	Y260 I294 R302	Y260-F298 HydrophobicContact CD2-CB 4.15Å; Y260-F298 HydrophobicContact CE1-CD2 4.29Å; Y260-F298 HydrophobicContact CE2-CB 3.59Å; Y260-F298 HydrophobicContact CE2-CD2 4.08Å; Y260-F298 HydrophobicContact CE2-CG 4.31Å; Y260-F298 AromaticContact CZ-CD2 3.78Å; I294-F298 WeakPolarHBondContact O-CB 3.49Å; I294-F298 PolarHBondContact O-N 3.06Å; F298-R302 HydrophobicContact CE2-CG 4.44Å; F298-R302 WeakPolarHBondContact O-CB 3.4Å; F298-R302 WeakPolarHBondContact O-CG 3.42Å; F298-R302 PolarHBondContact O-N 2.78Å
299	A	98.1	Very high	95.9	Very high	28 Å²	28	46.3 Å²	46.3	23%	0.231	23%	0.225	C	C	.	.	H	α-helix	trans	-74.5	-34.1	178.5	0	0	0	0	0	112.5	V296 H297 A303 F322	V296-A299 WeakPolarHBondContact O-CB 3.28Å; V296-A299 PolarHBondContact O-N 3.21Å; V296-A299 VanDerWaalsContact O-N 3.16Å; H297-A299 VanDerWaalsContact C-N 3.25Å; H297-A299 PolarHBondContact O-N 2.88Å; A299-A303 WeakPolarHBondContact O-CB 2.98Å; A299-A303 PolarHBondContact O-N 3.23Å; A299-A303 VanDerWaalsContact O-N 3.13Å; A299-F322 HydrophobicContact CB-CE1 3.98Å; A299-F322 HydrophobicContact CB-CZ 3.97Å; A299-F322 WeakPolarHBondContact O-CZ 3.41Å
300	L	97.8	Very high	95.4	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-68.4	-50.9	178.5	-178.3	53.9	0	0	0	110.9	V296 H297 R302 A303 I304 I318 F319 F322	V296-L300 PolarHBondContact O-N 3.43Å; H297-L300 PolarHBondContact O-N 3.35Å; L300-R302 VanDerWaalsContact C-N 3.34Å; L300-R302 PolarHBondContact O-N 2.92Å; L300-A303 WeakPolarHBondContact O-CB 3.28Å; L300-A303 PolarHBondContact O-N 3.43Å; L300-I304 HydrophobicContact CD1-CD1 3.99Å; L300-I304 HydrophobicContact CD1-CG1 4.3Å; L300-I304 HydrophobicContact CG-CD1 3.94Å; L300-I304 WeakPolarHBondContact O-CG1 3.47Å; L300-I304 PolarHBondContact O-N 3.45Å; L300-I318 HydrophobicContact CD1-CG2 3.59Å; L300-F319 HydrophobicContact CD2-CE1 4.39Å; L300-F322 VanDerWaalsContact CA-CE1 3.46Å; L300-F322 HydrophobicContact CB-CD1 3.87Å; L300-F322 HydrophobicContact CB-CE1 3.62Å; L300-F322 HydrophobicContact CB-CZ 4.28Å; L300-F322 HydrophobicContact CD1-CB 4.36Å; L300-F322 HydrophobicContact CD1-CD1 3.93Å; L300-F322 HydrophobicContact CD1-CD2 4.22Å; L300-F322 HydrophobicContact CD1-CE1 4.23Å; L300-F322 HydrophobicContact CD1-CG 3.92Å; L300-F322 HydrophobicContact CG-CD1 4.35Å; L300-F322 HydrophobicContact CG-CE1 4.49Å; L300-F322 VanDerWaalsContact N-CE1 3.34Å
301	L	97.4	Very high	94.7	Very high	16 Å²	16	52 Å²	52	8%	0.084	27%	0.273	C	S	.	.	H	α-helix	trans	-54.1	-49.8	175.7	178.1	59	0	0	0	111.3	E256 Y260 H297 A303 I304 D305	E256-L301 HydrophobicContact CB-CD1 4.2Å; E256-L301 HydrophobicContact CG-CB 4.1Å; E256-L301 HydrophobicContact CG-CD1 4.09Å; Y260-L301 HydrophobicContact CD1-CD2 3.89Å; Y260-L301 HydrophobicContact CG-CD2 4.04Å; H297-L301 WeakPolarHBondContact O-CB 3.46Å; H297-L301 PolarHBondContact O-N 2.93Å; L301-A303 VanDerWaalsContact C-N 3.27Å; L301-A303 PolarHBondContact O-N 2.9Å; L301-I304 PolarHBondContact O-N 2.96Å; L301-I304 VanDerWaalsContact O-N 3.09Å; L301-D305 PolarHBondContact O-N 2.9Å
302	R	96.8	Very high	94.1	Very high	141 Å²	141	48.9 Å²	48.9	53%	0.532	26%	0.259	S	S	.	.	H	α-helix	trans	-62.3	-30.3	177.6	-74.6	-173.7	65	-150	-3.6	114	F298 L300 M306	F298-R302 HydrophobicContact CE2-CG 4.44Å; F298-R302 WeakPolarHBondContact O-CB 3.4Å; F298-R302 WeakPolarHBondContact O-CG 3.42Å; F298-R302 PolarHBondContact O-N 2.78Å; L300-R302 VanDerWaalsContact C-N 3.34Å; L300-R302 PolarHBondContact O-N 2.92Å; R302-M306 WeakPolarHBondContact O-CG 3.33Å; R302-M306 PolarHBondContact O-N 3.41Å
303	A	96.8	Very high	93.5	Very high	26 Å²	26	48.4 Å²	48.4	22%	0.215	26%	0.261	C	S	.	.	H	α-helix	trans	-72.3	-41.1	173.7	0	0	0	0	0	111.3	A299 L300 L301 N307 I318 F322	A299-A303 WeakPolarHBondContact O-CB 2.98Å; A299-A303 PolarHBondContact O-N 3.23Å; A299-A303 VanDerWaalsContact O-N 3.13Å; L300-A303 WeakPolarHBondContact O-CB 3.28Å; L300-A303 PolarHBondContact O-N 3.43Å; L301-A303 VanDerWaalsContact C-N 3.27Å; L301-A303 PolarHBondContact O-N 2.9Å; A303-N307 PolarHBondContact O-N 2.82Å; A303-N307 VanDerWaalsContact O-N 3.13Å; A303-I318 HydrophobicContact CB-CD1 4.13Å; A303-I318 HydrophobicContact CB-CG1 4.33Å; A303-I318 HydrophobicContact CB-CG2 3.89Å; A303-I318 VanDerWaalsContact O-CD1 3.31Å; A303-I318 WeakPolarHBondContact O-CD1 3.36Å; A303-F322 HydrophobicContact CB-CE2 4.2Å; A303-F322 HydrophobicContact CB-CZ 4.42Å
304	I	95.6	Very high	93.1	Very high	1 Å²	1	49.2 Å²	49.2	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-63.5	-50.2	176.5	-66.9	170	0	0	0	110.3	I252 Q253 E256 L300 L301 M306 N307 M308 L315 I318 F319	I252-I304 HydrophobicContact CG2-CD1 4.35Å; Q253-I304 HydrophobicContact CB-CG2 4.11Å; Q253-I304 HydrophobicContact CG-CG2 4.22Å; E256-I304 HydrophobicContact CB-CD1 4.48Å; E256-I304 HydrophobicContact CG-CD1 4.13Å; L300-I304 HydrophobicContact CD1-CD1 3.99Å; L300-I304 HydrophobicContact CD1-CG1 4.3Å; L300-I304 HydrophobicContact CG-CD1 3.94Å; L300-I304 WeakPolarHBondContact O-CG1 3.47Å; L300-I304 PolarHBondContact O-N 3.45Å; L301-I304 PolarHBondContact O-N 2.96Å; L301-I304 VanDerWaalsContact O-N 3.09Å; I304-M306 VanDerWaalsContact C-N 3.32Å; I304-M306 PolarHBondContact O-N 3.11Å; I304-N307 CarbonylContact O-C 3.57Å; I304-N307 WeakPolarHBondContact O-CA 3.29Å; I304-N307 WeakPolarHBondContact O-CB 3.46Å; I304-N307 PolarHBondContact O-N 3.19Å; I304-M308 HydrophobicContact CG2-CG 4.24Å; I304-M308 WeakPolarHBondContact O-CG 3.49Å; I304-M308 PolarHBondContact O-N 3.5Å; I304-L315 HydrophobicContact CB-CD1 4.49Å; I304-L315 HydrophobicContact CD1-CD1 4.42Å; I304-L315 HydrophobicContact CG1-CD1 3.8Å; I304-L315 HydrophobicContact CG2-CD1 4.26Å; I304-I318 HydrophobicContact CG1-CG2 4.42Å; I304-F319 HydrophobicContact CD1-CZ 4.41Å
305	D	94.9	Very high	92.8	Very high	52 Å²	52	49 Å²	49	28%	0.278	27%	0.268	S	S	.	.	H	α-helix	trans	-53	-48.2	177.8	-70.7	-30.6	0	0	0	112	Q253 L301 N307 M308 L309	Q253-D305 PolarHBondContact NE2-OD1 3.49Å; L301-D305 PolarHBondContact O-N 2.9Å; D305-N307 VanDerWaalsContact C-N 3.26Å; D305-N307 PolarHBondContact O-N 3.35Å; D305-M308 PolarHBondContact O-N 3.15Å; D305-L309 PolarHBondContact O-N 2.83Å
306	M	93.8	Very high	92.6	Very high	121 Å²	121	43.4 Å²	43.4	60%	0.596	25%	0.247	S	C	*	.	H	α-helix	trans	-66.5	-27	178.8	-67.8	-71.1	148.5	0	0	112.7	R302 I304 L309 S310	R302-M306 WeakPolarHBondContact O-CG 3.33Å; R302-M306 PolarHBondContact O-N 3.41Å; I304-M306 VanDerWaalsContact C-N 3.32Å; I304-M306 PolarHBondContact O-N 3.11Å; M306-L309 HydrophobicContact SD-CD1 4.16Å; M306-S310 PolarHBondContact O-OG 3.23Å
307	N	92.8	Very high	92.4	Very high	27 Å²	27	48.1 Å²	48.1	14%	0.144	27%	0.267	C	S	.	.	H	α-helix	trans	-81.1	-31.2	174.5	-160	-109	0	0	0	113.1	A303 I304 D305 L309 S310 G311 G312 G314 L315 I318	A303-N307 PolarHBondContact O-N 2.82Å; A303-N307 VanDerWaalsContact O-N 3.13Å; I304-N307 CarbonylContact O-C 3.57Å; I304-N307 WeakPolarHBondContact O-CA 3.29Å; I304-N307 WeakPolarHBondContact O-CB 3.46Å; I304-N307 PolarHBondContact O-N 3.19Å; D305-N307 VanDerWaalsContact C-N 3.26Å; D305-N307 PolarHBondContact O-N 3.35Å; N307-L309 VanDerWaalsContact C-N 3.32Å; N307-L309 PolarHBondContact O-N 2.82Å; N307-S310 CarbonylContact O-C 3.36Å; N307-S310 WeakPolarHBondContact O-CA 3.46Å; N307-S310 WeakPolarHBondContact O-CB 3.39Å; N307-S310 PolarHBondContact O-N 2.8Å; N307-G311 PolarHBondContact O-N 2.9Å; N307-G312 PolarHBondContact O-N 3.32Å; N307-G312 VanDerWaalsContact OD1-CA 3.24Å; N307-G312 WeakPolarHBondContact OD1-CA 3.49Å; N307-G312 PolarHBondContact OD1-O 2.99Å; N307-G314 WeakPolarHBondContact ND2-CA 3.24Å; N307-G314 PolarHBondContact ND2-N 3.44Å; N307-G314 WeakPolarHBondContact OD1-CA 3.17Å; N307-G314 PolarHBondContact OD1-N 2.91Å; N307-L315 PolarHBondContact OD1-N 3.07Å; N307-L315 VanDerWaalsContact OD1-N 3.12Å; N307-I318 HydrophobicContact CB-CD1 3.63Å
308	M	89.6	Confident	92.4	Very high	43 Å²	43	49 Å²	49	21%	0.212	27%	0.272	C	S	.	.	H	α-helix	trans	-64.4	-37.1	174	-70.3	-65.4	-80	0	0	111.5	L249 V250 Q253 I304 D305 S310 G311	L249-M308 HydrophobicContact CB-CE 3.82Å; L249-M308 HydrophobicContact CB-SD 3.84Å; L249-M308 HydrophobicContact CD2-SD 4.43Å; L249-M308 HydrophobicContact CG-SD 4.5Å; V250-M308 HydrophobicContact CG2-CE 4.05Å; Q253-M308 HydrophobicContact CB-CE 4.36Å; Q253-M308 HydrophobicContact CB-CG 4.41Å; Q253-M308 HydrophobicContact CG-CG 4.4Å; Q253-M308 VanDerWaalsContact OE1-CE 3.28Å; I304-M308 HydrophobicContact CG2-CG 4.24Å; I304-M308 WeakPolarHBondContact O-CG 3.49Å; I304-M308 PolarHBondContact O-N 3.5Å; D305-M308 PolarHBondContact O-N 3.15Å; M308-S310 PolarHBondContact O-N 3.26Å; M308-S310 VanDerWaalsContact O-N 3.08Å; M308-G311 PolarHBondContact O-N 2.91Å; M308-G311 VanDerWaalsContact O-N 3.07Å
309	L	87.9	Confident	92.3	Very high	144 Å²	144	44.6 Å²	44.6	75%	0.754	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-19.1	167.8	-63.8	177.7	0	0	0	113.8	D305 M306 N307	D305-L309 PolarHBondContact O-N 2.83Å; M306-L309 HydrophobicContact SD-CD1 4.16Å; N307-L309 VanDerWaalsContact C-N 3.32Å; N307-L309 PolarHBondContact O-N 2.82Å
310	S	84.6	Confident	92.1	Very high	84 Å²	84	46.1 Å²	46.1	59%	0.587	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108	13.4	179.3	-52.9	0	0	0	0	113.4	M306 N307 M308	M306-S310 PolarHBondContact O-OG 3.23Å; N307-S310 CarbonylContact O-C 3.36Å; N307-S310 WeakPolarHBondContact O-CA 3.46Å; N307-S310 WeakPolarHBondContact O-CB 3.39Å; N307-S310 PolarHBondContact O-N 2.8Å; M308-S310 PolarHBondContact O-N 3.26Å; M308-S310 VanDerWaalsContact O-N 3.08Å
311	G	81.3	Confident	92	Very high	44 Å²	44	50.4 Å²	50.4	45%	0.454	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.2	14.5	178.5	0	0	0	0	0	116	R245 N307 M308 S313	R245-G311 PolarHBondContact NH2-O 3.01Å; R245-G311 VanDerWaalsContact NH2-O 3.08Å; N307-G311 PolarHBondContact O-N 2.9Å; M308-G311 PolarHBondContact O-N 2.91Å; M308-G311 VanDerWaalsContact O-N 3.07Å; G311-S313 PolarHBondContact O-N 3.15Å
312	G	83.3	Confident	92	Very high	3 Å²	3	50.6 Å²	50.6	3%	0.031	28%	0.279	C	S	.	.	S	Bend	trans	71.9	5.9	172.1	0	0	0	0	0	116	N307 G314 L315	N307-G312 PolarHBondContact O-N 3.32Å; N307-G312 VanDerWaalsContact OD1-CA 3.24Å; N307-G312 WeakPolarHBondContact OD1-CA 3.49Å; N307-G312 PolarHBondContact OD1-O 2.99Å; G312-G314 VanDerWaalsContact C-N 3.25Å; G312-G314 PolarHBondContact O-N 2.97Å; G312-L315 WeakPolarHBondContact O-CB 3.4Å; G312-L315 PolarHBondContact O-N 3.15Å
313	S	84.5	Confident	91.8	Very high	57 Å²	57	45.3 Å²	45.3	40%	0.399	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-12.8	-173.8	55.2	0	0	0	0	114.9	G311 E401	G311-S313 PolarHBondContact O-N 3.15Å; S313-E401 WeakPolarHBondContact CB-OE2 3.36Å; S313-E401 WeakPolarHBondContact O-CB 3.43Å
314	G	89.2	Confident	91.5	Very high	17 Å²	17	50.6 Å²	50.6	18%	0.175	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.8	2.3	178.9	0	0	0	0	0	114.4	N307 G312 G316 K317 I318	N307-G314 WeakPolarHBondContact ND2-CA 3.24Å; N307-G314 PolarHBondContact ND2-N 3.44Å; N307-G314 WeakPolarHBondContact OD1-CA 3.17Å; N307-G314 PolarHBondContact OD1-N 2.91Å; G312-G314 VanDerWaalsContact C-N 3.25Å; G312-G314 PolarHBondContact O-N 2.97Å; G314-G316 VanDerWaalsContact C-N 3.29Å; G314-G316 PolarHBondContact O-N 2.97Å; G314-K317 WeakPolarHBondContact O-CB 3.43Å; G314-K317 PolarHBondContact O-N 2.91Å; G314-I318 PolarHBondContact O-N 2.85Å
315	L	92.8	Very high	91.5	Very high	3 Å²	3	55.3 Å²	55.3	2%	0.016	30%	0.298	C	S	.	.	H	α-helix	trans	-57.8	-38.7	-172.6	-170.2	70.2	0	0	0	113.1	L249 I252 I304 N307 G312 K317 I318 F319 L392	L249-L315 HydrophobicContact CD2-CD2 3.76Å; I252-L315 HydrophobicContact CD1-CD2 3.76Å; I252-L315 HydrophobicContact CG2-CD2 4.24Å; I304-L315 HydrophobicContact CB-CD1 4.49Å; I304-L315 HydrophobicContact CD1-CD1 4.42Å; I304-L315 HydrophobicContact CG1-CD1 3.8Å; I304-L315 HydrophobicContact CG2-CD1 4.26Å; N307-L315 PolarHBondContact OD1-N 3.07Å; N307-L315 VanDerWaalsContact OD1-N 3.12Å; G312-L315 WeakPolarHBondContact O-CB 3.4Å; G312-L315 PolarHBondContact O-N 3.15Å; L315-K317 VanDerWaalsContact C-N 3.31Å; L315-K317 PolarHBondContact O-N 3.23Å; L315-I318 WeakPolarHBondContact O-CB 3.49Å; L315-I318 PolarHBondContact O-N 2.83Å; L315-I318 VanDerWaalsContact O-N 3.1Å; L315-F319 HydrophobicContact CD1-CD2 4.4Å; L315-F319 HydrophobicContact CD1-CE2 3.94Å; L315-F319 HydrophobicContact CD2-CE2 4.3Å; L315-F319 HydrophobicContact CG-CD2 4.11Å; L315-F319 HydrophobicContact CG-CE2 3.9Å; L315-F319 WeakPolarHBondContact O-CD2 3.42Å; L315-F319 PolarHBondContact O-N 2.79Å; L315-L392 HydrophobicContact CD2-CD2 3.64Å
316	G	93.4	Very high	91.6	Very high	1 Å²	1	52.8 Å²	52.8	1%	0.01	29%	0.285	C	S	.	.	H	α-helix	trans	-59.1	-40.3	175.6	0	0	0	0	0	112.8	G314 I318 F319 L320 A408	G314-G316 VanDerWaalsContact C-N 3.29Å; G314-G316 PolarHBondContact O-N 2.97Å; G316-I318 VanDerWaalsContact C-N 3.34Å; G316-I318 PolarHBondContact O-N 3.47Å; G316-F319 PolarHBondContact O-N 2.94Å; G316-L320 WeakPolarHBondContact O-CG 2.95Å; G316-L320 PolarHBondContact O-N 3.17Å; G316-A408 WeakPolarHBondContact O-CB 3.15Å
317	K	94.4	Very high	91.5	Very high	110 Å²	110	47.5 Å²	47.5	48%	0.478	26%	0.259	S	S	.	.	H	α-helix	trans	-63.9	-39.3	174.7	-166.2	-165.7	174.3	-118.2	0	111.7	G314 L315 F319 L320 D321	G314-K317 WeakPolarHBondContact O-CB 3.43Å; G314-K317 PolarHBondContact O-N 2.91Å; L315-K317 VanDerWaalsContact C-N 3.31Å; L315-K317 PolarHBondContact O-N 3.23Å; K317-F319 PolarHBondContact O-N 2.8Å; K317-L320 WeakPolarHBondContact O-CB 3.27Å; K317-L320 PolarHBondContact O-N 2.77Å; K317-D321 VanDerWaalsContact CE-OD2 3.29Å; K317-D321 WeakPolarHBondContact CE-OD2 3.4Å; K317-D321 IonicContact NZ-OD1 2.67Å; K317-D321 IonicContact NZ-OD2 2.82Å; K317-D321 PolarHBondContact NZ-OD2 2.88Å; K317-D321 WeakPolarHBondContact O-CB 3.3Å; K317-D321 PolarHBondContact O-N 3.15Å
318	I	96.7	Very high	91.5	Very high	18 Å²	18	48.2 Å²	48.2	9%	0.092	26%	0.262	C	S	.	.	H	α-helix	trans	-61	-45.9	-180	-67.4	166.8	0	0	0	110.9	L300 A303 I304 N307 G314 L315 G316 L320 D321 F322	L300-I318 HydrophobicContact CD1-CG2 3.59Å; A303-I318 HydrophobicContact CB-CD1 4.13Å; A303-I318 HydrophobicContact CB-CG1 4.33Å; A303-I318 HydrophobicContact CB-CG2 3.89Å; A303-I318 VanDerWaalsContact O-CD1 3.31Å; A303-I318 WeakPolarHBondContact O-CD1 3.36Å; I304-I318 HydrophobicContact CG1-CG2 4.42Å; N307-I318 HydrophobicContact CB-CD1 3.63Å; G314-I318 PolarHBondContact O-N 2.85Å; L315-I318 WeakPolarHBondContact O-CB 3.49Å; L315-I318 PolarHBondContact O-N 2.83Å; L315-I318 VanDerWaalsContact O-N 3.1Å; G316-I318 VanDerWaalsContact C-N 3.34Å; G316-I318 PolarHBondContact O-N 3.47Å; I318-L320 VanDerWaalsContact C-N 3.3Å; I318-L320 PolarHBondContact O-N 3.39Å; I318-D321 PolarHBondContact O-N 3.48Å; I318-F322 HydrophobicContact CG2-CD2 4.07Å; I318-F322 HydrophobicContact CG2-CE2 4.28Å; I318-F322 WeakPolarHBondContact O-CB 3.23Å; I318-F322 VanDerWaalsContact O-CD2 3.31Å; I318-F322 WeakPolarHBondContact O-CD2 3.39Å; I318-F322 PolarHBondContact O-N 3.3Å
319	F	96.6	Very high	91.7	Very high	1 Å²	1	46.2 Å²	46.2	0%	0.004	25%	0.252	C	S	.	.	H	α-helix	trans	-66.4	-30	176.8	-78.5	-73.8	0	0	0	113.5	I252 L300 I304 L315 G316 K317 K323 Y385 L389 A408 M412	I252-F319 HydrophobicContact CG2-CE2 4.44Å; I252-F319 HydrophobicContact CG2-CZ 4.41Å; L300-F319 HydrophobicContact CD2-CE1 4.39Å; I304-F319 HydrophobicContact CD1-CZ 4.41Å; L315-F319 HydrophobicContact CD1-CD2 4.4Å; L315-F319 HydrophobicContact CD1-CE2 3.94Å; L315-F319 HydrophobicContact CD2-CE2 4.3Å; L315-F319 HydrophobicContact CG-CD2 4.11Å; L315-F319 HydrophobicContact CG-CE2 3.9Å; L315-F319 WeakPolarHBondContact O-CD2 3.42Å; L315-F319 PolarHBondContact O-N 2.79Å; G316-F319 PolarHBondContact O-N 2.94Å; K317-F319 PolarHBondContact O-N 2.8Å; F319-K323 PolarHBondContact O-N 3.25Å; F319-K323 VanDerWaalsContact O-N 3.1Å; F319-Y385 AromaticContact CE1-CD1 3.46Å; F319-Y385 HydrophobicContact CE1-CD1 3.46Å; F319-Y385 VanDerWaalsContact CE1-CD1 3.46Å; F319-Y385 AromaticContact CE1-CE1 3.8Å; F319-Y385 HydrophobicContact CE1-CE1 3.8Å; F319-Y385 AromaticContact CE1-CG 3.93Å; F319-Y385 HydrophobicContact CE1-CG 3.93Å; F319-Y385 AromaticContact CZ-CD1 3.74Å; F319-Y385 HydrophobicContact CZ-CD1 3.74Å; F319-Y385 HydrophobicContact CZ-CE1 4.03Å; F319-L389 HydrophobicContact CB-CD1 4.26Å; F319-L389 HydrophobicContact CD1-CD1 4.48Å; F319-L389 HydrophobicContact CD2-CD1 4.05Å; F319-L389 HydrophobicContact CD2-CD2 3.75Å; F319-L389 HydrophobicContact CD2-CG 4.33Å; F319-L389 HydrophobicContact CE2-CD2 3.96Å; F319-L389 HydrophobicContact CE2-CG 4.48Å; F319-L389 HydrophobicContact CG-CD1 4Å; F319-A408 HydrophobicContact CB-CB 4.11Å; F319-M412 HydrophobicContact CB-CE 4.39Å; F319-M412 HydrophobicContact CD1-CE 4.46Å; F319-M412 HydrophobicContact CD1-CG 4.2Å; F319-M412 HydrophobicContact CD1-SD 3.78Å; F319-M412 HydrophobicContact CE1-SD 4.5Å; F319-M412 WeakPolarHBondContact O-CE 3.49Å
320	L	94.7	Very high	91.8	Very high	59 Å²	59	39.4 Å²	39.4	31%	0.309	22%	0.217	S	C	.	.	H	α-helix	trans	-68.2	-50.5	170.6	-70.1	167.7	0	0	0	111.7	G316 K317 I318 F322 K323 E407 A408 A411	G316-L320 WeakPolarHBondContact O-CG 2.95Å; G316-L320 PolarHBondContact O-N 3.17Å; K317-L320 WeakPolarHBondContact O-CB 3.27Å; K317-L320 PolarHBondContact O-N 2.77Å; I318-L320 VanDerWaalsContact C-N 3.3Å; I318-L320 PolarHBondContact O-N 3.39Å; L320-F322 PolarHBondContact O-N 2.82Å; L320-K323 PolarHBondContact O-N 2.81Å; L320-E407 HydrophobicContact CD1-CB 4.05Å; L320-E407 HydrophobicContact CD2-CB 4.26Å; L320-A408 HydrophobicContact CG-CB 4.36Å; L320-A411 HydrophobicContact CD2-CB 3.82Å
321	D	95.5	Very high	92	Very high	90 Å²	90	40.1 Å²	40.1	48%	0.481	21%	0.211	S	C	.	.	H	α-helix	trans	-61.2	-25.8	178.3	-70.9	-11.9	0	0	0	112.1	K317 I318	K317-D321 VanDerWaalsContact CE-OD2 3.29Å; K317-D321 WeakPolarHBondContact CE-OD2 3.4Å; K317-D321 IonicContact NZ-OD1 2.67Å; K317-D321 IonicContact NZ-OD2 2.82Å; K317-D321 PolarHBondContact NZ-OD2 2.88Å; K317-D321 WeakPolarHBondContact O-CB 3.3Å; K317-D321 PolarHBondContact O-N 3.15Å; I318-D321 PolarHBondContact O-N 3.48Å
322	F	96.5	Very high	92.6	Very high	20 Å²	20	38 Å²	38	9%	0.088	19%	0.189	C	C	.	.	H	α-helix	trans	-96.8	-12.1	178.7	-85.3	-110.6	0	0	0	115.1	V296 A299 L300 A303 I318 L320 E324 R325 L326	V296-F322 HydrophobicContact CG1-CD1 4.17Å; V296-F322 HydrophobicContact CG1-CE1 4.49Å; A299-F322 HydrophobicContact CB-CE1 3.98Å; A299-F322 HydrophobicContact CB-CZ 3.97Å; A299-F322 WeakPolarHBondContact O-CZ 3.41Å; L300-F322 VanDerWaalsContact CA-CE1 3.46Å; L300-F322 HydrophobicContact CB-CD1 3.87Å; L300-F322 HydrophobicContact CB-CE1 3.62Å; L300-F322 HydrophobicContact CB-CZ 4.28Å; L300-F322 HydrophobicContact CD1-CB 4.36Å; L300-F322 HydrophobicContact CD1-CD1 3.93Å; L300-F322 HydrophobicContact CD1-CD2 4.22Å; L300-F322 HydrophobicContact CD1-CE1 4.23Å; L300-F322 HydrophobicContact CD1-CG 3.92Å; L300-F322 HydrophobicContact CG-CD1 4.35Å; L300-F322 HydrophobicContact CG-CE1 4.49Å; L300-F322 VanDerWaalsContact N-CE1 3.34Å; A303-F322 HydrophobicContact CB-CE2 4.2Å; A303-F322 HydrophobicContact CB-CZ 4.42Å; I318-F322 HydrophobicContact CG2-CD2 4.07Å; I318-F322 HydrophobicContact CG2-CE2 4.28Å; I318-F322 WeakPolarHBondContact O-CB 3.23Å; I318-F322 VanDerWaalsContact O-CD2 3.31Å; I318-F322 WeakPolarHBondContact O-CD2 3.39Å; I318-F322 PolarHBondContact O-N 3.3Å; L320-F322 PolarHBondContact O-N 2.82Å; F322-E324 VanDerWaalsContact C-N 3.32Å; F322-E324 PolarHBondContact O-N 3.23Å; F322-R325 VanDerWaalsContact CZ-NH1 3.29Å; F322-R325 WeakPolarHBondContact O-CA 3.27Å; F322-R325 WeakPolarHBondContact O-CB 3.38Å; F322-R325 PolarHBondContact O-N 3.02Å; F322-L326 HydrophobicContact CB-CD1 4.49Å; F322-L326 WeakPolarHBondContact O-CG 3.5Å; F322-L326 PolarHBondContact O-N 3.41Å
323	K	92.9	Very high	92.8	Very high	30 Å²	30	38.2 Å²	38.2	13%	0.13	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-48.9	-174.2	-171.1	-158.9	-179.7	176.4	0	112.9	F319 L320 R325 L326 A411 M412 D414	F319-K323 PolarHBondContact O-N 3.25Å; F319-K323 VanDerWaalsContact O-N 3.1Å; L320-K323 PolarHBondContact O-N 2.81Å; K323-R325 VanDerWaalsContact C-N 3.33Å; K323-R325 PolarHBondContact O-N 3.03Å; K323-L326 PolarHBondContact O-N 3.03Å; K323-A411 HydrophobicContact CD-CB 3.85Å; K323-A411 VanDerWaalsContact CE-O 3.3Å; K323-A411 WeakPolarHBondContact CE-O 3.34Å; K323-A411 HydrophobicContact CG-CB 4.19Å; K323-M412 HydrophobicContact CB-CE 4.07Å; K323-M412 HydrophobicContact CG-CE 4.03Å; K323-D414 IonicContact NZ-OD2 2.74Å; K323-D414 PolarHBondContact NZ-OD2 3.4Å
324	E	91.4	Very high	92.9	Very high	138 Å²	138	36.7 Å²	36.7	65%	0.645	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-32.2	-178.6	-65.3	-175.6	177.8	0	0	112.5	F322 L326 L327	F322-E324 VanDerWaalsContact C-N 3.32Å; F322-E324 PolarHBondContact O-N 3.23Å; E324-L326 VanDerWaalsContact C-N 3.31Å; E324-L327 WeakPolarHBondContact O-CB 3.44Å; E324-L327 PolarHBondContact O-N 2.83Å
325	R	95.2	Very high	92.8	Very high	99 Å²	99	39.6 Å²	39.6	37%	0.374	19%	0.188	S	C	.	.	G	3₁₀ helix	trans	-69.5	-30.2	176.3	-60.2	-175.8	64.3	-163	-3.1	112.3	V296 F322 K323 L327 I328	V296-R325 HydrophobicContact CG1-CB 4.19Å; V296-R325 HydrophobicContact CG2-CB 4.19Å; F322-R325 VanDerWaalsContact CZ-NH1 3.29Å; F322-R325 WeakPolarHBondContact O-CA 3.27Å; F322-R325 WeakPolarHBondContact O-CB 3.38Å; F322-R325 PolarHBondContact O-N 3.02Å; K323-R325 VanDerWaalsContact C-N 3.33Å; K323-R325 PolarHBondContact O-N 3.03Å; R325-L327 VanDerWaalsContact C-N 3.28Å; R325-L327 PolarHBondContact O-N 3.46Å; R325-I328 WeakPolarHBondContact O-CG1 3.43Å
326	L	95.7	Very high	92.6	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-76.7	-8.4	176.6	-65.9	169.5	0	0	0	113.2	V296 H297 F322 K323 E324 I328 Y329 M412 L415	V296-L326 HydrophobicContact CG1-CD2 3.97Å; H297-L326 WeakPolarHBondContact NE2-CD2 3.27Å; F322-L326 HydrophobicContact CB-CD1 4.49Å; F322-L326 WeakPolarHBondContact O-CG 3.5Å; F322-L326 PolarHBondContact O-N 3.41Å; K323-L326 PolarHBondContact O-N 3.03Å; E324-L326 VanDerWaalsContact C-N 3.31Å; L326-I328 PolarHBondContact O-N 2.98Å; L326-I328 VanDerWaalsContact O-N 3.11Å; L326-Y329 HydrophobicContact CB-CD2 4.48Å; L326-Y329 HydrophobicContact CD2-CD2 4.26Å; L326-Y329 HydrophobicContact CD2-CE2 3.83Å; L326-Y329 WeakPolarHBondContact O-CB 3.32Å; L326-Y329 WeakPolarHBondContact O-CD2 3.19Å; L326-Y329 PolarHBondContact O-N 3.25Å; L326-Y329 VanDerWaalsContact O-N 3.16Å; L326-M412 HydrophobicContact CD1-CE 4.12Å; L326-M412 HydrophobicContact CD1-SD 3.98Å; L326-L415 HydrophobicContact CB-CD1 4.17Å; L326-L415 HydrophobicContact CB-CD2 3.65Å; L326-L415 HydrophobicContact CD1-CD2 3.81Å; L326-L415 HydrophobicContact CG-CD2 4.35Å
327	L	92.1	Very high	92.1	Very high	10 Å²	10	44.1 Å²	44.1	5%	0.052	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-67.1	-12.1	178.1	-61.8	175.7	0	0	0	113.6	E324 R325 Y329 G330 L415 Y418 N580 L589	E324-L327 WeakPolarHBondContact O-CB 3.44Å; E324-L327 PolarHBondContact O-N 2.83Å; R325-L327 VanDerWaalsContact C-N 3.28Å; R325-L327 PolarHBondContact O-N 3.46Å; L327-Y329 PolarHBondContact O-N 3.43Å; L327-G330 PolarHBondContact O-N 2.94Å; L327-G330 VanDerWaalsContact O-N 3.14Å; L327-L415 HydrophobicContact CD2-CD1 3.8Å; L327-Y418 HydrophobicContact CB-CE1 4.12Å; L327-Y418 HydrophobicContact CD2-CD1 3.59Å; L327-Y418 HydrophobicContact CD2-CE1 3.75Å; L327-Y418 HydrophobicContact CD2-CG 4.14Å; L327-Y418 WeakPolarHBondContact O-CE1 3.5Å; L327-N580 VanDerWaalsContact CB-ND2 3.32Å; L327-N580 WeakPolarHBondContact CB-ND2 3.41Å; L327-N580 HydrophobicContact CD1-CB 3.81Å; L327-N580 WeakPolarHBondContact CD1-ND2 3.47Å; L327-L589 HydrophobicContact CD1-CD1 4.35Å; L327-L589 HydrophobicContact CD1-CD2 4.03Å; L327-L589 HydrophobicContact CD2-CD2 3.57Å; L327-L589 HydrophobicContact CG-CD2 4.48Å
328	I	93.6	Very high	91.7	Very high	42 Å²	42	43.2 Å²	43.2	22%	0.215	21%	0.209	C	C	.	.	G	3₁₀ helix	trans	-60.4	-23.8	171.1	65.5	177.7	0	0	0	113.1	N289 D292 I293 V296 R325 L326 G330 Q331 Y332	N289-I328 PolarHBondContact ND2-O 3.06Å; D292-I328 HydrophobicContact CB-CD1 3.93Å; I293-I328 HydrophobicContact CB-CD1 4.48Å; I293-I328 HydrophobicContact CG1-CD1 3.81Å; I293-I328 HydrophobicContact CG1-CG1 4.18Å; V296-I328 HydrophobicContact CB-CD1 4.29Å; V296-I328 HydrophobicContact CG2-CD1 3.75Å; R325-I328 WeakPolarHBondContact O-CG1 3.43Å; L326-I328 PolarHBondContact O-N 2.98Å; L326-I328 VanDerWaalsContact O-N 3.11Å; I328-G330 PolarHBondContact O-N 3.04Å; I328-Q331 PolarHBondContact O-N 2.97Å; I328-Y332 PolarHBondContact O-N 3.18Å
329	Y	93.8	Very high	91.5	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-60.8	-26.2	174.2	-84	-81	0	0	0	113.1	Y259 I293 H297 L326 L327 Q331 Y332 C333 P378 V382	Y259-Y329 PolarHBondContact OH-OH 3.46Å; I293-Y329 HydrophobicContact CD1-CD1 4.11Å; I293-Y329 HydrophobicContact CD1-CE1 3.92Å; I293-Y329 HydrophobicContact CG2-CE1 4.29Å; I293-Y329 HydrophobicContact CG2-CE2 4.44Å; I293-Y329 WeakPolarHBondContact CG2-OH 3.41Å; H297-Y329 AromaticContact NE2-CE2 3.39Å; H297-Y329 WeakPolarHBondContact NE2-CE2 3.37Å; H297-Y329 AromaticContact NE2-CZ 3.66Å; H297-Y329 PolarHBondContact NE2-OH 3.41Å; L326-Y329 HydrophobicContact CB-CD2 4.48Å; L326-Y329 HydrophobicContact CD2-CD2 4.26Å; L326-Y329 HydrophobicContact CD2-CE2 3.83Å; L326-Y329 WeakPolarHBondContact O-CB 3.32Å; L326-Y329 WeakPolarHBondContact O-CD2 3.19Å; L326-Y329 PolarHBondContact O-N 3.25Å; L326-Y329 VanDerWaalsContact O-N 3.16Å; L327-Y329 PolarHBondContact O-N 3.43Å; Y329-Q331 VanDerWaalsContact C-N 3.32Å; Y329-Q331 PolarHBondContact O-N 2.81Å; Y329-Y332 PolarHBondContact O-N 3.18Å; Y329-Y332 VanDerWaalsContact O-N 3.16Å; Y329-C333 WeakPolarHBondContact O-CB 3.49Å; Y329-C333 PolarHBondContact O-N 3.46Å; Y329-C333 PolarHBondContact O-SG 3.13Å; Y329-P378 HydrophobicContact CE1-CB 3.8Å; Y329-P378 WeakPolarHBondContact CE1-O 3.48Å; Y329-V382 HydrophobicContact CD1-CB 3.98Å; Y329-V382 HydrophobicContact CD1-CG1 3.72Å; Y329-V382 HydrophobicContact CD1-CG2 4.46Å; Y329-V382 HydrophobicContact CD2-CB 4.07Å; Y329-V382 HydrophobicContact CD2-CG2 3.81Å; Y329-V382 HydrophobicContact CE1-CB 4.02Å; Y329-V382 HydrophobicContact CE1-CG1 4.07Å; Y329-V382 HydrophobicContact CE2-CB 4.1Å; Y329-V382 HydrophobicContact CE2-CG2 4.16Å; Y329-V382 HydrophobicContact CG-CB 4Å; Y329-V382 HydrophobicContact CG-CG1 3.98Å; Y329-V382 HydrophobicContact CG-CG2 3.97Å
330	G	88.8	Confident	91.1	Very high	1 Å²	1	44 Å²	44	1%	0.01	21%	0.213	C	C	.	.	H	α-helix	trans	-57.1	-45.5	174.9	0	0	0	0	0	112.1	L327 I328 S334 V422	L327-G330 PolarHBondContact O-N 2.94Å; L327-G330 VanDerWaalsContact O-N 3.14Å; I328-G330 PolarHBondContact O-N 3.04Å; G330-S334 WeakPolarHBondContact O-CB 3.45Å; G330-S334 PolarHBondContact O-N 2.82Å; G330-S334 PolarHBondContact O-OG 2.91Å; G330-V422 VanDerWaalsContact O-CG1 3.28Å; G330-V422 WeakPolarHBondContact O-CG1 3.45Å
331	Q	89.9	Confident	90.7	Very high	99 Å²	99	45 Å²	45	46%	0.463	22%	0.215	S	C	.	.	H	α-helix	trans	-69	-35.5	176.1	178.1	-171.9	1.1	0	0	112.2	V288 N289 I328 Y329 S334 H335	V288-Q331 HydrophobicContact CG1-CG 4.06Å; N289-Q331 PolarHBondContact ND2-OE1 3.24Å; I328-Q331 PolarHBondContact O-N 2.97Å; Y329-Q331 VanDerWaalsContact C-N 3.32Å; Y329-Q331 PolarHBondContact O-N 2.81Å; Q331-S334 PolarHBondContact O-OG 2.81Å; Q331-S334 VanDerWaalsContact O-OG 3.05Å; Q331-H335 PolarHBondContact O-ND1 2.75Å
332	Y	92.9	Very high	90.6	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-66.3	-56	178.5	-167.7	-100	0	0	0	111.2	V288 N289 L290 I293 I328 Y329 S334 H335 M336 L375 P378	V288-Y332 HydrophobicContact CB-CD2 4.15Å; N289-Y332 WeakPolarHBondContact OD1-CB 3.48Å; N289-Y332 WeakPolarHBondContact OD1-CD2 3.47Å; L290-Y332 HydrophobicContact CB-CE2 4.07Å; L290-Y332 HydrophobicContact CD1-CE2 3.85Å; L290-Y332 HydrophobicContact CG-CE2 4.5Å; I293-Y332 HydrophobicContact CD1-CD1 4.17Å; I293-Y332 HydrophobicContact CD1-CD2 3.63Å; I293-Y332 HydrophobicContact CD1-CE2 4.27Å; I293-Y332 HydrophobicContact CD1-CG 3.58Å; I328-Y332 PolarHBondContact O-N 3.18Å; Y329-Y332 PolarHBondContact O-N 3.18Å; Y329-Y332 VanDerWaalsContact O-N 3.16Å; Y332-S334 VanDerWaalsContact C-N 3.28Å; Y332-S334 PolarHBondContact O-N 3.12Å; Y332-H335 PolarHBondContact O-N 3.19Å; Y332-H335 VanDerWaalsContact O-N 3.16Å; Y332-M336 HydrophobicContact CD1-SD 4.17Å; Y332-M336 HydrophobicContact CE1-SD 3.34Å; Y332-M336 WeakPolarHBondContact CE1-SD 3.37Å; Y332-M336 HydrophobicContact CE2-SD 4.38Å; Y332-M336 PolarHBondContact O-N 2.79Å; Y332-M336 VanDerWaalsContact O-N 3.13Å; Y332-M336 PolarHBondContact OH-SD 3.47Å; Y332-L375 WeakPolarHBondContact OH-CD2 3.46Å; Y332-L375 PolarHBondContact OH-O 2.89Å; Y332-L375 VanDerWaalsContact OH-O 3.05Å; Y332-P378 HydrophobicContact CD1-CB 4.05Å; Y332-P378 HydrophobicContact CE1-CB 3.59Å; Y332-P378 HydrophobicContact CE1-CG 3.8Å
333	C	89.1	Confident	90.4	Very high	7 Å²	7	41.5 Å²	41.5	5%	0.047	20%	0.198	C	C	.	.	H	α-helix	trans	-64.3	-30.3	-176	-60.8	0	0	0	0	112.8	Y329 M379 I419	Y329-C333 WeakPolarHBondContact O-CB 3.49Å; Y329-C333 PolarHBondContact O-N 3.46Å; Y329-C333 PolarHBondContact O-SG 3.13Å; C333-M379 HydrophobicContact CB-CG 4.37Å; C333-M379 HydrophobicContact CB-SD 4.45Å; C333-I419 HydrophobicContact CB-CG2 3.83Å
334	S	85.7	Confident	90.3	Very high	25 Å²	25	42.6 Å²	42.6	18%	0.175	21%	0.205	C	C	.	.	H	α-helix	trans	-70.6	-30	176.1	62.8	0	0	0	0	114.4	G330 Q331 Y332 N426	G330-S334 WeakPolarHBondContact O-CB 3.45Å; G330-S334 PolarHBondContact O-N 2.82Å; G330-S334 PolarHBondContact O-OG 2.91Å; Q331-S334 PolarHBondContact O-OG 2.81Å; Q331-S334 VanDerWaalsContact O-OG 3.05Å; Y332-S334 VanDerWaalsContact C-N 3.28Å; Y332-S334 PolarHBondContact O-N 3.12Å; S334-N426 WeakPolarHBondContact CB-ND2 3.4Å
335	H	87.8	Confident	90.4	Very high	79 Å²	79	37.6 Å²	37.6	37%	0.366	19%	0.191	S	C	.	.	H	α-helix	trans	-100.5	-6.6	-176	-64	96.8	0	0	0	113	V288 Q331 Y332 E337 N338 A339	V288-H335 HydrophobicContact CG1-CB 3.95Å; V288-H335 HydrophobicContact CG2-CB 3.79Å; Q331-H335 PolarHBondContact O-ND1 2.75Å; Y332-H335 PolarHBondContact O-N 3.19Å; Y332-H335 VanDerWaalsContact O-N 3.16Å; H335-E337 PolarHBondContact O-N 2.75Å; H335-N338 WeakPolarHBondContact O-CA 3.16Å; H335-N338 WeakPolarHBondContact O-CB 3.25Å; H335-N338 PolarHBondContact O-N 2.67Å; H335-A339 PolarHBondContact O-N 3.46Å
336	M	87.5	Confident	90.2	Very high	7 Å²	7	34 Å²	34	3%	0.034	18%	0.179	C	C	.	.	H	α-helix	trans	-59.6	-43.4	-170	-166.6	75.9	-81.3	0	0	114	Y332 N338 A339 Q340 L375	Y332-M336 HydrophobicContact CD1-SD 4.17Å; Y332-M336 HydrophobicContact CE1-SD 3.34Å; Y332-M336 WeakPolarHBondContact CE1-SD 3.37Å; Y332-M336 HydrophobicContact CE2-SD 4.38Å; Y332-M336 PolarHBondContact O-N 2.79Å; Y332-M336 VanDerWaalsContact O-N 3.13Å; Y332-M336 PolarHBondContact OH-SD 3.47Å; M336-N338 VanDerWaalsContact C-N 3.27Å; M336-N338 PolarHBondContact O-N 3.04Å; M336-A339 HydrophobicContact CE-CB 3.45Å; M336-A339 VanDerWaalsContact CE-CB 3.45Å; M336-A339 WeakPolarHBondContact O-CB 3.47Å; M336-A339 PolarHBondContact O-N 3.26Å; M336-Q340 PolarHBondContact O-N 2.86Å; M336-L375 HydrophobicContact CE-CB 3.8Å; M336-L375 HydrophobicContact CE-CD1 4.21Å; M336-L375 HydrophobicContact CE-CD2 4.24Å; M336-L375 HydrophobicContact CE-CG 4.3Å; M336-L375 HydrophobicContact SD-CB 4.02Å
337	E	83.1	Confident	90	Very high	91 Å²	91	35.6 Å²	35.6	43%	0.425	19%	0.187	S	C	.	.	H	α-helix	trans	-62.9	-34.5	176.3	-66	173.3	-153.9	0	0	112.2	H335 K341 K423	H335-E337 PolarHBondContact O-N 2.75Å; E337-K341 WeakPolarHBondContact O-CB 3.33Å; E337-K341 VanDerWaalsContact O-CG 3.23Å; E337-K341 WeakPolarHBondContact O-CG 3.43Å; E337-K341 PolarHBondContact O-N 2.89Å; E337-K341 VanDerWaalsContact O-N 3.08Å; E337-K423 WeakPolarHBondContact OE1-CE 3.35Å; E337-K423 IonicContact OE1-NZ 3.37Å; E337-K423 PolarHBondContact OE1-NZ 3.08Å
338	N	87.2	Confident	90	Very high	91 Å²	91	39.2 Å²	39.2	49%	0.487	22%	0.219	S	C	.	.	H	α-helix	trans	-74	-38.3	176.4	-175.2	80.9	0	0	0	111.5	H335 M336 K341 T342	H335-N338 WeakPolarHBondContact O-CA 3.16Å; H335-N338 WeakPolarHBondContact O-CB 3.25Å; H335-N338 PolarHBondContact O-N 2.67Å; M336-N338 VanDerWaalsContact C-N 3.27Å; M336-N338 PolarHBondContact O-N 3.04Å; N338-K341 PolarHBondContact O-N 3.11Å; N338-T342 WeakPolarHBondContact O-CB 3.38Å; N338-T342 PolarHBondContact O-N 3.2Å; N338-T342 PolarHBondContact O-OG1 3.33Å
339	A	91	Very high	90	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-62.2	-47.1	175.3	0	0	0	0	0	112	A285 I286 V288 H335 M336 T342 L343	A285-A339 VanDerWaalsContact O-CA 3.22Å; A285-A339 WeakPolarHBondContact O-CA 3.28Å; A285-A339 WeakPolarHBondContact O-CB 3.41Å; I286-A339 WeakPolarHBondContact O-CB 3.36Å; V288-A339 HydrophobicContact CG2-CB 4.21Å; H335-A339 PolarHBondContact O-N 3.46Å; M336-A339 HydrophobicContact CE-CB 3.45Å; M336-A339 VanDerWaalsContact CE-CB 3.45Å; M336-A339 WeakPolarHBondContact O-CB 3.47Å; M336-A339 PolarHBondContact O-N 3.26Å; A339-T342 PolarHBondContact O-N 2.86Å; A339-L343 WeakPolarHBondContact O-CB 3.47Å; A339-L343 PolarHBondContact O-N 2.58Å
340	Q	88.3	Confident	89.9	Confident	37 Å²	37	45.4 Å²	45.4	17%	0.173	25%	0.252	C	S	.	.	H	α-helix	trans	-61.2	-46.3	173	-74.8	179.8	-34.1	0	0	111.7	M336 T342 L343 D344 Q372 V376	M336-Q340 PolarHBondContact O-N 2.86Å; Q340-T342 VanDerWaalsContact C-N 3.3Å; Q340-T342 PolarHBondContact O-N 3.12Å; Q340-L343 PolarHBondContact O-N 3.38Å; Q340-D344 WeakPolarHBondContact O-CB 3.5Å; Q340-D344 VanDerWaalsContact O-CG 3.26Å; Q340-D344 PolarHBondContact O-N 3.14Å; Q340-Q372 PolarHBondContact NE2-O 3.32Å; Q340-V376 VanDerWaalsContact NE2-CG2 3.29Å
341	K	87.8	Confident	90	Very high	79 Å²	79	50.4 Å²	50.4	34%	0.343	28%	0.275	S	S	.	.	H	α-helix	trans	-59.7	-37.8	175.3	-77.3	173.6	174.7	-175.2	0	113.2	K103 E337 N338 G345	K103-K341 VanDerWaalsContact CB-CE 3.46Å; K103-K341 HydrophobicContact CD-CG 4.37Å; K103-K341 PolarHBondContact O-NZ 3.2Å; E337-K341 WeakPolarHBondContact O-CB 3.33Å; E337-K341 VanDerWaalsContact O-CG 3.23Å; E337-K341 WeakPolarHBondContact O-CG 3.43Å; E337-K341 PolarHBondContact O-N 2.89Å; E337-K341 VanDerWaalsContact O-N 3.08Å; N338-K341 PolarHBondContact O-N 3.11Å; K341-G345 PolarHBondContact O-N 2.81Å
342	T	92.2	Very high	90.1	Very high	36 Å²	36	49.7 Å²	49.7	22%	0.221	28%	0.275	C	S	.	.	H	α-helix	trans	-67.3	-44.8	176.5	-57.5	0	0	0	0	110.6	A285 I286 N338 A339 Q340 G345 L346	A285-T342 HydrophobicContact CB-CG2 4.08Å; I286-T342 HydrophobicContact CD1-CG2 4.48Å; I286-T342 HydrophobicContact CG1-CG2 4Å; N338-T342 WeakPolarHBondContact O-CB 3.38Å; N338-T342 PolarHBondContact O-N 3.2Å; N338-T342 PolarHBondContact O-OG1 3.33Å; A339-T342 PolarHBondContact O-N 2.86Å; Q340-T342 VanDerWaalsContact C-N 3.3Å; Q340-T342 PolarHBondContact O-N 3.12Å; T342-G345 PolarHBondContact O-N 2.98Å; T342-L346 HydrophobicContact CG2-CD1 3.95Å; T342-L346 WeakPolarHBondContact O-CB 3.38Å; T342-L346 VanDerWaalsContact O-CG 3.27Å; T342-L346 WeakPolarHBondContact O-CG 3.49Å; T342-L346 PolarHBondContact O-N 2.98Å
343	L	93.4	Very high	90	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-62.8	-48.4	176.3	179.5	59.8	0	0	0	112.1	I286 A339 Q340 G345 L346 I347 M353 V357 L371 Q372 L375	I286-L343 HydrophobicContact CD1-CB 4.41Å; I286-L343 HydrophobicContact CD1-CD1 4.24Å; I286-L343 HydrophobicContact CG1-CB 4.25Å; I286-L343 HydrophobicContact CG2-CB 4.35Å; I286-L343 HydrophobicContact CG2-CD1 4.48Å; I286-L343 HydrophobicContact CG2-CD2 4.49Å; A339-L343 WeakPolarHBondContact O-CB 3.47Å; A339-L343 PolarHBondContact O-N 2.58Å; Q340-L343 PolarHBondContact O-N 3.38Å; L343-G345 PolarHBondContact O-N 3.33Å; L343-L346 PolarHBondContact O-N 3.5Å; L343-I347 HydrophobicContact CD1-CD1 3.75Å; L343-I347 HydrophobicContact CD1-CG1 4.22Å; L343-I347 HydrophobicContact CG-CD1 3.84Å; L343-I347 WeakPolarHBondContact O-CB 3.48Å; L343-I347 VanDerWaalsContact O-CG1 3.3Å; L343-I347 WeakPolarHBondContact O-CG1 3.47Å; L343-I347 PolarHBondContact O-N 3.04Å; L343-M353 HydrophobicContact CD1-CE 3.46Å; L343-M353 VanDerWaalsContact CD1-CE 3.46Å; L343-V357 HydrophobicContact CD1-CG2 4.36Å; L343-L371 HydrophobicContact CD1-CD2 4.1Å; L343-L371 HydrophobicContact CD2-CB 4.05Å; L343-L371 HydrophobicContact CD2-CD2 3.75Å; L343-L371 HydrophobicContact CD2-CG 3.73Å; L343-Q372 HydrophobicContact CD2-CG 4.1Å; L343-L375 HydrophobicContact CD2-CD1 4.1Å
344	D	90.8	Very high	90.1	Very high	53 Å²	53	52 Å²	52	28%	0.283	28%	0.284	S	S	.	.	H	α-helix	trans	-57.1	-48.5	175.6	-72.1	-16.4	0	0	0	110.9	K103 Q340 L346 I347 A348 Q372	K103-D344 IonicContact NZ-OD2 2.76Å; K103-D344 PolarHBondContact NZ-OD2 2.83Å; Q340-D344 WeakPolarHBondContact O-CB 3.5Å; Q340-D344 VanDerWaalsContact O-CG 3.26Å; Q340-D344 PolarHBondContact O-N 3.14Å; D344-L346 PolarHBondContact O-N 2.99Å; D344-I347 PolarHBondContact O-N 3Å; D344-A348 VanDerWaalsContact O-CB 3.31Å; D344-A348 WeakPolarHBondContact O-CB 3.36Å; D344-A348 PolarHBondContact O-N 2.88Å; D344-Q372 WeakPolarHBondContact OD1-CG 3.39Å; D344-Q372 PolarHBondContact OD1-NE2 3.21Å
345	G	91.9	Very high	90.4	Very high	34 Å²	34	55.4 Å²	55.4	35%	0.351	30%	0.299	S	S	.	.	H	α-helix	trans	-63.3	-37.6	179.2	0	0	0	0	0	113.4	K341 T342 L343 T349	K341-G345 PolarHBondContact O-N 2.81Å; T342-G345 PolarHBondContact O-N 2.98Å; L343-G345 PolarHBondContact O-N 3.33Å; G345-T349 WeakPolarHBondContact O-CB 3.43Å; G345-T349 VanDerWaalsContact O-CG2 3.32Å; G345-T349 WeakPolarHBondContact O-CG2 3.39Å; G345-T349 PolarHBondContact O-N 3.37Å; G345-T349 PolarHBondContact O-OG1 3.09Å
346	L	92.2	Very high	90.5	Very high	22 Å²	22	53.5 Å²	53.5	12%	0.115	29%	0.29	C	S	.	.	H	α-helix	trans	-70.6	-45.3	175.1	-72	166.5	0	0	0	111.5	L278 E282 I286 T342 L343 D344 A348 T349 R350 M353	L278-L346 HydrophobicContact CD2-CD1 4.18Å; E282-L346 HydrophobicContact CB-CD1 4.3Å; E282-L346 HydrophobicContact CG-CD1 4.09Å; E282-L346 VanDerWaalsContact OE1-CD2 3.26Å; E282-L346 WeakPolarHBondContact OE1-CD2 3.5Å; I286-L346 HydrophobicContact CD1-CD1 3.7Å; T342-L346 HydrophobicContact CG2-CD1 3.95Å; T342-L346 WeakPolarHBondContact O-CB 3.38Å; T342-L346 VanDerWaalsContact O-CG 3.27Å; T342-L346 WeakPolarHBondContact O-CG 3.49Å; T342-L346 PolarHBondContact O-N 2.98Å; L343-L346 PolarHBondContact O-N 3.5Å; D344-L346 PolarHBondContact O-N 2.99Å; L346-A348 PolarHBondContact O-N 3.33Å; L346-T349 PolarHBondContact O-N 2.54Å; L346-T349 VanDerWaalsContact O-N 3.15Å; L346-T349 PolarHBondContact O-OG1 2.72Å; L346-R350 WeakPolarHBondContact O-CB 3.42Å; L346-R350 PolarHBondContact O-N 2.91Å; L346-M353 HydrophobicContact CB-CG 4.18Å
347	I	91.8	Very high	90.7	Very high	34 Å²	34	53.6 Å²	53.6	17%	0.174	29%	0.291	C	S	.	.	H	α-helix	trans	-60.2	-35.9	175.4	-69.3	167	0	0	0	111.3	L343 D344 M353 K354 V357	L343-I347 HydrophobicContact CD1-CD1 3.75Å; L343-I347 HydrophobicContact CD1-CG1 4.22Å; L343-I347 HydrophobicContact CG-CD1 3.84Å; L343-I347 WeakPolarHBondContact O-CB 3.48Å; L343-I347 VanDerWaalsContact O-CG1 3.3Å; L343-I347 WeakPolarHBondContact O-CG1 3.47Å; L343-I347 PolarHBondContact O-N 3.04Å; D344-I347 PolarHBondContact O-N 3Å; I347-M353 HydrophobicContact CG1-CG 4.44Å; I347-K354 HydrophobicContact CG2-CB 4.05Å; I347-K354 HydrophobicContact CG2-CD 4.13Å; I347-K354 HydrophobicContact CG2-CG 4.09Å; I347-V357 HydrophobicContact CD1-CB 4.35Å; I347-V357 HydrophobicContact CD1-CG1 4.06Å; I347-V357 HydrophobicContact CD1-CG2 4.2Å; I347-V357 HydrophobicContact CG1-CG2 4.26Å
348	A	91.6	Very high	91	Very high	87 Å²	87	54 Å²	54	72%	0.719	29%	0.293	S	S	*	.	H	α-helix	trans	-75.9	-18.8	178.3	0	0	0	0	0	114.6	D344 L346	D344-A348 VanDerWaalsContact O-CB 3.31Å; D344-A348 WeakPolarHBondContact O-CB 3.36Å; D344-A348 PolarHBondContact O-N 2.88Å; L346-A348 PolarHBondContact O-N 3.33Å
349	T	92.8	Very high	91.2	Very high	112 Å²	112	53.3 Å²	53.3	69%	0.687	29%	0.286	S	S	*	.	H	α-helix	trans	-114	-21.4	-175	54.1	0	0	0	0	114.5	G345 L346	G345-T349 WeakPolarHBondContact O-CB 3.43Å; G345-T349 VanDerWaalsContact O-CG2 3.32Å; G345-T349 WeakPolarHBondContact O-CG2 3.39Å; G345-T349 PolarHBondContact O-N 3.37Å; G345-T349 PolarHBondContact O-OG1 3.09Å; L346-T349 PolarHBondContact O-N 2.54Å; L346-T349 VanDerWaalsContact O-N 3.15Å; L346-T349 PolarHBondContact O-OG1 2.72Å
350	R	92.6	Very high	91.2	Very high	60 Å²	60	53.3 Å²	53.3	23%	0.226	29%	0.286	C	S	.	.			trans	-124.9	100.3	-173.8	-74.1	-178	62.4	-178.5	-1.9	110.6	V277 E282 L346 D352 M353 K354	V277-R350 PolarHBondContact O-NH1 2.86Å; V277-R350 PolarHBondContact O-NH2 2.86Å; E282-R350 IonicContact OE1-NH1 2.74Å; E282-R350 PolarHBondContact OE1-NH1 2.83Å; E282-R350 IonicContact OE2-NH1 3.12Å; L346-R350 WeakPolarHBondContact O-CB 3.42Å; L346-R350 PolarHBondContact O-N 2.91Å; R350-D352 VanDerWaalsContact CB-OD1 3.32Å; R350-D352 WeakPolarHBondContact CB-OD1 3.47Å; R350-D352 IonicContact CZ-OD2 2.89Å; R350-D352 IonicContact NE-OD1 2.67Å; R350-D352 IonicContact NE-OD2 2.75Å; R350-D352 PolarHBondContact NE-OD2 3.07Å; R350-D352 IonicContact NH2-OD2 2.62Å; R350-D352 PolarHBondContact NH2-OD2 3.06Å; R350-D352 PolarHBondContact O-N 3.02Å; R350-M353 HydrophobicContact CB-CB 3.71Å; R350-M353 WeakPolarHBondContact O-CB 3.12Å; R350-M353 PolarHBondContact O-N 3.23Å; R350-M353 VanDerWaalsContact O-N 3.09Å; R350-K354 PolarHBondContact O-N 3.39Å
351	E	91.4	Very high	91.2	Very high	105 Å²	105	52.1 Å²	52.1	49%	0.491	28%	0.282	S	S	.	.	H	α-helix	trans	-64.5	-28.9	179.7	-170.9	61.7	-149.7	0	0	112.1	K354 I355	E351-K354 PolarHBondContact O-N 2.79Å; E351-K354 IonicContact OE1-NZ 3.25Å; E351-K354 PolarHBondContact OE1-NZ 3.46Å; E351-K354 IonicContact OE2-NZ 3.52Å; E351-K354 PolarHBondContact OE2-NZ 2.83Å; E351-I355 HydrophobicContact CG-CD1 4.04Å; E351-I355 HydrophobicContact CG-CG1 4.5Å; E351-I355 WeakPolarHBondContact O-CB 3.35Å; E351-I355 VanDerWaalsContact O-CG1 3.28Å; E351-I355 WeakPolarHBondContact O-CG1 3.3Å; E351-I355 PolarHBondContact O-N 2.82Å
352	D	90.4	Very high	91.2	Very high	84 Å²	84	54.2 Å²	54.2	45%	0.449	29%	0.294	S	S	.	.	H	α-helix	trans	-62.5	-42.4	170.9	61.6	-58.4	0	0	0	112.2	V277 R350 K356	V277-D352 WeakPolarHBondContact CG1-OD2 3.39Å; R350-D352 VanDerWaalsContact CB-OD1 3.32Å; R350-D352 WeakPolarHBondContact CB-OD1 3.47Å; R350-D352 IonicContact CZ-OD2 2.89Å; R350-D352 IonicContact NE-OD1 2.67Å; R350-D352 IonicContact NE-OD2 2.75Å; R350-D352 PolarHBondContact NE-OD2 3.07Å; R350-D352 IonicContact NH2-OD2 2.62Å; R350-D352 PolarHBondContact NH2-OD2 3.06Å; R350-D352 PolarHBondContact O-N 3.02Å; D352-K356 WeakPolarHBondContact O-CB 3.47Å; D352-K356 PolarHBondContact O-N 2.8Å; D352-K356 VanDerWaalsContact O-N 3.15Å
353	M	90.9	Very high	90.8	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-68.6	-45.6	175.6	174.2	56.1	176.5	0	0	111.1	L274 L278 I286 L343 L346 I347 R350 K356 V357	L274-M353 HydrophobicContact CD1-CE 4.38Å; L274-M353 HydrophobicContact CD2-CE 4.09Å; L274-M353 HydrophobicContact CD2-SD 3.66Å; L278-M353 HydrophobicContact CD1-CE 3.92Å; L278-M353 HydrophobicContact CD1-SD 4.34Å; L278-M353 HydrophobicContact CD2-CE 4.08Å; L278-M353 HydrophobicContact CD2-CG 4.46Å; L278-M353 HydrophobicContact CD2-SD 3.76Å; L278-M353 HydrophobicContact CG-CE 4.35Å; L278-M353 HydrophobicContact CG-SD 4.15Å; I286-M353 HydrophobicContact CD1-CE 4.41Å; L343-M353 HydrophobicContact CD1-CE 3.46Å; L343-M353 VanDerWaalsContact CD1-CE 3.46Å; L346-M353 HydrophobicContact CB-CG 4.18Å; I347-M353 HydrophobicContact CG1-CG 4.44Å; R350-M353 HydrophobicContact CB-CB 3.71Å; R350-M353 WeakPolarHBondContact O-CB 3.12Å; R350-M353 PolarHBondContact O-N 3.23Å; R350-M353 VanDerWaalsContact O-N 3.09Å; M353-K356 PolarHBondContact O-N 2.95Å; M353-K356 VanDerWaalsContact O-N 3.15Å; M353-V357 HydrophobicContact CE-CG2 3.49Å; M353-V357 VanDerWaalsContact CE-CG2 3.49Å; M353-V357 HydrophobicContact CG-CG2 4.49Å; M353-V357 WeakPolarHBondContact O-CG2 2.95Å; M353-V357 PolarHBondContact O-N 3.25Å; M353-V357 HydrophobicContact SD-CG2 3.85Å
354	K	91.2	Very high	90.2	Very high	56 Å²	56	58 Å²	58	24%	0.243	31%	0.308	C	S	.	.	H	α-helix	trans	-56.7	-53.7	177.5	172	163.3	152.8	-83.4	0	112.2	I347 R350 E351 K356 V357 E358	I347-K354 HydrophobicContact CG2-CB 4.05Å; I347-K354 HydrophobicContact CG2-CD 4.13Å; I347-K354 HydrophobicContact CG2-CG 4.09Å; R350-K354 PolarHBondContact O-N 3.39Å; E351-K354 PolarHBondContact O-N 2.79Å; E351-K354 IonicContact OE1-NZ 3.25Å; E351-K354 PolarHBondContact OE1-NZ 3.46Å; E351-K354 IonicContact OE2-NZ 3.52Å; E351-K354 PolarHBondContact OE2-NZ 2.83Å; K354-K356 PolarHBondContact O-N 3.44Å; K354-V357 PolarHBondContact O-N 3.27Å; K354-E358 WeakPolarHBondContact CE-OE1 3.45Å; K354-E358 VanDerWaalsContact CG-OE1 3.31Å; K354-E358 WeakPolarHBondContact CG-OE1 3.5Å; K354-E358 WeakPolarHBondContact O-CG 3.44Å; K354-E358 PolarHBondContact O-N 3.45Å
355	I	91.9	Very high	89.3	Confident	96 Å²	96	58.7 Å²	58.7	49%	0.492	31%	0.309	S	S	.	.	H	α-helix	trans	-57.6	-39	176.2	-68	167.1	0	0	0	110.7	E351 E358 E359	E351-I355 HydrophobicContact CG-CD1 4.04Å; E351-I355 HydrophobicContact CG-CG1 4.5Å; E351-I355 WeakPolarHBondContact O-CB 3.35Å; E351-I355 VanDerWaalsContact O-CG1 3.28Å; E351-I355 WeakPolarHBondContact O-CG1 3.3Å; E351-I355 PolarHBondContact O-N 2.82Å; I355-E358 PolarHBondContact O-N 3.01Å; I355-E359 WeakPolarHBondContact O-CB 3.48Å; I355-E359 PolarHBondContact O-N 3.35Å
356	K	91.8	Very high	88.5	Confident	39 Å²	39	66.2 Å²	66.2	17%	0.17	34%	0.335	C	S	.	.	H	α-helix	trans	-68.2	-41.5	178.6	-161.4	72.6	-167.2	167.2	0	112.9	L274 V277 D352 M353 K354 E359 C360	L274-K356 HydrophobicContact CD2-CB 4.22Å; L274-K356 HydrophobicContact CD2-CG 3.87Å; V277-K356 HydrophobicContact CG2-CB 4.49Å; V277-K356 HydrophobicContact CG2-CD 4.3Å; V277-K356 HydrophobicContact CG2-CG 4.05Å; D352-K356 WeakPolarHBondContact O-CB 3.47Å; D352-K356 PolarHBondContact O-N 2.8Å; D352-K356 VanDerWaalsContact O-N 3.15Å; M353-K356 PolarHBondContact O-N 2.95Å; M353-K356 VanDerWaalsContact O-N 3.15Å; K354-K356 PolarHBondContact O-N 3.44Å; K356-E359 WeakPolarHBondContact CD-OE2 3.31Å; K356-E359 WeakPolarHBondContact CE-OE2 3.28Å; K356-E359 IonicContact NZ-OE1 2.76Å; K356-E359 IonicContact NZ-OE2 3.45Å; K356-E359 PolarHBondContact NZ-OE2 2.92Å; K356-E359 PolarHBondContact O-N 2.97Å; K356-C360 WeakPolarHBondContact O-CB 3.14Å; K356-C360 PolarHBondContact O-N 2.99Å; K356-C360 PolarHBondContact O-SG 3.29Å
357	V	91.2	Very high	87.7	Confident	9 Å²	9	66.3 Å²	66.3	6%	0.055	34%	0.342	C	S	.	.	H	α-helix	trans	-65.1	-40.9	175.5	173.3	0	0	0	0	110.9	L274 L343 I347 M353 K354 C360 T361 L371	L274-V357 HydrophobicContact CD1-CG2 4.47Å; L274-V357 HydrophobicContact CD2-CG2 4.17Å; L343-V357 HydrophobicContact CD1-CG2 4.36Å; I347-V357 HydrophobicContact CD1-CB 4.35Å; I347-V357 HydrophobicContact CD1-CG1 4.06Å; I347-V357 HydrophobicContact CD1-CG2 4.2Å; I347-V357 HydrophobicContact CG1-CG2 4.26Å; M353-V357 HydrophobicContact CE-CG2 3.49Å; M353-V357 VanDerWaalsContact CE-CG2 3.49Å; M353-V357 HydrophobicContact CG-CG2 4.49Å; M353-V357 WeakPolarHBondContact O-CG2 2.95Å; M353-V357 PolarHBondContact O-N 3.25Å; M353-V357 HydrophobicContact SD-CG2 3.85Å; K354-V357 PolarHBondContact O-N 3.27Å; V357-C360 PolarHBondContact O-N 3.11Å; V357-T361 VanDerWaalsContact O-CB 3.31Å; V357-T361 WeakPolarHBondContact O-CB 3.46Å; V357-T361 PolarHBondContact O-N 2.97Å; V357-T361 PolarHBondContact O-OG1 3.27Å; V357-L371 HydrophobicContact CG1-CB 4.45Å
358	E	89.9	Confident	87.1	Confident	100 Å²	100	70 Å²	70	47%	0.467	36%	0.357	S	S	.	.	H	α-helix	trans	-61.7	-46.4	174.7	-70.7	171	-168	0	0	111.2	K354 I355 C360 T361 M362	K354-E358 WeakPolarHBondContact CE-OE1 3.45Å; K354-E358 VanDerWaalsContact CG-OE1 3.31Å; K354-E358 WeakPolarHBondContact CG-OE1 3.5Å; K354-E358 WeakPolarHBondContact O-CG 3.44Å; K354-E358 PolarHBondContact O-N 3.45Å; I355-E358 PolarHBondContact O-N 3.01Å; E358-C360 VanDerWaalsContact C-N 3.33Å; E358-C360 PolarHBondContact O-N 3.47Å; E358-T361 PolarHBondContact O-N 2.98Å; E358-M362 WeakPolarHBondContact O-CG 3.5Å; E358-M362 PolarHBondContact O-N 2.87Å
359	E	90.4	Very high	86.8	Confident	76 Å²	76	66.5 Å²	66.5	36%	0.355	33%	0.325	S	S	.	.	H	α-helix	trans	-59.9	-38.4	175.3	-167.5	-147.6	142.9	0	0	112.8	I355 K356 K363	I355-E359 WeakPolarHBondContact O-CB 3.48Å; I355-E359 PolarHBondContact O-N 3.35Å; K356-E359 WeakPolarHBondContact CD-OE2 3.31Å; K356-E359 WeakPolarHBondContact CE-OE2 3.28Å; K356-E359 IonicContact NZ-OE1 2.76Å; K356-E359 IonicContact NZ-OE2 3.45Å; K356-E359 PolarHBondContact NZ-OE2 2.92Å; K356-E359 PolarHBondContact O-N 2.97Å; E359-K363 WeakPolarHBondContact O-CE 3.44Å; E359-K363 WeakPolarHBondContact O-CG 3.4Å; E359-K363 IonicContact OE1-NZ 3.6Å; E359-K363 PolarHBondContact OE1-NZ 3.45Å
360	C	90.9	Very high	86.6	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-73.1	-38.2	176.9	-62.5	0	0	0	0	111.5	N269 Y270 K356 V357 E358 K363 V364	N269-C360 VanDerWaalsContact O-CB 3.27Å; N269-C360 WeakPolarHBondContact O-CB 3.49Å; N269-C360 PolarHBondContact O-SG 2.95Å; Y270-C360 HydrophobicContact CD1-CB 3.39Å; Y270-C360 HydrophobicContact CE1-CB 3.57Å; Y270-C360 HydrophobicContact CG-CB 4.11Å; K356-C360 WeakPolarHBondContact O-CB 3.14Å; K356-C360 PolarHBondContact O-N 2.99Å; K356-C360 PolarHBondContact O-SG 3.29Å; V357-C360 PolarHBondContact O-N 3.11Å; E358-C360 VanDerWaalsContact C-N 3.33Å; E358-C360 PolarHBondContact O-N 3.47Å; C360-K363 WeakPolarHBondContact O-CB 3.31Å; C360-K363 PolarHBondContact O-N 2.96Å; C360-K363 VanDerWaalsContact O-N 3.1Å; C360-V364 PolarHBondContact O-N 3.33Å
361	T	89.1	Confident	86.4	Confident	12 Å²	12	64.2 Å²	64.2	7%	0.074	31%	0.307	C	S	.	.	H	α-helix	trans	-63.9	-41.6	178.7	-57.9	0	0	0	0	111.9	Y270 V357 E358 K363 V364 G367 F369	Y270-T361 VanDerWaalsContact OH-CA 3.25Å; Y270-T361 WeakPolarHBondContact OH-CA 3.43Å; Y270-T361 WeakPolarHBondContact OH-CB 3.28Å; Y270-T361 PolarHBondContact OH-OG1 3.15Å; V357-T361 VanDerWaalsContact O-CB 3.31Å; V357-T361 WeakPolarHBondContact O-CB 3.46Å; V357-T361 PolarHBondContact O-N 2.97Å; V357-T361 PolarHBondContact O-OG1 3.27Å; E358-T361 PolarHBondContact O-N 2.98Å; T361-K363 PolarHBondContact O-N 3.12Å; T361-K363 VanDerWaalsContact O-N 3.09Å; T361-V364 PolarHBondContact O-N 3.3Å; T361-V364 VanDerWaalsContact O-N 3.12Å; T361-V364 VanDerWaalsContact O-O 3.07Å; T361-G367 WeakPolarHBondContact O-CA 3.45Å; T361-G367 PolarHBondContact O-N 3.25Å; T361-F369 WeakPolarHBondContact CG2-O 3.46Å
362	M	86.9	Confident	86.3	Confident	124 Å²	124	60.8 Å²	60.8	61%	0.611	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-16.5	175.2	-64.5	-61.5	99.6	0	0	114.1	E358	E358-M362 WeakPolarHBondContact O-CG 3.5Å; E358-M362 PolarHBondContact O-N 2.87Å
363	K	84.6	Confident	86.2	Confident	112 Å²	112	58.5 Å²	58.5	49%	0.487	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-17.1	177	-63.3	171.3	-167.4	172.6	0	113.5	E359 C360 T361	E359-K363 WeakPolarHBondContact O-CE 3.44Å; E359-K363 WeakPolarHBondContact O-CG 3.4Å; E359-K363 IonicContact OE1-NZ 3.6Å; E359-K363 PolarHBondContact OE1-NZ 3.45Å; C360-K363 WeakPolarHBondContact O-CB 3.31Å; C360-K363 PolarHBondContact O-N 2.96Å; C360-K363 VanDerWaalsContact O-N 3.1Å; T361-K363 PolarHBondContact O-N 3.12Å; T361-K363 VanDerWaalsContact O-N 3.09Å
364	V	81.1	Confident	86.1	Confident	3 Å²	3	58.5 Å²	58.5	2%	0.018	28%	0.279	C	S	.	.	S	Bend	trans	-107.2	117.7	-177.3	179	0	0	0	0	109.4	D265 N269 Y270 C360 T361 E366 G367 L374	D265-V364 HydrophobicContact CB-CG1 4.36Å; N269-V364 HydrophobicContact CB-CG2 3.38Å; Y270-V364 HydrophobicContact CD2-CG2 4.07Å; Y270-V364 HydrophobicContact CE2-CB 3.99Å; Y270-V364 HydrophobicContact CE2-CG1 4.29Å; Y270-V364 HydrophobicContact CE2-CG2 3.65Å; C360-V364 PolarHBondContact O-N 3.33Å; T361-V364 PolarHBondContact O-N 3.3Å; T361-V364 VanDerWaalsContact O-N 3.12Å; T361-V364 VanDerWaalsContact O-O 3.07Å; V364-E366 PolarHBondContact O-N 3.12Å; V364-E366 VanDerWaalsContact O-N 3.13Å; V364-G367 PolarHBondContact O-N 3.45Å; V364-L374 HydrophobicContact CG1-CD1 3.85Å
365	Q	70.4	Confident	86.1	Confident	67 Å²	67	55.9 Å²	55.9	31%	0.313	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	49.7	40.7	177.1	-54.1	-173	25.3	0	0	113.5	G367 K368 F369	Q365-G367 PolarHBondContact O-N 2.76Å; Q365-G367 VanDerWaalsContact O-N 3.08Å; Q365-K368 VanDerWaalsContact O-CB 3.26Å; Q365-K368 WeakPolarHBondContact O-CB 3.35Å; Q365-K368 PolarHBondContact O-N 2.74Å; Q365-F369 VanDerWaalsContact OE1-CD2 3.3Å
366	E	76.5	Confident	85.9	Confident	192 Å²	192	52.4 Å²	52.4	90%	0.897	25%	0.251	S	S	*	.	G	3₁₀ helix	trans	55.3	23.8	-179.3	-57.6	-178.2	179.2	0	0	114.2	V364	V364-E366 PolarHBondContact O-N 3.12Å; V364-E366 VanDerWaalsContact O-N 3.13Å
367	G	74.3	Confident	85.8	Confident	24 Å²	24	50.6 Å²	50.6	25%	0.247	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	78.7	12.5	-177.1	0	0	0	0	0	115.1	T361 V364 Q365 F369	T361-G367 WeakPolarHBondContact O-CA 3.45Å; T361-G367 PolarHBondContact O-N 3.25Å; V364-G367 PolarHBondContact O-N 3.45Å; Q365-G367 PolarHBondContact O-N 2.76Å; Q365-G367 VanDerWaalsContact O-N 3.08Å; G367-F369 PolarHBondContact O-N 3.01Å
368	K	80.1	Confident	85.9	Confident	112 Å²	112	50.2 Å²	50.2	49%	0.487	24%	0.241	S	C	.	.	S	Bend	trans	-60	-32.3	178.7	-175.5	-178.7	170.7	-162.5	0	113.2	D220 Q365	D220-K368 PolarHBondContact O-NZ 2.74Å; D220-K368 IonicContact OD2-NZ 3.52Å; D220-K368 PolarHBondContact OD2-NZ 3.27Å; Q365-K368 VanDerWaalsContact O-CB 3.26Å; Q365-K368 WeakPolarHBondContact O-CB 3.35Å; Q365-K368 PolarHBondContact O-N 2.74Å
369	F	83.7	Confident	85.8	Confident	14 Å²	14	48.1 Å²	48.1	6%	0.061	23%	0.232	C	C	.	.	S	Bend	trans	-132.8	141.6	-178.6	-55.3	-78	0	0	0	110.6	I217 D220 I221 T361 Q365 G367 D373 L374	I217-F369 HydrophobicContact CB-CE1 4.43Å; I217-F369 HydrophobicContact CG1-CD1 4.45Å; I217-F369 HydrophobicContact CG1-CE1 4.32Å; I217-F369 HydrophobicContact CG2-CD1 3.95Å; I217-F369 HydrophobicContact CG2-CE1 4Å; D220-F369 HydrophobicContact CB-CZ 4.33Å; I221-F369 HydrophobicContact CD1-CD1 4.19Å; I221-F369 HydrophobicContact CD1-CD2 4Å; I221-F369 HydrophobicContact CD1-CE1 4.23Å; I221-F369 HydrophobicContact CD1-CE2 4.05Å; I221-F369 HydrophobicContact CD1-CG 4.06Å; I221-F369 HydrophobicContact CD1-CZ 4.15Å; I221-F369 HydrophobicContact CG1-CD1 4.35Å; I221-F369 HydrophobicContact CG1-CD2 3.71Å; I221-F369 HydrophobicContact CG1-CE1 3.99Å; I221-F369 HydrophobicContact CG1-CE2 3.28Å; I221-F369 HydrophobicContact CG1-CG 4.21Å; I221-F369 HydrophobicContact CG1-CZ 3.42Å; I221-F369 VanDerWaalsContact CG1-CZ 3.42Å; T361-F369 WeakPolarHBondContact CG2-O 3.46Å; Q365-F369 VanDerWaalsContact OE1-CD2 3.3Å; G367-F369 PolarHBondContact O-N 3.01Å; F369-D373 HydrophobicContact CB-CB 4.23Å; F369-L374 HydrophobicContact CB-CD2 4.08Å; F369-L374 HydrophobicContact CB-CG 4.15Å
370	K	88.4	Confident	85.5	Confident	124 Å²	124	45 Å²	45	54%	0.539	22%	0.217	S	C	.	.			trans	-84.5	170	177.1	-55.6	169.3	-171.3	161.3	0	111.1	Q372 D373 L374	K370-Q372 VanDerWaalsContact C-N 3.32Å; K370-Q372 PolarHBondContact O-N 3.12Å; K370-D373 WeakPolarHBondContact CB-OD2 3.46Å; K370-D373 PolarHBondContact N-OD2 3.17Å; K370-D373 WeakPolarHBondContact O-CB 3.06Å; K370-D373 PolarHBondContact O-N 2.98Å; K370-L374 WeakPolarHBondContact O-CG 3.36Å; K370-L374 PolarHBondContact O-N 3.3Å
371	L	90.3	Very high	85.6	Confident	0 Å²	0	45 Å²	45	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-61.2	-39	173.6	-176.9	56.9	0	0	0	112.5	I266 Y270 L274 F287 L343 V357 D373 L374 L375	I266-L371 HydrophobicContact CG2-CD1 4.34Å; Y270-L371 HydrophobicContact CD1-CB 4.07Å; Y270-L371 HydrophobicContact CD1-CD1 4.04Å; Y270-L371 HydrophobicContact CD1-CD2 3.89Å; Y270-L371 HydrophobicContact CD1-CG 4.22Å; Y270-L371 HydrophobicContact CD2-CD1 4.05Å; Y270-L371 HydrophobicContact CE1-CB 3.71Å; Y270-L371 HydrophobicContact CE1-CD1 4.36Å; Y270-L371 HydrophobicContact CE1-CD2 4.36Å; Y270-L371 HydrophobicContact CE1-CG 4.36Å; Y270-L371 HydrophobicContact CE2-CD1 4.34Å; Y270-L371 HydrophobicContact CG-CD1 3.85Å; Y270-L371 HydrophobicContact CG-CD2 4.35Å; Y270-L371 PolarHBondContact OH-N 3.13Å; L274-L371 HydrophobicContact CD1-CD2 3.91Å; F287-L371 HydrophobicContact CE1-CD1 4.09Å; F287-L371 HydrophobicContact CE1-CD2 4.46Å; F287-L371 HydrophobicContact CZ-CD1 4.41Å; F287-L371 HydrophobicContact CZ-CD2 4Å; L343-L371 HydrophobicContact CD1-CD2 4.1Å; L343-L371 HydrophobicContact CD2-CB 4.05Å; L343-L371 HydrophobicContact CD2-CD2 3.75Å; L343-L371 HydrophobicContact CD2-CG 3.73Å; V357-L371 HydrophobicContact CG1-CB 4.45Å; L371-D373 VanDerWaalsContact C-N 3.26Å; L371-D373 PolarHBondContact O-N 2.77Å; L371-L374 PolarHBondContact O-N 2.94Å; L371-L375 HydrophobicContact CD1-CD1 4.22Å; L371-L375 HydrophobicContact CD1-CG 4.07Å; L371-L375 HydrophobicContact CG-CD1 4.02Å; L371-L375 HydrophobicContact CG-CG 4.36Å; L371-L375 WeakPolarHBondContact O-CB 3.11Å; L371-L375 WeakPolarHBondContact O-CG 3.22Å; L371-L375 PolarHBondContact O-N 3.41Å; L371-L375 VanDerWaalsContact O-N 3.09Å
372	Q	89.3	Confident	85.7	Confident	32 Å²	32	44.5 Å²	44.5	15%	0.15	21%	0.214	C	C	.	.	H	α-helix	trans	-54	-44.5	174.7	-73.7	86.9	-21.1	0	0	112.2	Q340 L343 D344 K370	Q340-Q372 PolarHBondContact NE2-O 3.32Å; L343-Q372 HydrophobicContact CD2-CG 4.1Å; D344-Q372 WeakPolarHBondContact OD1-CG 3.39Å; D344-Q372 PolarHBondContact OD1-NE2 3.21Å; K370-Q372 VanDerWaalsContact C-N 3.32Å; K370-Q372 PolarHBondContact O-N 3.12Å
373	D	86.6	Confident	85.6	Confident	36 Å²	36	41.1 Å²	41.1	19%	0.193	20%	0.198	C	C	.	.	H	α-helix	trans	-68.4	-50.1	-176.6	-45.5	-11.2	0	0	0	110.2	I217 F369 K370 L371 L375 V376	I217-D373 HydrophobicContact CD1-CB 4.09Å; I217-D373 HydrophobicContact CG2-CB 4.27Å; F369-D373 HydrophobicContact CB-CB 4.23Å; K370-D373 WeakPolarHBondContact CB-OD2 3.46Å; K370-D373 PolarHBondContact N-OD2 3.17Å; K370-D373 WeakPolarHBondContact O-CB 3.06Å; K370-D373 PolarHBondContact O-N 2.98Å; L371-D373 VanDerWaalsContact C-N 3.26Å; L371-D373 PolarHBondContact O-N 2.77Å; D373-L375 PolarHBondContact O-N 3.45Å; D373-V376 PolarHBondContact O-N 2.89Å; D373-V376 VanDerWaalsContact O-N 3.08Å
374	L	90.2	Very high	85.7	Confident	1 Å²	1	37.3 Å²	37.3	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-63	-27.8	-179.5	-67.4	173.3	0	0	0	113.2	I221 T262 I266 Y270 V364 F369 K370 L371 V376	I221-L374 HydrophobicContact CD1-CD2 3.85Å; T262-L374 HydrophobicContact CG2-CD2 3.97Å; I266-L374 HydrophobicContact CD1-CB 4.01Å; I266-L374 HydrophobicContact CG1-CB 4.17Å; I266-L374 HydrophobicContact CG1-CD1 4.45Å; Y270-L374 HydrophobicContact CE2-CD1 3.66Å; V364-L374 HydrophobicContact CG1-CD1 3.85Å; F369-L374 HydrophobicContact CB-CD2 4.08Å; F369-L374 HydrophobicContact CB-CG 4.15Å; K370-L374 WeakPolarHBondContact O-CG 3.36Å; K370-L374 PolarHBondContact O-N 3.3Å; L371-L374 PolarHBondContact O-N 2.94Å; L374-V376 VanDerWaalsContact C-N 3.33Å
375	L	91.6	Very high	86.4	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-20.5	175.7	-74.8	170.7	0	0	0	113.4	I286 F287 L290 Y332 M336 L343 L371 D373 P378	I286-L375 HydrophobicContact CG2-CD1 4.32Å; F287-L375 HydrophobicContact CD1-CD2 4.21Å; F287-L375 HydrophobicContact CE1-CD2 4.42Å; L290-L375 HydrophobicContact CD2-CD2 4.35Å; Y332-L375 WeakPolarHBondContact OH-CD2 3.46Å; Y332-L375 PolarHBondContact OH-O 2.89Å; Y332-L375 VanDerWaalsContact OH-O 3.05Å; M336-L375 HydrophobicContact CE-CB 3.8Å; M336-L375 HydrophobicContact CE-CD1 4.21Å; M336-L375 HydrophobicContact CE-CD2 4.24Å; M336-L375 HydrophobicContact CE-CG 4.3Å; M336-L375 HydrophobicContact SD-CB 4.02Å; L343-L375 HydrophobicContact CD2-CD1 4.1Å; L371-L375 HydrophobicContact CD1-CD1 4.22Å; L371-L375 HydrophobicContact CD1-CG 4.07Å; L371-L375 HydrophobicContact CG-CD1 4.02Å; L371-L375 HydrophobicContact CG-CG 4.36Å; L371-L375 WeakPolarHBondContact O-CB 3.11Å; L371-L375 WeakPolarHBondContact O-CG 3.22Å; L371-L375 PolarHBondContact O-N 3.41Å; L371-L375 VanDerWaalsContact O-N 3.09Å; D373-L375 PolarHBondContact O-N 3.45Å; L375-P378 VanDerWaalsContact O-CD 3.27Å; L375-P378 WeakPolarHBondContact O-CD 3.5Å
376	V	87.5	Confident	87.3	Confident	23 Å²	23	36 Å²	36	14%	0.139	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-34.6	177.3	-168.6	0	0	0	0	111.8	Q340 D373 L374 P378 M379 Q380	Q340-V376 VanDerWaalsContact NE2-CG2 3.29Å; D373-V376 PolarHBondContact O-N 2.89Å; D373-V376 VanDerWaalsContact O-N 3.08Å; L374-V376 VanDerWaalsContact C-N 3.33Å; V376-P378 VanDerWaalsContact C-N 3.32Å; V376-P378 WeakPolarHBondContact O-CD 3.42Å; V376-P378 VanDerWaalsContact O-N 3.07Å; V376-M379 HydrophobicContact CG1-CE 4.14Å; V376-M379 WeakPolarHBondContact O-CB 3.26Å; V376-M379 PolarHBondContact O-N 3.38Å; V376-Q380 HydrophobicContact CG1-CG 4.22Å; V376-Q380 PolarHBondContact O-OE1 2.92Å
377	V	89.5	Confident	87.8	Confident	2 Å²	2	31.3 Å²	31.3	1%	0.012	16%	0.156	C	C	.	.	H	α-helix	trans	-47.2	-40.2	-173.7	-174.6	0	0	0	0	114.5	Y218 I221 I222 Y259 Q380 R381	Y218-V377 HydrophobicContact CD2-CG1 3.86Å; Y218-V377 HydrophobicContact CE2-CG1 4.22Å; I221-V377 HydrophobicContact CD1-CG2 3.7Å; I222-V377 HydrophobicContact CD1-CG1 4.26Å; I222-V377 HydrophobicContact CG1-CG1 4.16Å; Y259-V377 HydrophobicContact CD2-CG1 4.01Å; Y259-V377 HydrophobicContact CE2-CG1 4.08Å; V377-Q380 PolarHBondContact O-N 2.91Å; V377-R381 PolarHBondContact O-N 2.85Å
378	P	92.5	Very high	88.5	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-61.1	-43.5	175.1	-24	36.5	0	0	0	114.4	Y259 L263 L290 Y329 Y332 L375 V376 Q380 R381 V382	Y259-P378 HydrophobicContact CE2-CB 4.46Å; Y259-P378 HydrophobicContact CE2-CG 4.41Å; Y259-P378 VanDerWaalsContact OH-CA 3.25Å; Y259-P378 WeakPolarHBondContact OH-CA 3.44Å; Y259-P378 WeakPolarHBondContact OH-CB 3.32Å; L263-P378 HydrophobicContact CD2-CG 4.06Å; L290-P378 HydrophobicContact CD1-CG 4.05Å; Y329-P378 HydrophobicContact CE1-CB 3.8Å; Y329-P378 WeakPolarHBondContact CE1-O 3.48Å; Y332-P378 HydrophobicContact CD1-CB 4.05Å; Y332-P378 HydrophobicContact CE1-CB 3.59Å; Y332-P378 HydrophobicContact CE1-CG 3.8Å; L375-P378 VanDerWaalsContact O-CD 3.27Å; L375-P378 WeakPolarHBondContact O-CD 3.5Å; V376-P378 VanDerWaalsContact C-N 3.32Å; V376-P378 WeakPolarHBondContact O-CD 3.42Å; V376-P378 VanDerWaalsContact O-N 3.07Å; P378-Q380 PolarHBondContact O-N 2.99Å; P378-R381 PolarHBondContact O-N 2.93Å; P378-V382 PolarHBondContact O-N 2.81Å
379	M	87.3	Confident	89.2	Confident	57 Å²	57	26.1 Å²	26.1	28%	0.281	13%	0.127	S	C	.	.	H	α-helix	trans	-60.3	-32.2	179	179.2	174.8	78.9	0	0	111.4	C333 V376 V382 L383	C333-M379 HydrophobicContact CB-CG 4.37Å; C333-M379 HydrophobicContact CB-SD 4.45Å; V376-M379 HydrophobicContact CG1-CE 4.14Å; V376-M379 WeakPolarHBondContact O-CB 3.26Å; V376-M379 PolarHBondContact O-N 3.38Å; M379-V382 VanDerWaalsContact O-CG1 3.3Å; M379-V382 WeakPolarHBondContact O-CG1 3.28Å; M379-L383 WeakPolarHBondContact O-CG 3.09Å
380	Q	84.7	Confident	89.5	Confident	10 Å²	10	31.1 Å²	31.1	5%	0.047	15%	0.149	C	C	.	.	H	α-helix	trans	-83.2	-41.8	-178.4	-58.8	167.9	-80	0	0	111.4	G214 D215 Y218 V376 V377 P378 V382 L383 K384	G214-Q380 PolarHBondContact O-NE2 3.17Å; D215-Q380 VanDerWaalsContact CA-NE2 3.27Å; D215-Q380 PolarHBondContact OD1-NE2 3.11Å; Y218-Q380 HydrophobicContact CD2-CB 3.61Å; Y218-Q380 HydrophobicContact CE2-CB 4.21Å; Y218-Q380 HydrophobicContact CG-CB 4.05Å; V376-Q380 HydrophobicContact CG1-CG 4.22Å; V376-Q380 PolarHBondContact O-OE1 2.92Å; V377-Q380 PolarHBondContact O-N 2.91Å; P378-Q380 PolarHBondContact O-N 2.99Å; Q380-V382 VanDerWaalsContact C-N 3.28Å; Q380-V382 PolarHBondContact O-N 2.82Å; Q380-L383 PolarHBondContact O-N 3.37Å; Q380-L383 VanDerWaalsContact O-N 3.08Å; Q380-K384 WeakPolarHBondContact O-CG 3.37Å; Q380-K384 PolarHBondContact O-N 3.04Å; Q380-K384 VanDerWaalsContact O-N 3.15Å
381	R	92.6	Very high	89.5	Confident	1 Å²	1	29.1 Å²	29.1	0%	0.004	14%	0.142	C	C	.	.	H	α-helix	trans	-53	-47	178.7	179.7	61.6	178.5	170	0.6	111.9	Y218 T255 E256 Y259 V377 P378 L383 K384 Y385	Y218-R381 HydrophobicContact CE2-CB 3.98Å; Y218-R381 VanDerWaalsContact OH-CD 3.23Å; Y218-R381 WeakPolarHBondContact OH-CD 3.25Å; Y218-R381 PolarHBondContact OH-NH1 2.82Å; T255-R381 VanDerWaalsContact CB-NH1 3.26Å; T255-R381 PolarHBondContact OG1-NH1 2.79Å; T255-R381 PolarHBondContact OG1-NH2 2.97Å; T255-R381 VanDerWaalsContact OG1-NH2 3.13Å; E256-R381 VanDerWaalsContact CA-NH2 3.34Å; E256-R381 VanDerWaalsContact N-NH2 3.15Å; E256-R381 IonicContact OE2-CZ 2.84Å; E256-R381 VanDerWaalsContact OE2-CZ 3.31Å; E256-R381 IonicContact OE2-NE 2.7Å; E256-R381 PolarHBondContact OE2-NE 2.97Å; E256-R381 VanDerWaalsContact OE2-NE 3.08Å; E256-R381 IonicContact OE2-NH2 3.04Å; E256-R381 PolarHBondContact OE2-NH2 2.93Å; Y259-R381 HydrophobicContact CD1-CB 4.34Å; Y259-R381 HydrophobicContact CD1-CG 3.61Å; Y259-R381 HydrophobicContact CD2-CB 3.83Å; Y259-R381 HydrophobicContact CD2-CG 3.88Å; Y259-R381 HydrophobicContact CE1-CB 4.16Å; Y259-R381 HydrophobicContact CE1-CG 3.73Å; Y259-R381 HydrophobicContact CE2-CB 3.68Å; Y259-R381 HydrophobicContact CE2-CG 4.04Å; Y259-R381 HydrophobicContact CG-CB 4.17Å; Y259-R381 HydrophobicContact CG-CG 3.67Å; V377-R381 PolarHBondContact O-N 2.85Å; P378-R381 PolarHBondContact O-N 2.93Å; R381-L383 PolarHBondContact O-N 3.26Å; R381-K384 PolarHBondContact O-N 3.35Å; R381-Y385 HydrophobicContact CG-CE2 4.04Å; R381-Y385 WeakPolarHBondContact CG-OH 3.32Å; R381-Y385 PolarHBondContact NE-OH 3.44Å
382	V	91.7	Very high	89.5	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-65.1	-27.3	-176.2	65	0	0	0	0	112.9	Y329 P378 M379 Q380 L415 I419	Y329-V382 HydrophobicContact CD1-CB 3.98Å; Y329-V382 HydrophobicContact CD1-CG1 3.72Å; Y329-V382 HydrophobicContact CD1-CG2 4.46Å; Y329-V382 HydrophobicContact CD2-CB 4.07Å; Y329-V382 HydrophobicContact CD2-CG2 3.81Å; Y329-V382 HydrophobicContact CE1-CB 4.02Å; Y329-V382 HydrophobicContact CE1-CG1 4.07Å; Y329-V382 HydrophobicContact CE2-CB 4.1Å; Y329-V382 HydrophobicContact CE2-CG2 4.16Å; Y329-V382 HydrophobicContact CG-CB 4Å; Y329-V382 HydrophobicContact CG-CG1 3.98Å; Y329-V382 HydrophobicContact CG-CG2 3.97Å; P378-V382 PolarHBondContact O-N 2.81Å; M379-V382 VanDerWaalsContact O-CG1 3.3Å; M379-V382 WeakPolarHBondContact O-CG1 3.28Å; Q380-V382 VanDerWaalsContact C-N 3.28Å; Q380-V382 PolarHBondContact O-N 2.82Å; V382-L415 HydrophobicContact CG2-CD2 3.63Å; V382-L415 HydrophobicContact CG2-CG 4Å; V382-I419 HydrophobicContact CB-CD1 4.23Å; V382-I419 HydrophobicContact CG1-CD1 3.58Å; V382-I419 HydrophobicContact CG2-CD1 3.58Å
383	L	85.2	Confident	89.6	Confident	53 Å²	53	28.7 Å²	28.7	28%	0.277	14%	0.14	S	C	.	.	H	α-helix	trans	-79.1	-27.6	173.5	-59.8	176	0	0	0	112.7	M379 Q380 R381 Y385 H386 A416	M379-L383 WeakPolarHBondContact O-CG 3.09Å; Q380-L383 PolarHBondContact O-N 3.37Å; Q380-L383 VanDerWaalsContact O-N 3.08Å; R381-L383 PolarHBondContact O-N 3.26Å; L383-Y385 VanDerWaalsContact C-N 3.33Å; L383-Y385 PolarHBondContact O-N 2.9Å; L383-H386 PolarHBondContact O-CD2 3.45Å; L383-H386 PolarHBondContact O-NE2 3.18Å; L383-A416 HydrophobicContact CD2-CB 3.7Å
384	K	86.3	Confident	89.8	Confident	32 Å²	32	29.5 Å²	29.5	14%	0.139	15%	0.149	C	C	.	.	H	α-helix	trans	-75.5	-19	-178.3	-53.3	-99.6	178.8	176.1	0	112.5	D215 Y218 E219 Q380 R381 H386 L387 L388	D215-K384 IonicContact OD1-NZ 3.48Å; D215-K384 IonicContact OD2-NZ 2.67Å; D215-K384 PolarHBondContact OD2-NZ 3.15Å; Y218-K384 HydrophobicContact CD1-CD 4.21Å; Y218-K384 HydrophobicContact CE1-CD 3.76Å; Y218-K384 HydrophobicContact CE1-CG 3.82Å; E219-K384 IonicContact OE1-NZ 3.18Å; E219-K384 PolarHBondContact OE1-NZ 2.84Å; Q380-K384 WeakPolarHBondContact O-CG 3.37Å; Q380-K384 PolarHBondContact O-N 3.04Å; Q380-K384 VanDerWaalsContact O-N 3.15Å; R381-K384 PolarHBondContact O-N 3.35Å; K384-H386 PolarHBondContact O-N 3.28Å; K384-L387 WeakPolarHBondContact O-CB 3.35Å; K384-L387 PolarHBondContact O-N 3.47Å; K384-L388 WeakPolarHBondContact O-CG 3.22Å; K384-L388 PolarHBondContact O-N 2.98Å; K384-L388 VanDerWaalsContact O-N 3.09Å
385	Y	95.1	Very high	89.6	Confident	1 Å²	1	30.8 Å²	30.8	0%	0.004	16%	0.155	C	C	.	.	H	α-helix	trans	-60	-41.5	-179.3	-71.6	-55.6	0	0	0	114.8	E256 H297 F319 R381 L383 L387 L388 L389	E256-Y385 VanDerWaalsContact CD-OH 3.26Å; E256-Y385 PolarHBondContact OE1-OH 3.31Å; E256-Y385 VanDerWaalsContact OE2-CE1 3.31Å; E256-Y385 WeakPolarHBondContact OE2-CE1 3.27Å; E256-Y385 PolarHBondContact OE2-OH 3.02Å; H297-Y385 AromaticContact CE1-CZ 3.99Å; H297-Y385 PolarHBondContact CE1-OH 3.07Å; H297-Y385 PolarHBondContact ND1-OH 3.37Å; F319-Y385 AromaticContact CE1-CD1 3.46Å; F319-Y385 HydrophobicContact CE1-CD1 3.46Å; F319-Y385 VanDerWaalsContact CE1-CD1 3.46Å; F319-Y385 AromaticContact CE1-CE1 3.8Å; F319-Y385 HydrophobicContact CE1-CE1 3.8Å; F319-Y385 AromaticContact CE1-CG 3.93Å; F319-Y385 HydrophobicContact CE1-CG 3.93Å; F319-Y385 AromaticContact CZ-CD1 3.74Å; F319-Y385 HydrophobicContact CZ-CD1 3.74Å; F319-Y385 HydrophobicContact CZ-CE1 4.03Å; R381-Y385 HydrophobicContact CG-CE2 4.04Å; R381-Y385 WeakPolarHBondContact CG-OH 3.32Å; R381-Y385 PolarHBondContact NE-OH 3.44Å; L383-Y385 VanDerWaalsContact C-N 3.33Å; L383-Y385 PolarHBondContact O-N 2.9Å; Y385-L387 VanDerWaalsContact C-N 3.3Å; Y385-L387 PolarHBondContact O-N 2.95Å; Y385-L388 PolarHBondContact O-N 3.36Å; Y385-L389 WeakPolarHBondContact O-CG 3.46Å; Y385-L389 PolarHBondContact O-N 3.45Å
386	H	90.9	Very high	89.3	Confident	43 Å²	43	30.8 Å²	30.8	20%	0.199	16%	0.155	C	C	.	.	H	α-helix	trans	-70.9	-28.6	179.9	71.2	84.4	0	0	0	111.9	L383 K384 K390 L409 M412 E413	L383-H386 PolarHBondContact O-CD2 3.45Å; L383-H386 PolarHBondContact O-NE2 3.18Å; K384-H386 PolarHBondContact O-N 3.28Å; H386-K390 WeakPolarHBondContact O-CB 3.45Å; H386-K390 PolarHBondContact O-N 3.39Å; H386-K390 VanDerWaalsContact O-N 3.1Å; H386-L409 HydrophobicContact CB-CD1 4.02Å; H386-L409 WeakPolarHBondContact O-CD1 3.26Å; H386-M412 HydrophobicContact CB-CB 3.87Å; H386-E413 HydrophobicContact CB-CG 3.83Å
387	L	86.6	Confident	88.9	Confident	93 Å²	93	33.2 Å²	33.2	49%	0.487	17%	0.17	S	C	.	.	H	α-helix	trans	-67.3	-48.9	172.7	-58.3	178.4	0	0	0	111	K384 Y385 L389 K390 E391	K384-L387 WeakPolarHBondContact O-CB 3.35Å; K384-L387 PolarHBondContact O-N 3.47Å; Y385-L387 VanDerWaalsContact C-N 3.3Å; Y385-L387 PolarHBondContact O-N 2.95Å; L387-L389 PolarHBondContact O-N 3.22Å; L387-K390 WeakPolarHBondContact O-CB 3.44Å; L387-K390 PolarHBondContact O-N 2.91Å; L387-E391 PolarHBondContact O-N 2.88Å; L387-E391 VanDerWaalsContact O-N 3.1Å
388	L	88.8	Confident	88.3	Confident	25 Å²	25	40.4 Å²	40.4	13%	0.131	21%	0.208	C	C	.	.	H	α-helix	trans	-60.7	-43.9	178.5	-69	167.2	0	0	0	112.5	E251 I252 K384 Y385 K390 E391 L392	E251-L388 HydrophobicContact CG-CD2 3.98Å; I252-L388 HydrophobicContact CD1-CB 4.11Å; I252-L388 HydrophobicContact CG1-CB 3.81Å; I252-L388 HydrophobicContact CG1-CD1 4.23Å; I252-L388 HydrophobicContact CG1-CD2 4.29Å; I252-L388 HydrophobicContact CG1-CG 4.34Å; K384-L388 WeakPolarHBondContact O-CG 3.22Å; K384-L388 PolarHBondContact O-N 2.98Å; K384-L388 VanDerWaalsContact O-N 3.09Å; Y385-L388 PolarHBondContact O-N 3.36Å; L388-K390 VanDerWaalsContact C-N 3.33Å; L388-K390 PolarHBondContact O-N 2.82Å; L388-E391 PolarHBondContact O-N 3.45Å; L388-L392 WeakPolarHBondContact O-CB 3.25Å; L388-L392 PolarHBondContact O-N 2.86Å; L388-L392 VanDerWaalsContact O-N 3.12Å
389	L	94.2	Very high	87.7	Confident	1 Å²	1	44.2 Å²	44.2	1%	0.005	22%	0.222	C	C	.	.	H	α-helix	trans	-67.4	-32.7	176.5	-72	172	0	0	0	112.8	F319 Y385 L387 L393 L405 A408 L409 M412	F319-L389 HydrophobicContact CB-CD1 4.26Å; F319-L389 HydrophobicContact CD1-CD1 4.48Å; F319-L389 HydrophobicContact CD2-CD1 4.05Å; F319-L389 HydrophobicContact CD2-CD2 3.75Å; F319-L389 HydrophobicContact CD2-CG 4.33Å; F319-L389 HydrophobicContact CE2-CD2 3.96Å; F319-L389 HydrophobicContact CE2-CG 4.48Å; F319-L389 HydrophobicContact CG-CD1 4Å; Y385-L389 WeakPolarHBondContact O-CG 3.46Å; Y385-L389 PolarHBondContact O-N 3.45Å; L387-L389 PolarHBondContact O-N 3.22Å; L389-L393 WeakPolarHBondContact O-CB 3.37Å; L389-L393 PolarHBondContact O-N 2.81Å; L389-L405 HydrophobicContact CD2-CD2 4.36Å; L389-A408 HydrophobicContact CD1-CB 4.11Å; L389-L409 HydrophobicContact CB-CB 4.47Å; L389-L409 HydrophobicContact CB-CD1 4.37Å; L389-M412 HydrophobicContact CD1-CB 4.29Å; L389-M412 HydrophobicContact CD1-CG 3.59Å
390	K	91.4	Very high	87.4	Confident	120 Å²	120	47.5 Å²	47.5	52%	0.522	25%	0.248	S	C	.	.	H	α-helix	trans	-67.2	-40.8	177.2	179.4	177.9	176.7	179.8	0	111.9	H386 L387 L388 L393 S394 L409	H386-K390 WeakPolarHBondContact O-CB 3.45Å; H386-K390 PolarHBondContact O-N 3.39Å; H386-K390 VanDerWaalsContact O-N 3.1Å; L387-K390 WeakPolarHBondContact O-CB 3.44Å; L387-K390 PolarHBondContact O-N 2.91Å; L388-K390 VanDerWaalsContact C-N 3.33Å; L388-K390 PolarHBondContact O-N 2.82Å; K390-L393 PolarHBondContact O-N 3.17Å; K390-S394 PolarHBondContact O-N 3.45Å; K390-S394 VanDerWaalsContact O-N 3.08Å; K390-L409 HydrophobicContact CB-CD1 3.96Å; K390-L409 HydrophobicContact CB-CD2 4.15Å; K390-L409 HydrophobicContact CG-CD2 4.46Å
391	E	87.2	Confident	87.4	Confident	82 Å²	82	47.9 Å²	47.9	38%	0.383	25%	0.25	S	C	.	.	H	α-helix	trans	-69.9	-44.8	176.9	-162.2	68.2	176.6	0	0	111.5	L387 L388 L393 S394 H395	L387-E391 PolarHBondContact O-N 2.88Å; L387-E391 VanDerWaalsContact O-N 3.1Å; L388-E391 PolarHBondContact O-N 3.45Å; E391-L393 VanDerWaalsContact C-N 3.28Å; E391-L393 PolarHBondContact O-N 2.74Å; E391-S394 WeakPolarHBondContact O-CA 3.46Å; E391-S394 VanDerWaalsContact O-CB 3.25Å; E391-S394 WeakPolarHBondContact O-CB 3.42Å; E391-S394 PolarHBondContact O-N 2.83Å; E391-S394 PolarHBondContact O-OG 3.17Å; E391-H395 PolarHBondContact O-CD2 2.95Å; E391-H395 PolarHBondContact O-N 2.92Å; E391-H395 IonicContact OE1-NE2 3.15Å
392	L	89.9	Confident	87.2	Confident	2 Å²	2	51.2 Å²	51.2	1%	0.01	26%	0.263	C	S	.	.	H	α-helix	trans	-58.1	-39.8	173.4	179	66	0	0	0	112.3	R245 C248 L249 I252 L315 L388 S394 H395 S396 L405	R245-L392 HydrophobicContact CG-CD1 3.73Å; C248-L392 HydrophobicContact CB-CB 4.1Å; C248-L392 HydrophobicContact CB-CD1 3.93Å; L249-L392 HydrophobicContact CD2-CD1 3.86Å; L249-L392 HydrophobicContact CD2-CD2 3.82Å; L249-L392 HydrophobicContact CG-CD1 3.84Å; I252-L392 HydrophobicContact CD1-CD2 4.06Å; L315-L392 HydrophobicContact CD2-CD2 3.64Å; L388-L392 WeakPolarHBondContact O-CB 3.25Å; L388-L392 PolarHBondContact O-N 2.86Å; L388-L392 VanDerWaalsContact O-N 3.12Å; L392-S394 VanDerWaalsContact C-N 3.28Å; L392-S394 PolarHBondContact O-N 3.41Å; L392-H395 PolarHBondContact O-N 3.36Å; L392-S396 WeakPolarHBondContact O-CB 3.5Å; L392-S396 PolarHBondContact O-N 3.24Å; L392-S396 PolarHBondContact O-OG 3.44Å; L392-L405 HydrophobicContact CD2-CD1 4.46Å; L392-L405 HydrophobicContact CD2-CD2 3.89Å; L392-L405 HydrophobicContact CG-CD1 4.34Å
393	L	92.3	Very high	87.2	Confident	21 Å²	21	56 Å²	56	11%	0.11	29%	0.285	C	S	.	.	H	α-helix	trans	-66.2	-30.1	174.7	177.4	64.1	0	0	0	112	L389 K390 E391 S396 R402 L405 K406 L409	L389-L393 WeakPolarHBondContact O-CB 3.37Å; L389-L393 PolarHBondContact O-N 2.81Å; K390-L393 PolarHBondContact O-N 3.17Å; E391-L393 VanDerWaalsContact C-N 3.28Å; E391-L393 PolarHBondContact O-N 2.74Å; L393-S396 PolarHBondContact O-N 3.01Å; L393-R402 HydrophobicContact CD1-CG 3.91Å; L393-R402 PolarHBondContact O-NH1 2.83Å; L393-L405 HydrophobicContact CD1-CB 3.94Å; L393-K406 HydrophobicContact CD1-CG 3.92Å; L393-K406 HydrophobicContact CD2-CG 3.81Å; L393-L409 HydrophobicContact CD2-CD2 3.72Å
394	S	90.1	Very high	87.6	Confident	53 Å²	53	57.4 Å²	57.4	37%	0.371	29%	0.29	S	S	.	.	H	α-helix	trans	-63.2	-44.8	177.1	99.1	0	0	0	0	111	K390 E391 L392 S396	K390-S394 PolarHBondContact O-N 3.45Å; K390-S394 VanDerWaalsContact O-N 3.08Å; E391-S394 WeakPolarHBondContact O-CA 3.46Å; E391-S394 VanDerWaalsContact O-CB 3.25Å; E391-S394 WeakPolarHBondContact O-CB 3.42Å; E391-S394 PolarHBondContact O-N 2.83Å; E391-S394 PolarHBondContact O-OG 3.17Å; L392-S394 VanDerWaalsContact C-N 3.28Å; L392-S394 PolarHBondContact O-N 3.41Å; S394-S396 VanDerWaalsContact C-N 3.29Å; S394-S396 PolarHBondContact O-N 3.19Å
395	H	86.6	Confident	88	Confident	27 Å²	27	56.1 Å²	56.1	13%	0.125	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	11.7	179.2	-58.2	-54.6	0	0	0	114.7	E241 K244 R245 E391 L392	E241-H395 IonicContact OE2-CE1 3.31Å; E241-H395 IonicContact OE2-CG 2.66Å; E241-H395 IonicContact OE2-ND1 2.8Å; E241-H395 PolarHBondContact OE2-ND1 3.38Å; K244-H395 HydrophobicContact CB-CB 4.35Å; K244-H395 VanDerWaalsContact CD-CE1 3.48Å; K244-H395 WeakPolarHBondContact CD-CE1 3.3Å; R245-H395 HydrophobicContact CB-CB 3.98Å; E391-H395 PolarHBondContact O-CD2 2.95Å; E391-H395 PolarHBondContact O-N 2.92Å; E391-H395 IonicContact OE1-NE2 3.15Å; L392-H395 PolarHBondContact O-N 3.36Å
396	S	85.6	Confident	87.9	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.304	C	S	.	.			trans	-121.6	50	-177.6	-61	0	0	0	0	111.9	L392 L393 S394 R402	L392-S396 WeakPolarHBondContact O-CB 3.5Å; L392-S396 PolarHBondContact O-N 3.24Å; L392-S396 PolarHBondContact O-OG 3.44Å; L393-S396 PolarHBondContact O-N 3.01Å; S394-S396 VanDerWaalsContact C-N 3.29Å; S394-S396 PolarHBondContact O-N 3.19Å; S396-R402 VanDerWaalsContact C-NH1 3.27Å; S396-R402 WeakPolarHBondContact O-CD 3.33Å; S396-R402 WeakPolarHBondContact O-CG 3.43Å; S396-R402 PolarHBondContact O-NH1 3.08Å
397	T	78.4	Confident	88.1	Confident	75 Å²	75	62.8 Å²	62.8	46%	0.46	31%	0.314	S	S	.	.	S	Bend	trans	-67.8	-41.5	-171.7	45.4	0	0	0	0	115	R402	T397-R402 WeakPolarHBondContact O-CD 3.41Å; T397-R402 PolarHBondContact O-NE 2.72Å
398	D	77.1	Confident	88.5	Confident	152 Å²	152	58.4 Å²	58.4	81%	0.813	29%	0.291	S	S	*	.	S	Bend	trans	-118.6	18.9	-167.1	-57.4	-81.2	0	0	0	112.8
399	R	80.3	Confident	88.8	Confident	80 Å²	80	58 Å²	58	30%	0.302	29%	0.289	S	S	.	.			trans	-100	144.8	-176.5	-64.6	-172.4	177.1	-100.3	-9.1	112.4	D242 E401 R402	D242-R399 IonicContact OD1-CZ 2.63Å; D242-R399 IonicContact OD1-NE 3.69Å; D242-R399 IonicContact OD1-NH2 3.66Å; D242-R399 PolarHBondContact OD1-NH2 3.25Å; D242-R399 IonicContact OD2-NH2 2.66Å; D242-R399 PolarHBondContact OD2-NH2 2.69Å; R399-E401 HydrophobicContact CB-CG 3.86Å; R399-E401 PolarHBondContact O-N 2.68Å; R399-R402 WeakPolarHBondContact O-CB 3.43Å; R399-R402 PolarHBondContact O-N 2.8Å
400	P	81.6	Confident	88.7	Confident	126 Å²	126	59.9 Å²	59.9	82%	0.818	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-29.2	-178.2	26	-35.1	0	0	0	113.1	R402	P400-R402 PolarHBondContact O-N 3.3Å
401	E	84.3	Confident	88.8	Confident	19 Å²	19	54.5 Å²	54.5	9%	0.089	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-15.7	174.9	66.7	-145.4	-136.5	0	0	114.4	R245 S313 R399 Q403 Q404 L405	R245-E401 IonicContact CZ-OE1 3.3Å; R245-E401 VanDerWaalsContact CZ-OE1 3.27Å; R245-E401 IonicContact NE-OE1 3.41Å; R245-E401 PolarHBondContact NE-OE1 3.14Å; R245-E401 IonicContact NH2-OE1 2.7Å; R245-E401 PolarHBondContact NH2-OE1 3.4Å; R245-E401 IonicContact NH2-OE2 3.43Å; S313-E401 WeakPolarHBondContact CB-OE2 3.36Å; S313-E401 WeakPolarHBondContact O-CB 3.43Å; R399-E401 HydrophobicContact CB-CG 3.86Å; R399-E401 PolarHBondContact O-N 2.68Å; E401-Q403 PolarHBondContact O-N 2.72Å; E401-Q403 VanDerWaalsContact O-N 3.1Å; E401-Q404 PolarHBondContact O-N 2.9Å; E401-L405 HydrophobicContact CG-CD1 4.05Å; E401-L405 PolarHBondContact O-N 3.23Å
402	R	88.8	Confident	89.2	Confident	71 Å²	71	50.7 Å²	50.7	27%	0.268	27%	0.265	S	S	.	.	H	α-helix	trans	-53.9	-35.9	-174.1	-179.2	171.2	-168.2	65.6	-3.5	113.9	L393 S396 T397 R399 P400 K406	L393-R402 HydrophobicContact CD1-CG 3.91Å; L393-R402 PolarHBondContact O-NH1 2.83Å; S396-R402 VanDerWaalsContact C-NH1 3.27Å; S396-R402 WeakPolarHBondContact O-CD 3.33Å; S396-R402 WeakPolarHBondContact O-CG 3.43Å; S396-R402 PolarHBondContact O-NH1 3.08Å; T397-R402 WeakPolarHBondContact O-CD 3.41Å; T397-R402 PolarHBondContact O-NE 2.72Å; R399-R402 WeakPolarHBondContact O-CB 3.43Å; R399-R402 PolarHBondContact O-N 2.8Å; P400-R402 PolarHBondContact O-N 3.3Å; R402-K406 WeakPolarHBondContact O-CG 3.49Å; R402-K406 PolarHBondContact O-N 2.72Å; R402-K406 VanDerWaalsContact O-N 3.14Å
403	Q	91.3	Very high	89.2	Confident	100 Å²	100	54.3 Å²	54.3	47%	0.467	28%	0.282	S	S	.	.	H	α-helix	trans	-72.9	-40.6	179.2	-176.9	55.4	30.8	0	0	111.7	E401 L405 K406 E407	E401-Q403 PolarHBondContact O-N 2.72Å; E401-Q403 VanDerWaalsContact O-N 3.1Å; Q403-L405 VanDerWaalsContact C-N 3.33Å; Q403-L405 PolarHBondContact O-N 3.37Å; Q403-K406 WeakPolarHBondContact O-CB 3.34Å; Q403-K406 PolarHBondContact O-N 2.92Å; Q403-E407 WeakPolarHBondContact CG-OE1 3.36Å; Q403-E407 PolarHBondContact NE2-OE1 3.41Å; Q403-E407 WeakPolarHBondContact O-CG 3.45Å; Q403-E407 PolarHBondContact O-N 3.26Å; Q403-E407 VanDerWaalsContact O-N 3.08Å
404	Q	92.8	Very high	89.1	Confident	83 Å²	83	53.4 Å²	53.4	39%	0.388	28%	0.277	S	S	.	.	H	α-helix	trans	-66.5	-35.3	174.5	-64.8	-179	1.2	0	0	111.6	E401 E407 A408	E401-Q404 PolarHBondContact O-N 2.9Å; Q404-E407 PolarHBondContact O-N 3Å; Q404-A408 VanDerWaalsContact O-CB 3.26Å; Q404-A408 WeakPolarHBondContact O-CB 3.43Å; Q404-A408 PolarHBondContact O-N 3.37Å
405	L	94.1	Very high	89.2	Confident	5 Å²	5	50.9 Å²	50.9	3%	0.026	26%	0.26	C	S	.	.	H	α-helix	trans	-65.2	-35.9	173.3	-71.6	175.8	0	0	0	112.7	L389 L392 L393 E401 Q403 L409	L389-L405 HydrophobicContact CD2-CD2 4.36Å; L392-L405 HydrophobicContact CD2-CD1 4.46Å; L392-L405 HydrophobicContact CD2-CD2 3.89Å; L392-L405 HydrophobicContact CG-CD1 4.34Å; L393-L405 HydrophobicContact CD1-CB 3.94Å; E401-L405 HydrophobicContact CG-CD1 4.05Å; E401-L405 PolarHBondContact O-N 3.23Å; Q403-L405 VanDerWaalsContact C-N 3.33Å; Q403-L405 PolarHBondContact O-N 3.37Å; L405-L409 VanDerWaalsContact O-CB 3.32Å; L405-L409 WeakPolarHBondContact O-CB 3.3Å; L405-L409 PolarHBondContact O-N 2.74Å
406	K	94.3	Very high	89.2	Confident	96 Å²	96	50 Å²	50	42%	0.417	26%	0.257	S	S	.	.	H	α-helix	trans	-65.6	-43.4	171.9	-73.8	174.7	179.4	-178.9	0	112.5	L393 R402 Q403 L409 A410	L393-K406 HydrophobicContact CD1-CG 3.92Å; L393-K406 HydrophobicContact CD2-CG 3.81Å; R402-K406 WeakPolarHBondContact O-CG 3.49Å; R402-K406 PolarHBondContact O-N 2.72Å; R402-K406 VanDerWaalsContact O-N 3.14Å; Q403-K406 WeakPolarHBondContact O-CB 3.34Å; Q403-K406 PolarHBondContact O-N 2.92Å; K406-L409 PolarHBondContact O-N 3.06Å; K406-A410 PolarHBondContact O-N 3.4Å
407	E	93.8	Very high	89.2	Confident	88 Å²	88	54.2 Å²	54.2	41%	0.411	28%	0.277	S	S	.	.	H	α-helix	trans	-65.9	-40.2	178.6	-72.3	162.8	-162.4	0	0	110.9	L320 Q403 Q404 A411	L320-E407 HydrophobicContact CD1-CB 4.05Å; L320-E407 HydrophobicContact CD2-CB 4.26Å; Q403-E407 WeakPolarHBondContact CG-OE1 3.36Å; Q403-E407 PolarHBondContact NE2-OE1 3.41Å; Q403-E407 WeakPolarHBondContact O-CG 3.45Å; Q403-E407 PolarHBondContact O-N 3.26Å; Q403-E407 VanDerWaalsContact O-N 3.08Å; Q404-E407 PolarHBondContact O-N 3Å; E407-A411 VanDerWaalsContact O-CB 3.29Å; E407-A411 WeakPolarHBondContact O-CB 3.46Å; E407-A411 PolarHBondContact O-N 3.33Å
408	A	95.6	Very high	89.8	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-64.1	-42.6	172.8	0	0	0	0	0	113	G316 F319 L320 L389 Q404 A411 M412	G316-A408 WeakPolarHBondContact O-CB 3.15Å; F319-A408 HydrophobicContact CB-CB 4.11Å; L320-A408 HydrophobicContact CG-CB 4.36Å; L389-A408 HydrophobicContact CD1-CB 4.11Å; Q404-A408 VanDerWaalsContact O-CB 3.26Å; Q404-A408 WeakPolarHBondContact O-CB 3.43Å; Q404-A408 PolarHBondContact O-N 3.37Å; A408-A411 WeakPolarHBondContact O-CB 3.2Å; A408-A411 PolarHBondContact O-N 3.01Å; A408-M412 WeakPolarHBondContact O-CG 3.48Å; A408-M412 PolarHBondContact O-N 3.37Å
409	L	95.4	Very high	90.2	Very high	17 Å²	17	44.2 Å²	44.2	9%	0.089	22%	0.22	C	C	.	.	H	α-helix	trans	-58.7	-54.1	174.6	173.8	58.4	0	0	0	110.6	H386 L389 K390 L393 L405 K406 A411 M412 E413	H386-L409 HydrophobicContact CB-CD1 4.02Å; H386-L409 WeakPolarHBondContact O-CD1 3.26Å; L389-L409 HydrophobicContact CB-CB 4.47Å; L389-L409 HydrophobicContact CB-CD1 4.37Å; K390-L409 HydrophobicContact CB-CD1 3.96Å; K390-L409 HydrophobicContact CB-CD2 4.15Å; K390-L409 HydrophobicContact CG-CD2 4.46Å; L393-L409 HydrophobicContact CD2-CD2 3.72Å; L405-L409 VanDerWaalsContact O-CB 3.32Å; L405-L409 WeakPolarHBondContact O-CB 3.3Å; L405-L409 PolarHBondContact O-N 2.74Å; K406-L409 PolarHBondContact O-N 3.06Å; L409-A411 PolarHBondContact O-N 3.17Å; L409-M412 PolarHBondContact O-N 3.02Å; L409-E413 HydrophobicContact CD1-CG 4.03Å; L409-E413 HydrophobicContact CG-CG 4.44Å; L409-E413 WeakPolarHBondContact O-CG 3.46Å; L409-E413 PolarHBondContact O-N 3.38Å
410	A	93.1	Very high	90.4	Very high	41 Å²	41	44.5 Å²	44.5	34%	0.339	23%	0.228	S	C	.	.	H	α-helix	trans	-61	-29.7	177.7	0	0	0	0	0	112.8	K406 D414	K406-A410 PolarHBondContact O-N 3.4Å; A410-D414 VanDerWaalsContact O-CB 3.32Å; A410-D414 WeakPolarHBondContact O-CB 3.28Å; A410-D414 PolarHBondContact O-N 2.61Å
411	A	92.4	Very high	90.7	Very high	7 Å²	7	40.5 Å²	40.5	6%	0.058	20%	0.198	C	C	.	.	H	α-helix	trans	-69.7	-38.5	173.2	0	0	0	0	0	113.2	L320 K323 E407 A408 L409 L415	L320-A411 HydrophobicContact CD2-CB 3.82Å; K323-A411 HydrophobicContact CD-CB 3.85Å; K323-A411 VanDerWaalsContact CE-O 3.3Å; K323-A411 WeakPolarHBondContact CE-O 3.34Å; K323-A411 HydrophobicContact CG-CB 4.19Å; E407-A411 VanDerWaalsContact O-CB 3.29Å; E407-A411 WeakPolarHBondContact O-CB 3.46Å; E407-A411 PolarHBondContact O-N 3.33Å; A408-A411 WeakPolarHBondContact O-CB 3.2Å; A408-A411 PolarHBondContact O-N 3.01Å; L409-A411 PolarHBondContact O-N 3.17Å; A411-L415 PolarHBondContact O-N 3.34Å; A411-L415 VanDerWaalsContact O-N 3.14Å
412	M	95.2	Very high	90.9	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-78.1	-32.1	176	-64.9	-58.6	99.1	0	0	112.3	F319 K323 L326 H386 L389 A408 L409 L415 A416	F319-M412 HydrophobicContact CB-CE 4.39Å; F319-M412 HydrophobicContact CD1-CE 4.46Å; F319-M412 HydrophobicContact CD1-CG 4.2Å; F319-M412 HydrophobicContact CD1-SD 3.78Å; F319-M412 HydrophobicContact CE1-SD 4.5Å; F319-M412 WeakPolarHBondContact O-CE 3.49Å; K323-M412 HydrophobicContact CB-CE 4.07Å; K323-M412 HydrophobicContact CG-CE 4.03Å; L326-M412 HydrophobicContact CD1-CE 4.12Å; L326-M412 HydrophobicContact CD1-SD 3.98Å; H386-M412 HydrophobicContact CB-CB 3.87Å; L389-M412 HydrophobicContact CD1-CB 4.29Å; L389-M412 HydrophobicContact CD1-CG 3.59Å; A408-M412 WeakPolarHBondContact O-CG 3.48Å; A408-M412 PolarHBondContact O-N 3.37Å; L409-M412 PolarHBondContact O-N 3.02Å; M412-L415 HydrophobicContact CE-CD2 4.15Å; M412-L415 WeakPolarHBondContact O-CB 3.08Å; M412-L415 PolarHBondContact O-N 3.24Å; M412-L415 HydrophobicContact SD-CD2 3.86Å; M412-A416 PolarHBondContact O-N 3.08Å
413	E	91.1	Very high	90.4	Very high	79 Å²	79	39.6 Å²	39.6	37%	0.369	20%	0.196	S	C	.	.	H	α-helix	trans	-63.2	-43.5	169.5	-69	175.5	152.7	0	0	110.8	H386 L409 L415 A416 M417	H386-E413 HydrophobicContact CB-CG 3.83Å; L409-E413 HydrophobicContact CD1-CG 4.03Å; L409-E413 HydrophobicContact CG-CG 4.44Å; L409-E413 WeakPolarHBondContact O-CG 3.46Å; L409-E413 PolarHBondContact O-N 3.38Å; E413-L415 VanDerWaalsContact C-N 3.3Å; E413-L415 PolarHBondContact O-N 3.01Å; E413-A416 PolarHBondContact O-N 3.35Å; E413-M417 WeakPolarHBondContact O-CG 3.12Å; E413-M417 PolarHBondContact O-N 3.23Å
414	D	89.9	Confident	90.1	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.011	20%	0.195	C	C	.	.	H	α-helix	trans	-65.1	-31.1	174.7	-168.4	46.4	0	0	0	113.2	K323 A410 Y418 M588 L589 R591	K323-D414 IonicContact NZ-OD2 2.74Å; K323-D414 PolarHBondContact NZ-OD2 3.4Å; A410-D414 VanDerWaalsContact O-CB 3.32Å; A410-D414 WeakPolarHBondContact O-CB 3.28Å; A410-D414 PolarHBondContact O-N 2.61Å; D414-Y418 WeakPolarHBondContact O-CB 3.12Å; D414-Y418 PolarHBondContact O-N 3.45Å; D414-M588 HydrophobicContact CB-CE 3.67Å; D414-L589 PolarHBondContact OD2-N 3.43Å; D414-R591 IonicContact OD1-CZ 3.67Å; D414-R591 IonicContact OD1-NE 3.23Å; D414-R591 PolarHBondContact OD1-NE 2.97Å; D414-R591 IonicContact OD1-NH2 2.65Å; D414-R591 PolarHBondContact OD1-NH2 3.08Å
415	L	91.3	Very high	90	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-68.6	-45.7	173.1	174.2	64.8	0	0	0	111.6	L326 L327 V382 A411 M412 E413 Y418 I419	L326-L415 HydrophobicContact CB-CD1 4.17Å; L326-L415 HydrophobicContact CB-CD2 3.65Å; L326-L415 HydrophobicContact CD1-CD2 3.81Å; L326-L415 HydrophobicContact CG-CD2 4.35Å; L327-L415 HydrophobicContact CD2-CD1 3.8Å; V382-L415 HydrophobicContact CG2-CD2 3.63Å; V382-L415 HydrophobicContact CG2-CG 4Å; A411-L415 PolarHBondContact O-N 3.34Å; A411-L415 VanDerWaalsContact O-N 3.14Å; M412-L415 HydrophobicContact CE-CD2 4.15Å; M412-L415 WeakPolarHBondContact O-CB 3.08Å; M412-L415 PolarHBondContact O-N 3.24Å; M412-L415 HydrophobicContact SD-CD2 3.86Å; E413-L415 VanDerWaalsContact C-N 3.3Å; E413-L415 PolarHBondContact O-N 3.01Å; L415-Y418 HydrophobicContact CD1-CD1 4.41Å; L415-Y418 WeakPolarHBondContact O-CB 3.46Å; L415-Y418 PolarHBondContact O-N 2.9Å; L415-I419 HydrophobicContact CD1-CD1 4.18Å; L415-I419 HydrophobicContact CG-CD1 4.21Å; L415-I419 WeakPolarHBondContact O-CG1 3.5Å; L415-I419 PolarHBondContact O-N 3.42Å
416	A	86.5	Confident	89.6	Confident	7 Å²	7	38.2 Å²	38.2	6%	0.058	19%	0.186	C	C	.	.	H	α-helix	trans	-62.4	-43.7	174.8	0	0	0	0	0	111.5	L383 M412 E413 Y418 I419 N420	L383-A416 HydrophobicContact CD2-CB 3.7Å; M412-A416 PolarHBondContact O-N 3.08Å; E413-A416 PolarHBondContact O-N 3.35Å; A416-Y418 VanDerWaalsContact C-N 3.34Å; A416-Y418 PolarHBondContact O-N 2.91Å; A416-I419 PolarHBondContact O-N 3.18Å; A416-N420 PolarHBondContact O-N 2.93Å; A416-N420 VanDerWaalsContact O-N 3.14Å; A416-N420 PolarHBondContact O-ND2 3.46Å
417	M	86.9	Confident	89.1	Confident	89 Å²	89	38.5 Å²	38.5	44%	0.438	19%	0.188	S	C	.	.	H	α-helix	trans	-59.4	-43.3	172.1	-69.5	-169.4	81.6	0	0	111.8	E413 N420 E421	E413-M417 WeakPolarHBondContact O-CG 3.12Å; E413-M417 PolarHBondContact O-N 3.23Å; M417-N420 PolarHBondContact O-N 3.24Å; M417-E421 WeakPolarHBondContact O-CG 3.37Å; M417-E421 PolarHBondContact O-N 2.99Å
418	Y	89.8	Confident	88.8	Confident	13 Å²	13	35.5 Å²	35.5	5%	0.051	18%	0.176	C	C	.	.	H	α-helix	trans	-58.3	-48.7	177.3	164.2	-106.3	0	0	0	112.1	L327 D414 L415 A416 N420 E421 V422 N580 L589	L327-Y418 HydrophobicContact CB-CE1 4.12Å; L327-Y418 HydrophobicContact CD2-CD1 3.59Å; L327-Y418 HydrophobicContact CD2-CE1 3.75Å; L327-Y418 HydrophobicContact CD2-CG 4.14Å; L327-Y418 WeakPolarHBondContact O-CE1 3.5Å; D414-Y418 WeakPolarHBondContact O-CB 3.12Å; D414-Y418 PolarHBondContact O-N 3.45Å; L415-Y418 HydrophobicContact CD1-CD1 4.41Å; L415-Y418 WeakPolarHBondContact O-CB 3.46Å; L415-Y418 PolarHBondContact O-N 2.9Å; A416-Y418 VanDerWaalsContact C-N 3.34Å; A416-Y418 PolarHBondContact O-N 2.91Å; Y418-N420 VanDerWaalsContact C-N 3.3Å; Y418-N420 PolarHBondContact O-N 3.3Å; Y418-E421 PolarHBondContact O-N 3.36Å; Y418-V422 HydrophobicContact CD1-CG2 4.47Å; Y418-V422 HydrophobicContact CD2-CG2 3.86Å; Y418-V422 HydrophobicContact CE1-CG2 4.09Å; Y418-V422 HydrophobicContact CE2-CG2 3.42Å; Y418-V422 VanDerWaalsContact CE2-CG2 3.42Å; Y418-V422 HydrophobicContact CG-CG2 4.38Å; Y418-V422 WeakPolarHBondContact O-CG2 3.33Å; Y418-V422 PolarHBondContact O-N 2.96Å; Y418-N580 PolarHBondContact OH-OD1 3.17Å; Y418-L589 HydrophobicContact CD1-CD2 4.3Å; Y418-L589 HydrophobicContact CD2-CD2 3.37Å; Y418-L589 HydrophobicContact CD2-CG 4.36Å; Y418-L589 HydrophobicContact CE2-CD2 3.85Å; Y418-L589 HydrophobicContact CG-CD2 3.62Å
419	I	86.6	Confident	88.5	Confident	5 Å²	5	37.7 Å²	37.7	3%	0.026	19%	0.188	C	C	.	.	H	α-helix	trans	-59.8	-41.7	179.9	-67.6	162.7	0	0	0	111	C333 V382 L415 A416 V422 K423	C333-I419 HydrophobicContact CB-CG2 3.83Å; V382-I419 HydrophobicContact CB-CD1 4.23Å; V382-I419 HydrophobicContact CG1-CD1 3.58Å; V382-I419 HydrophobicContact CG2-CD1 3.58Å; L415-I419 HydrophobicContact CD1-CD1 4.18Å; L415-I419 HydrophobicContact CG-CD1 4.21Å; L415-I419 WeakPolarHBondContact O-CG1 3.5Å; L415-I419 PolarHBondContact O-N 3.42Å; A416-I419 PolarHBondContact O-N 3.18Å; I419-V422 PolarHBondContact O-N 3.3Å; I419-K423 PolarHBondContact O-N 3Å
420	N	84.2	Confident	88.1	Confident	86 Å²	86	41.7 Å²	41.7	46%	0.46	20%	0.204	S	C	.	.	H	α-helix	trans	-64.5	-39.2	176.8	-69.1	-15.9	0	0	0	113	A416 M417 Y418 R424	A416-N420 PolarHBondContact O-N 2.93Å; A416-N420 VanDerWaalsContact O-N 3.14Å; A416-N420 PolarHBondContact O-ND2 3.46Å; M417-N420 PolarHBondContact O-N 3.24Å; Y418-N420 VanDerWaalsContact C-N 3.3Å; Y418-N420 PolarHBondContact O-N 3.3Å; N420-R424 PolarHBondContact O-N 3.41Å; N420-R424 VanDerWaalsContact O-N 3.1Å
421	E	88.3	Confident	87.7	Confident	42 Å²	42	41.5 Å²	41.5	20%	0.196	20%	0.196	C	C	.	.	H	α-helix	trans	-68.2	-36.9	173	-63.8	-57.2	134.9	0	0	111.9	M417 Y418 R424 D425 R591	M417-E421 WeakPolarHBondContact O-CG 3.37Å; M417-E421 PolarHBondContact O-N 2.99Å; Y418-E421 PolarHBondContact O-N 3.36Å; E421-R424 PolarHBondContact O-N 3.06Å; E421-R424 IonicContact OE1-CZ 3.17Å; E421-R424 IonicContact OE1-NH1 3.58Å; E421-R424 PolarHBondContact OE1-NH1 3.3Å; E421-R424 IonicContact OE1-NH2 3.85Å; E421-R424 PolarHBondContact OE1-NH2 3.39Å; E421-R424 IonicContact OE2-CZ 2.68Å; E421-R424 IonicContact OE2-NH1 2.87Å; E421-R424 PolarHBondContact OE2-NH1 2.6Å; E421-R424 IonicContact OE2-NH2 3.14Å; E421-D425 WeakPolarHBondContact O-CB 3.41Å; E421-D425 PolarHBondContact O-N 3.01Å; E421-R591 HydrophobicContact CB-CB 3.85Å; E421-R591 HydrophobicContact CG-CB 3.67Å
422	V	87.3	Confident	87.7	Confident	1 Å²	1	41.2 Å²	41.2	1%	0.006	19%	0.193	C	C	.	.	H	α-helix	trans	-65.1	-43	176	175.4	0	0	0	0	111.2	G330 Y418 I419 D425 N426 I593	G330-V422 VanDerWaalsContact O-CG1 3.28Å; G330-V422 WeakPolarHBondContact O-CG1 3.45Å; Y418-V422 HydrophobicContact CD1-CG2 4.47Å; Y418-V422 HydrophobicContact CD2-CG2 3.86Å; Y418-V422 HydrophobicContact CE1-CG2 4.09Å; Y418-V422 HydrophobicContact CE2-CG2 3.42Å; Y418-V422 VanDerWaalsContact CE2-CG2 3.42Å; Y418-V422 HydrophobicContact CG-CG2 4.38Å; Y418-V422 WeakPolarHBondContact O-CG2 3.33Å; Y418-V422 PolarHBondContact O-N 2.96Å; I419-V422 PolarHBondContact O-N 3.3Å; V422-D425 PolarHBondContact O-N 3.43Å; V422-N426 PolarHBondContact O-N 3.31Å; V422-N426 VanDerWaalsContact O-N 3.11Å; V422-N426 PolarHBondContact O-ND2 3.11Å; V422-I593 HydrophobicContact CG1-CG2 3.98Å; V422-I593 HydrophobicContact CG2-CG2 4.11Å
423	K	79.6	Confident	87.5	Confident	70 Å²	70	44.4 Å²	44.4	30%	0.304	22%	0.216	S	C	.	.	H	α-helix	trans	-60.7	-48.6	173.3	175	159.1	170.8	159.1	0	111.3	E337 I419 D425 N426 E427	E337-K423 WeakPolarHBondContact OE1-CE 3.35Å; E337-K423 IonicContact OE1-NZ 3.37Å; E337-K423 PolarHBondContact OE1-NZ 3.08Å; I419-K423 PolarHBondContact O-N 3Å; K423-D425 VanDerWaalsContact C-N 3.3Å; K423-D425 PolarHBondContact O-N 2.86Å; K423-N426 PolarHBondContact O-N 3.47Å; K423-E427 WeakPolarHBondContact CE-OE1 3.42Å; K423-E427 HydrophobicContact CG-CG 4.44Å; K423-E427 WeakPolarHBondContact CG-OE1 3.46Å; K423-E427 WeakPolarHBondContact O-CG 3.22Å; K423-E427 PolarHBondContact O-N 3.37Å
424	R	84.5	Confident	87.4	Confident	119 Å²	119	42.3 Å²	42.3	45%	0.449	21%	0.206	S	C	.	.	H	α-helix	trans	-60.6	-36.6	178.9	-161.9	-170.7	-53.1	132.7	16.4	113.1	N420 E421 T428	N420-R424 PolarHBondContact O-N 3.41Å; N420-R424 VanDerWaalsContact O-N 3.1Å; E421-R424 PolarHBondContact O-N 3.06Å; E421-R424 IonicContact OE1-CZ 3.17Å; E421-R424 IonicContact OE1-NH1 3.58Å; E421-R424 PolarHBondContact OE1-NH1 3.3Å; E421-R424 IonicContact OE1-NH2 3.85Å; E421-R424 PolarHBondContact OE1-NH2 3.39Å; E421-R424 IonicContact OE2-CZ 2.68Å; E421-R424 IonicContact OE2-NH1 2.87Å; E421-R424 PolarHBondContact OE2-NH1 2.6Å; E421-R424 IonicContact OE2-NH2 3.14Å; R424-T428 WeakPolarHBondContact O-CB 3.42Å; R424-T428 PolarHBondContact O-N 2.9Å; R424-T428 PolarHBondContact O-OG1 3.49Å
425	D	89.8	Confident	87.5	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.005	21%	0.206	C	C	.	.	H	α-helix	trans	-68.3	-35.4	175.1	-84	-10.6	0	0	0	112.3	E421 V422 K423 T428 L429 R451 G592 I593 F594	E421-D425 WeakPolarHBondContact O-CB 3.41Å; E421-D425 PolarHBondContact O-N 3.01Å; V422-D425 PolarHBondContact O-N 3.43Å; K423-D425 VanDerWaalsContact C-N 3.3Å; K423-D425 PolarHBondContact O-N 2.86Å; D425-T428 WeakPolarHBondContact O-CB 3.23Å; D425-T428 PolarHBondContact O-N 3.45Å; D425-L429 WeakPolarHBondContact O-CB 3.41Å; D425-L429 VanDerWaalsContact O-CG 3.27Å; D425-L429 WeakPolarHBondContact O-CG 3.49Å; D425-L429 PolarHBondContact O-N 2.93Å; D425-R451 IonicContact OD1-CZ 3.29Å; D425-R451 VanDerWaalsContact OD1-CZ 3.29Å; D425-R451 IonicContact OD1-NE 3.14Å; D425-R451 PolarHBondContact OD1-NE 2.89Å; D425-R451 VanDerWaalsContact OD1-NE 3.14Å; D425-R451 IonicContact OD1-NH2 3.66Å; D425-R451 PolarHBondContact OD1-NH2 3.39Å; D425-R451 IonicContact OD2-NH2 2.88Å; D425-R451 PolarHBondContact OD2-NH2 3.38Å; D425-G592 VanDerWaalsContact OD2-CA 3.28Å; D425-G592 WeakPolarHBondContact OD2-CA 3.41Å; D425-I593 HydrophobicContact CB-CG1 3.71Å; D425-I593 PolarHBondContact OD2-N 3.25Å; D425-F594 HydrophobicContact CB-CB 4.08Å; D425-F594 PolarHBondContact OD2-N 3.38Å
426	N	85.9	Confident	87.6	Confident	39 Å²	39	45.1 Å²	45.1	21%	0.209	22%	0.219	C	C	.	.	H	α-helix	trans	-69.9	-41.3	174.3	-79.2	-88.4	0	0	0	112.2	S334 V422 K423 T428 L429 K430 I593	S334-N426 WeakPolarHBondContact CB-ND2 3.4Å; V422-N426 PolarHBondContact O-N 3.31Å; V422-N426 VanDerWaalsContact O-N 3.11Å; V422-N426 PolarHBondContact O-ND2 3.11Å; K423-N426 PolarHBondContact O-N 3.47Å; N426-T428 VanDerWaalsContact C-N 3.26Å; N426-T428 PolarHBondContact O-N 2.72Å; N426-L429 PolarHBondContact O-N 2.87Å; N426-K430 WeakPolarHBondContact O-CB 3.35Å; N426-K430 PolarHBondContact O-N 3.05Å; N426-I593 WeakPolarHBondContact ND2-CD1 3.34Å
427	E	82.8	Confident	87.8	Confident	101 Å²	101	49.9 Å²	49.9	47%	0.472	25%	0.252	S	S	.	.	H	α-helix	trans	-57.8	-41.4	169.8	-68.2	167.7	176.2	0	0	111.2	K423 K430 K431	K423-E427 WeakPolarHBondContact CE-OE1 3.42Å; K423-E427 HydrophobicContact CG-CG 4.44Å; K423-E427 WeakPolarHBondContact CG-OE1 3.46Å; K423-E427 WeakPolarHBondContact O-CG 3.22Å; K423-E427 PolarHBondContact O-N 3.37Å; E427-K430 PolarHBondContact O-N 3.43Å; E427-K431 PolarHBondContact O-N 3.16Å
428	T	87.9	Confident	88	Confident	25 Å²	25	46.4 Å²	46.4	15%	0.153	24%	0.236	C	C	.	.	H	α-helix	trans	-65.2	-46.8	176.2	-58.7	0	0	0	0	111.6	R424 D425 N426 K430 K431 I432 R451 P452 F594	R424-T428 WeakPolarHBondContact O-CB 3.42Å; R424-T428 PolarHBondContact O-N 2.9Å; R424-T428 PolarHBondContact O-OG1 3.49Å; D425-T428 WeakPolarHBondContact O-CB 3.23Å; D425-T428 PolarHBondContact O-N 3.45Å; N426-T428 VanDerWaalsContact C-N 3.26Å; N426-T428 PolarHBondContact O-N 2.72Å; T428-K430 VanDerWaalsContact C-N 3.34Å; T428-K430 PolarHBondContact O-N 3.47Å; T428-K431 WeakPolarHBondContact O-CB 3.36Å; T428-K431 PolarHBondContact O-N 3.39Å; T428-I432 HydrophobicContact CG2-CD1 3.96Å; T428-I432 HydrophobicContact CG2-CG1 4.47Å; T428-I432 WeakPolarHBondContact O-CB 3.39Å; T428-I432 VanDerWaalsContact O-CG1 3.23Å; T428-I432 WeakPolarHBondContact O-CG1 3.18Å; T428-I432 PolarHBondContact O-N 3.32Å; T428-R451 HydrophobicContact CG2-CB 4.34Å; T428-R451 HydrophobicContact CG2-CG 4.1Å; T428-P452 HydrophobicContact CG2-CG 4.49Å; T428-F594 HydrophobicContact CG2-CE1 4.49Å
429	L	90.1	Very high	88.1	Confident	46 Å²	46	46.2 Å²	46.2	24%	0.241	24%	0.236	C	C	.	.	H	α-helix	trans	-63.2	-38.3	177	-73.5	168.9	0	0	0	111.9	D425 N426 I432 S433 E447 I593 F594	D425-L429 WeakPolarHBondContact O-CB 3.41Å; D425-L429 VanDerWaalsContact O-CG 3.27Å; D425-L429 WeakPolarHBondContact O-CG 3.49Å; D425-L429 PolarHBondContact O-N 2.93Å; N426-L429 PolarHBondContact O-N 2.87Å; L429-I432 PolarHBondContact O-N 3.42Å; L429-S433 PolarHBondContact O-N 3.09Å; L429-E447 HydrophobicContact CD2-CG 4.06Å; L429-I593 HydrophobicContact CD1-CD1 3.87Å; L429-I593 HydrophobicContact CD1-CG1 4.43Å; L429-F594 HydrophobicContact CD1-CB 4.46Å; L429-F594 HydrophobicContact CD2-CD1 4.4Å; L429-F594 HydrophobicContact CD2-CD2 3.79Å; L429-F594 HydrophobicContact CD2-CE1 4.48Å; L429-F594 HydrophobicContact CD2-CE2 3.88Å; L429-F594 HydrophobicContact CD2-CG 4.06Å; L429-F594 HydrophobicContact CD2-CZ 4.24Å; L429-F594 HydrophobicContact CG-CG 4.39Å
430	K	85.9	Confident	88.3	Confident	102 Å²	102	49.1 Å²	49.1	44%	0.443	25%	0.249	S	C	.	.	H	α-helix	trans	-60.6	-48	171.3	-177.6	-172.8	172.9	-166	0	111.3	N426 E427 T428 I432 S433 E434	N426-K430 WeakPolarHBondContact O-CB 3.35Å; N426-K430 PolarHBondContact O-N 3.05Å; E427-K430 PolarHBondContact O-N 3.43Å; T428-K430 VanDerWaalsContact C-N 3.34Å; T428-K430 PolarHBondContact O-N 3.47Å; K430-I432 VanDerWaalsContact C-N 3.31Å; K430-I432 PolarHBondContact O-N 3.32Å; K430-S433 WeakPolarHBondContact O-CB 3.4Å; K430-S433 PolarHBondContact O-N 3.13Å; K430-S433 VanDerWaalsContact O-N 3.14Å; K430-E434 PolarHBondContact O-N 3.24Å
431	K	85.9	Confident	88.4	Confident	37 Å²	37	50.5 Å²	50.5	16%	0.161	26%	0.257	C	S	.	.	H	α-helix	trans	-59.6	-40.4	175.2	-175.5	176	-175.9	170.5	0	112.2	S112 L115 E427 T428 E434 F435	S112-K431 VanDerWaalsContact CB-NZ 3.26Å; S112-K431 WeakPolarHBondContact OG-CE 3.45Å; S112-K431 PolarHBondContact OG-NZ 3.48Å; L115-K431 HydrophobicContact CD1-CD 3.97Å; E427-K431 PolarHBondContact O-N 3.16Å; T428-K431 WeakPolarHBondContact O-CB 3.36Å; T428-K431 PolarHBondContact O-N 3.39Å; K431-E434 PolarHBondContact O-N 2.86Å; K431-F435 HydrophobicContact CD-CZ 4.32Å; K431-F435 HydrophobicContact CG-CD1 4.47Å; K431-F435 HydrophobicContact CG-CE1 4.1Å; K431-F435 HydrophobicContact CG-CE2 4.47Å; K431-F435 HydrophobicContact CG-CZ 4.13Å; K431-F435 WeakPolarHBondContact O-CG 3.33Å; K431-F435 PolarHBondContact O-N 3.32Å
432	I	92.6	Very high	88.4	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-62.8	-41.3	174.9	-70.9	172.2	0	0	0	111	T428 L429 K430 F435 Q436 L446 E447 P452 F476 F594	T428-I432 HydrophobicContact CG2-CD1 3.96Å; T428-I432 HydrophobicContact CG2-CG1 4.47Å; T428-I432 WeakPolarHBondContact O-CB 3.39Å; T428-I432 VanDerWaalsContact O-CG1 3.23Å; T428-I432 WeakPolarHBondContact O-CG1 3.18Å; T428-I432 PolarHBondContact O-N 3.32Å; L429-I432 PolarHBondContact O-N 3.42Å; K430-I432 VanDerWaalsContact C-N 3.31Å; K430-I432 PolarHBondContact O-N 3.32Å; I432-F435 PolarHBondContact O-N 2.78Å; I432-Q436 WeakPolarHBondContact O-CB 3.27Å; I432-Q436 PolarHBondContact O-N 3.01Å; I432-L446 HydrophobicContact CG2-CB 3.51Å; I432-E447 HydrophobicContact CG2-CG 4.22Å; I432-P452 HydrophobicContact CG1-CG 4.31Å; I432-F476 HydrophobicContact CD1-CE1 4.42Å; I432-F476 HydrophobicContact CG1-CE1 4.09Å; I432-F594 HydrophobicContact CD1-CE1 3.66Å; I432-F594 HydrophobicContact CD1-CZ 3.78Å
433	S	90.7	Very high	88.2	Confident	68 Å²	68	59.1 Å²	59.1	48%	0.476	30%	0.298	S	S	.	.	H	α-helix	trans	-65.9	-41.5	175.2	-169.6	0	0	0	0	112.5	L429 K430 Q436 S437	L429-S433 PolarHBondContact O-N 3.09Å; K430-S433 WeakPolarHBondContact O-CB 3.4Å; K430-S433 PolarHBondContact O-N 3.13Å; K430-S433 VanDerWaalsContact O-N 3.14Å; S433-Q436 PolarHBondContact O-N 2.88Å; S433-S437 PolarHBondContact O-N 3.2Å
434	E	88.6	Confident	88.6	Confident	36 Å²	36	58.4 Å²	58.4	17%	0.168	30%	0.299	C	S	.	.	H	α-helix	trans	-63	-40.6	173.1	-69.6	-168.6	-163.4	0	0	112.3	F114 K118 K430 K431 S437 S438	F114-E434 HydrophobicContact CE1-CB 4.17Å; F114-E434 HydrophobicContact CZ-CB 4.38Å; K118-E434 IonicContact NZ-OE1 2.9Å; K118-E434 PolarHBondContact NZ-OE1 2.93Å; K118-E434 IonicContact NZ-OE2 2.74Å; K118-E434 PolarHBondContact NZ-OE2 2.87Å; K430-E434 PolarHBondContact O-N 3.24Å; K431-E434 PolarHBondContact O-N 2.86Å; E434-S437 PolarHBondContact O-OG 3.34Å; E434-S438 PolarHBondContact O-N 3.34Å
435	F	92.2	Very high	88.9	Confident	2 Å²	2	57.6 Å²	57.6	1%	0.009	30%	0.299	C	S	.	.	H	α-helix	trans	-61.6	-47.2	171.8	-73.9	-0.3	0	0	0	111.1	F114 K431 I432 S437 S438 I439 L446 P452 D455 F474 F476	F114-F435 HydrophobicContact CB-CE1 3.76Å; F114-F435 HydrophobicContact CB-CZ 4.48Å; F114-F435 AromaticContact CD1-CD1 3.93Å; F114-F435 HydrophobicContact CD1-CD1 3.93Å; F114-F435 AromaticContact CD1-CE1 3.63Å; F114-F435 HydrophobicContact CD1-CE1 3.63Å; F114-F435 HydrophobicContact CD2-CD1 4.17Å; F114-F435 HydrophobicContact CD2-CE1 4.18Å; F114-F435 HydrophobicContact CE1-CD1 4.09Å; F114-F435 HydrophobicContact CE1-CE1 4.24Å; F114-F435 HydrophobicContact CE2-CD1 4.32Å; F114-F435 AromaticContact CG-CD1 3.98Å; F114-F435 HydrophobicContact CG-CD1 3.98Å; F114-F435 AromaticContact CG-CE1 3.6Å; F114-F435 HydrophobicContact CG-CE1 3.6Å; F114-F435 HydrophobicContact CZ-CD1 4.28Å; K431-F435 HydrophobicContact CD-CZ 4.32Å; K431-F435 HydrophobicContact CG-CD1 4.47Å; K431-F435 HydrophobicContact CG-CE1 4.1Å; K431-F435 HydrophobicContact CG-CE2 4.47Å; K431-F435 HydrophobicContact CG-CZ 4.13Å; K431-F435 WeakPolarHBondContact O-CG 3.33Å; K431-F435 PolarHBondContact O-N 3.32Å; I432-F435 PolarHBondContact O-N 2.78Å; F435-S437 VanDerWaalsContact C-N 3.34Å; F435-S437 PolarHBondContact O-N 2.79Å; F435-S438 PolarHBondContact O-N 2.77Å; F435-S438 PolarHBondContact O-OG 3.05Å; F435-I439 WeakPolarHBondContact O-CG1 3.38Å; F435-I439 PolarHBondContact O-N 3.02Å; F435-L446 HydrophobicContact CB-CD1 3.82Å; F435-P452 HydrophobicContact CE2-CB 3.96Å; F435-P452 HydrophobicContact CE2-CG 4.46Å; F435-D455 HydrophobicContact CZ-CB 4.22Å; F435-F474 HydrophobicContact CD1-CE1 4.09Å; F435-F474 AromaticContact CD2-CD1 3.84Å; F435-F474 HydrophobicContact CD2-CD1 3.84Å; F435-F474 HydrophobicContact CD2-CE1 4.21Å; F435-F474 HydrophobicContact CE1-CD1 4.49Å; F435-F474 HydrophobicContact CE1-CE1 4.19Å; F435-F474 AromaticContact CE2-CD1 3.82Å; F435-F474 HydrophobicContact CE2-CD1 3.82Å; F435-F474 HydrophobicContact CE2-CE1 4.31Å; F435-F474 HydrophobicContact CG-CD1 4.18Å; F435-F474 HydrophobicContact CG-CE1 4.08Å; F435-F474 HydrophobicContact CZ-CD1 4.14Å; F435-F474 HydrophobicContact CZ-CE1 4.28Å; F435-F476 HydrophobicContact CD2-CE2 4.38Å; F435-F476 HydrophobicContact CD2-CZ 4.04Å
436	Q	92.9	Very high	89.1	Confident	59 Å²	59	57.6 Å²	57.6	28%	0.276	30%	0.299	S	S	.	.	H	α-helix	trans	-62.1	-37.3	-178.2	-170.2	167.6	-83.2	0	0	112.8	I432 S433 S438 L442 L446	I432-Q436 WeakPolarHBondContact O-CB 3.27Å; I432-Q436 PolarHBondContact O-N 3.01Å; S433-Q436 PolarHBondContact O-N 2.88Å; Q436-S438 PolarHBondContact O-N 3.03Å; Q436-L442 HydrophobicContact CG-CD2 4.14Å; Q436-L446 HydrophobicContact CB-CD1 3.8Å; Q436-L446 HydrophobicContact CB-CG 4.12Å; Q436-L446 HydrophobicContact CG-CD1 4.5Å; Q436-L446 HydrophobicContact CG-CG 4.34Å
437	S	91	Very high	89.4	Confident	106 Å²	106	58.8 Å²	58.8	74%	0.741	30%	0.303	S	S	*	.	H	α-helix	trans	-69.8	-21.1	175.8	73.3	0	0	0	0	113.6	S433 E434 F435	S433-S437 PolarHBondContact O-N 3.2Å; E434-S437 PolarHBondContact O-OG 3.34Å; F435-S437 VanDerWaalsContact C-N 3.34Å; F435-S437 PolarHBondContact O-N 2.79Å
438	S	90.8	Very high	89.9	Confident	16 Å²	16	58.8 Å²	58.8	11%	0.112	30%	0.303	C	S	.	.	H	α-helix	trans	-91.3	-13	-178.4	77.5	0	0	0	0	115	E434 F435 Q436 Y490	E434-S438 PolarHBondContact O-N 3.34Å; F435-S438 PolarHBondContact O-N 2.77Å; F435-S438 PolarHBondContact O-OG 3.05Å; Q436-S438 PolarHBondContact O-N 3.03Å; S438-Y490 PolarHBondContact O-N 2.89Å; S438-Y490 WeakPolarHBondContact OG-CD2 3.49Å
439	I	92.8	Very high	90.2	Very high	10 Å²	10	59.2 Å²	59.2	5%	0.051	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	110.4	-173.7	-60.8	166.2	0	0	0	111	F435 L442 L446 F474 Y490 L492	F435-I439 WeakPolarHBondContact O-CG1 3.38Å; F435-I439 PolarHBondContact O-N 3.02Å; I439-L442 HydrophobicContact CB-CB 4.49Å; I439-L442 HydrophobicContact CG2-CB 4Å; I439-L446 HydrophobicContact CD1-CD1 4.27Å; I439-F474 HydrophobicContact CD1-CD2 3.96Å; I439-F474 HydrophobicContact CD1-CE2 3.76Å; I439-F474 HydrophobicContact CD1-CZ 4.18Å; I439-F474 HydrophobicContact CG1-CE2 3.99Å; I439-F474 HydrophobicContact CG1-CZ 4.3Å; I439-Y490 CarbonylContact C-O 3.08Å; I439-Y490 VanDerWaalsContact CA-O 3.31Å; I439-Y490 WeakPolarHBondContact CA-O 3.44Å; I439-L492 HydrophobicContact CG2-CB 4.21Å
440	E	90.4	Very high	90.4	Very high	65 Å²	65	57 Å²	57	30%	0.304	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	142.6	175.5	-60.8	171.5	-167.6	0	0	111.9	L442 K486 S489 Y490 L492	E440-L442 VanDerWaalsContact C-N 3.26Å; E440-L442 PolarHBondContact O-N 3.03Å; E440-K486 WeakPolarHBondContact OE2-CD 3.27Å; E440-K486 IonicContact OE2-NZ 3.08Å; E440-K486 PolarHBondContact OE2-NZ 2.81Å; E440-S489 WeakPolarHBondContact OE1-CB 3.44Å; E440-S489 PolarHBondContact OE1-OG 2.88Å; E440-Y490 PolarHBondContact N-O 3.44Å; E440-L492 VanDerWaalsContact O-CB 3.31Å; E440-L492 WeakPolarHBondContact O-CB 3.44Å; E440-L492 PolarHBondContact O-N 3.48Å
441	N	87.1	Confident	90.8	Very high	116 Å²	116	54.8 Å²	54.8	62%	0.62	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	68	13.5	176.7	-46.3	-72.2	0	0	0	115.8
442	L	88.2	Confident	91.2	Very high	31 Å²	31	54.2 Å²	54.2	16%	0.162	28%	0.28	C	S	.	.			trans	-77.1	126.1	170.1	-178.4	67.1	0	0	0	110.7	Q436 I439 E440 V444 L446 L492 I495	Q436-L442 HydrophobicContact CG-CD2 4.14Å; I439-L442 HydrophobicContact CB-CB 4.49Å; I439-L442 HydrophobicContact CG2-CB 4Å; E440-L442 VanDerWaalsContact C-N 3.26Å; E440-L442 PolarHBondContact O-N 3.03Å; L442-V444 WeakPolarHBondContact CG-O 3.3Å; L442-L446 HydrophobicContact CD1-CD2 4.35Å; L442-L446 HydrophobicContact CD2-CD1 4.18Å; L442-L446 HydrophobicContact CD2-CD2 3.48Å; L442-L446 VanDerWaalsContact CD2-CD2 3.48Å; L442-L446 HydrophobicContact CD2-CG 3.66Å; L442-L492 HydrophobicContact CD1-CD2 4.28Å; L442-I495 HydrophobicContact CD1-CD1 4.24Å
443	Q	82.5	Confident	91.2	Very high	192 Å²	192	56.3 Å²	56.3	90%	0.897	29%	0.289	S	S	*	.			trans	-108.6	-6.8	-178.7	-65.1	-175.2	-10.3	0	0	114.3
444	V	88	Confident	91.3	Very high	56 Å²	56	54.9 Å²	54.9	34%	0.339	28%	0.276	S	S	.	.	S	Bend	trans	-117.3	145.5	-174.2	-176.6	0	0	0	0	109.4	L442 L446 Y449	L442-V444 WeakPolarHBondContact CG-O 3.3Å; V444-L446 PolarHBondContact O-N 2.87Å; V444-Y449 HydrophobicContact CG1-CE1 4.45Å; V444-Y449 HydrophobicContact CG1-CE2 4.45Å
445	K	91.6	Very high	91.5	Very high	102 Å²	102	53.7 Å²	53.7	44%	0.443	27%	0.27	S	S	.	.			trans	-67.3	128.7	176.5	-71.8	179.9	150.3	-139.4	0	111.1	E447 E448	K445-E447 HydrophobicContact CB-CB 4.35Å; K445-E447 IonicContact NZ-OE1 3.82Å; K445-E447 IonicContact NZ-OE2 2.7Å; K445-E447 PolarHBondContact NZ-OE2 2.85Å; K445-E447 PolarHBondContact O-N 3.38Å; K445-E448 HydrophobicContact CB-CG 4.2Å; K445-E448 WeakPolarHBondContact O-CB 3.47Å; K445-E448 PolarHBondContact O-N 3.24Å; K445-E448 VanDerWaalsContact O-N 3.08Å
446	L	93.4	Very high	91.5	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-63.1	-26.8	175.1	-66.2	-173	0	0	0	112.9	I432 F435 Q436 I439 L442 V444 E448 Y449 F476 I481	I432-L446 HydrophobicContact CG2-CB 3.51Å; F435-L446 HydrophobicContact CB-CD1 3.82Å; Q436-L446 HydrophobicContact CB-CD1 3.8Å; Q436-L446 HydrophobicContact CB-CG 4.12Å; Q436-L446 HydrophobicContact CG-CD1 4.5Å; Q436-L446 HydrophobicContact CG-CG 4.34Å; I439-L446 HydrophobicContact CD1-CD1 4.27Å; L442-L446 HydrophobicContact CD1-CD2 4.35Å; L442-L446 HydrophobicContact CD2-CD1 4.18Å; L442-L446 HydrophobicContact CD2-CD2 3.48Å; L442-L446 VanDerWaalsContact CD2-CD2 3.48Å; L442-L446 HydrophobicContact CD2-CG 3.66Å; V444-L446 PolarHBondContact O-N 2.87Å; L446-E448 PolarHBondContact O-N 3.23Å; L446-Y449 HydrophobicContact CD2-CD2 3.96Å; L446-Y449 HydrophobicContact CD2-CE2 4.15Å; L446-Y449 PolarHBondContact O-N 2.94Å; L446-F476 HydrophobicContact CB-CE1 4.13Å; L446-F476 HydrophobicContact CB-CZ 4.05Å; L446-F476 HydrophobicContact CD1-CZ 3.93Å; L446-F476 HydrophobicContact CD2-CE2 4.49Å; L446-F476 HydrophobicContact CD2-CZ 4.32Å; L446-F476 HydrophobicContact CG-CZ 4.34Å; L446-I481 HydrophobicContact CD2-CD1 3.29Å
447	E	93.1	Very high	91.3	Very high	65 Å²	65	53.5 Å²	53.5	30%	0.304	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-50	-36.6	170.6	-65	156.9	-143.6	0	0	112.4	L429 I432 K445 Y449 G450 F594 Y595	L429-E447 HydrophobicContact CD2-CG 4.06Å; I432-E447 HydrophobicContact CG2-CG 4.22Å; K445-E447 HydrophobicContact CB-CB 4.35Å; K445-E447 IonicContact NZ-OE1 3.82Å; K445-E447 IonicContact NZ-OE2 2.7Å; K445-E447 PolarHBondContact NZ-OE2 2.85Å; K445-E447 PolarHBondContact O-N 3.38Å; E447-Y449 PolarHBondContact O-N 2.81Å; E447-G450 PolarHBondContact O-N 2.83Å; E447-F594 HydrophobicContact CB-CE2 4.27Å; E447-F594 WeakPolarHBondContact O-CE2 3.27Å; E447-F594 WeakPolarHBondContact O-CZ 3.47Å; E447-Y595 WeakPolarHBondContact O-CE2 3.49Å
448	E	92.4	Very high	91.5	Very high	101 Å²	101	48.6 Å²	48.6	47%	0.472	24%	0.236	S	C	.	.	G	3₁₀ helix	trans	-69.2	-18.3	-178.2	-65.5	174.8	-134.4	0	0	112.7	K445 L446 K478 Y595	K445-E448 HydrophobicContact CB-CG 4.2Å; K445-E448 WeakPolarHBondContact O-CB 3.47Å; K445-E448 PolarHBondContact O-N 3.24Å; K445-E448 VanDerWaalsContact O-N 3.08Å; L446-E448 PolarHBondContact O-N 3.23Å; E448-K478 WeakPolarHBondContact O-CD 3.37Å; E448-K478 WeakPolarHBondContact O-CE 3.16Å; E448-K478 PolarHBondContact O-NZ 3.08Å; E448-Y595 PolarHBondContact O-OH 3Å
449	Y	94.8	Very high	91.5	Very high	33 Å²	33	49.8 Å²	49.8	13%	0.129	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-92.3	-1.9	-178.4	-57.1	-41.9	0	0	0	114.7	V444 L446 E447 D477 K478 V479 I481	V444-Y449 HydrophobicContact CG1-CE1 4.45Å; V444-Y449 HydrophobicContact CG1-CE2 4.45Å; L446-Y449 HydrophobicContact CD2-CD2 3.96Å; L446-Y449 HydrophobicContact CD2-CE2 4.15Å; L446-Y449 PolarHBondContact O-N 2.94Å; E447-Y449 PolarHBondContact O-N 2.81Å; Y449-D477 PolarHBondContact O-N 2.71Å; Y449-K478 WeakPolarHBondContact O-CB 3.31Å; Y449-K478 WeakPolarHBondContact O-CG 3.34Å; Y449-K478 PolarHBondContact O-N 3.45Å; Y449-V479 HydrophobicContact CD1-CB 4.42Å; Y449-V479 HydrophobicContact CD1-CG1 3.51Å; Y449-V479 HydrophobicContact CD1-CG2 3.98Å; Y449-V479 HydrophobicContact CD2-CG2 3.63Å; Y449-V479 HydrophobicContact CE1-CG1 3.76Å; Y449-V479 HydrophobicContact CE1-CG2 4.43Å; Y449-V479 HydrophobicContact CE2-CG2 4.11Å; Y449-V479 HydrophobicContact CG-CB 4.44Å; Y449-V479 HydrophobicContact CG-CG1 4Å; Y449-V479 HydrophobicContact CG-CG2 3.56Å; Y449-I481 HydrophobicContact CD2-CD1 4.32Å; Y449-I481 HydrophobicContact CE2-CD1 4.45Å
450	G	93.6	Very high	91.6	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.24	C	C	.	.			trans	92.2	-156	178.3	0	0	0	0	0	113.6	E447 F476 F594	E447-G450 PolarHBondContact O-N 2.83Å; G450-F476 WeakPolarHBondContact O-CD1 3.41Å; G450-F594 WeakPolarHBondContact O-CZ 3.47Å
451	R	94.6	Very high	91.5	Very high	56 Å²	56	47.2 Å²	47.2	21%	0.211	23%	0.229	C	C	.	.	S	Bend	trans	-82.7	139.2	-179.9	-61.9	-175.4	175.9	86.1	-10.7	110.2	D425 T428 K453 D477 F594 Y595	D425-R451 IonicContact OD1-CZ 3.29Å; D425-R451 VanDerWaalsContact OD1-CZ 3.29Å; D425-R451 IonicContact OD1-NE 3.14Å; D425-R451 PolarHBondContact OD1-NE 2.89Å; D425-R451 VanDerWaalsContact OD1-NE 3.14Å; D425-R451 IonicContact OD1-NH2 3.66Å; D425-R451 PolarHBondContact OD1-NH2 3.39Å; D425-R451 IonicContact OD2-NH2 2.88Å; D425-R451 PolarHBondContact OD2-NH2 3.38Å; T428-R451 HydrophobicContact CG2-CB 4.34Å; T428-R451 HydrophobicContact CG2-CG 4.1Å; R451-K453 PolarHBondContact O-NZ 3.31Å; R451-D477 WeakPolarHBondContact CA-OD2 3.3Å; R451-D477 WeakPolarHBondContact CB-OD2 3.18Å; R451-D477 PolarHBondContact N-OD2 3.12Å; R451-D477 PolarHBondContact O-N 3Å; R451-D477 VanDerWaalsContact O-N 3.12Å; R451-F594 HydrophobicContact CG-CD1 3.82Å; R451-F594 HydrophobicContact CG-CE1 3.74Å; R451-F594 PolarHBondContact NH1-O 2.84Å; R451-F594 PolarHBondContact NH2-O 3.4Å; R451-Y595 PolarHBondContact NH1-O 3.13Å
452	P	94.3	Very high	91.5	Very high	24 Å²	24	42.4 Å²	42.4	16%	0.156	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	159.8	168.3	28	-35.1	0	0	0	110.7	T428 I432 F435 L475 F476	T428-P452 HydrophobicContact CG2-CG 4.49Å; I432-P452 HydrophobicContact CG1-CG 4.31Å; F435-P452 HydrophobicContact CE2-CB 3.96Å; F435-P452 HydrophobicContact CE2-CG 4.46Å; P452-L475 CarbonylContact C-O 3.59Å; P452-L475 WeakPolarHBondContact CA-O 3.3Å; P452-F476 HydrophobicContact CB-CD1 4.48Å; P452-F476 HydrophobicContact CB-CE1 4.27Å; P452-F476 HydrophobicContact CB-CZ 4.36Å
453	K	92.8	Very high	90.7	Very high	45 Å²	45	46 Å²	46	20%	0.196	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	-54.1	-178.1	-64.8	-71	168.9	-72.5	0	111.9	R451 L475 D477 Q552 A556	R451-K453 PolarHBondContact O-NZ 3.31Å; K453-L475 HydrophobicContact CB-CB 4.3Å; K453-L475 HydrophobicContact CB-CD2 4.04Å; K453-L475 HydrophobicContact CB-CG 4.06Å; K453-L475 HydrophobicContact CG-CG 4.42Å; K453-L475 PolarHBondContact N-O 2.75Å; K453-D477 WeakPolarHBondContact CE-OD1 3.48Å; K453-D477 IonicContact NZ-OD1 3.95Å; K453-D477 PolarHBondContact NZ-OD1 3.1Å; K453-D477 IonicContact NZ-OD2 2.72Å; K453-D477 PolarHBondContact NZ-OD2 3.34Å; K453-Q552 HydrophobicContact CB-CB 4.18Å; K453-A556 HydrophobicContact CG-CB 4.38Å
454	I	92.7	Very high	90.3	Very high	38 Å²	38	42.4 Å²	42.4	20%	0.195	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	147.2	179.9	-178.4	166	0	0	0	109	L475 W549 Q552	I454-L475 HydrophobicContact CG2-CB 3.93Å; I454-L475 HydrophobicContact CG2-CD2 3.9Å; I454-L475 PolarHBondContact O-N 2.95Å; I454-W549 HydrophobicContact CD1-CD2 4.01Å; I454-W549 HydrophobicContact CD1-CG 4.22Å; I454-W549 HydrophobicContact CD1-CZ2 4.18Å; I454-W549 HydrophobicContact CG1-CD2 4.38Å; I454-W549 HydrophobicContact CG1-CH2 4.19Å; I454-W549 HydrophobicContact CG1-CZ2 3.88Å; I454-W549 HydrophobicContact CG2-CD2 4Å; I454-W549 HydrophobicContact CG2-CE3 3.56Å; I454-W549 HydrophobicContact CG2-CH2 3.98Å; I454-W549 HydrophobicContact CG2-CZ2 4.37Å; I454-W549 HydrophobicContact CG2-CZ3 3.57Å; I454-Q552 HydrophobicContact CB-CB 4.44Å; I454-Q552 HydrophobicContact CB-CG 4.18Å; I454-Q552 HydrophobicContact CG2-CB 3.68Å; I454-Q552 HydrophobicContact CG2-CG 3.95Å
455	D	93.4	Very high	89.6	Confident	11 Å²	11	43.2 Å²	43.2	6%	0.059	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	140.5	177.3	55.8	-81.4	0	0	0	109.9	S112 Q113 F114 F435 Y472 I473 F474	S112-D455 WeakPolarHBondContact CB-OD1 3.44Å; S112-D455 VanDerWaalsContact OG-CG 3.27Å; S112-D455 PolarHBondContact OG-OD1 2.91Å; S112-D455 PolarHBondContact OG-OD2 3.35Å; Q113-D455 PolarHBondContact N-OD2 3.04Å; Q113-D455 VanDerWaalsContact N-OD2 3.11Å; F114-D455 WeakPolarHBondContact CB-OD2 3.33Å; F114-D455 PolarHBondContact N-OD2 3.17Å; F435-D455 HydrophobicContact CZ-CB 4.22Å; D455-Y472 HydrophobicContact CB-CE1 4.22Å; D455-Y472 PolarHBondContact OD2-OH 3.1Å; D455-I473 CarbonylContact C-O 3.56Å; D455-I473 VanDerWaalsContact CA-O 3.28Å; D455-I473 WeakPolarHBondContact CA-O 3.37Å; D455-F474 HydrophobicContact CB-CD1 3.83Å; D455-F474 HydrophobicContact CB-CE1 4.28Å
456	G	90.3	Very high	89	Confident	5 Å²	5	48.8 Å²	48.8	5%	0.052	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	162.5	-178.2	174.4	0	0	0	0	0	116.6	I473	G456-I473 PolarHBondContact N-O 3.47Å; G456-I473 PolarHBondContact O-N 2.92Å
457	E	90.4	Very high	88.6	Confident	52 Å²	52	52.4 Å²	52.4	24%	0.243	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	123.7	-177	-65.8	-167.1	158.6	0	0	113.6	R471 Y472 R485	E457-R471 WeakPolarHBondContact CA-O 3.36Å; E457-Y472 HydrophobicContact CG-CD2 3.55Å; E457-Y472 HydrophobicContact CG-CE2 4.04Å; E457-R485 WeakPolarHBondContact OE1-CD 3.28Å; E457-R485 IonicContact OE1-CZ 2.69Å; E457-R485 IonicContact OE1-NE 2.74Å; E457-R485 IonicContact OE1-NH1 3.72Å; E457-R485 PolarHBondContact OE1-NH1 3.32Å; E457-R485 IonicContact OE2-NH1 3.56Å
458	L	93.4	Very high	88.4	Confident	2 Å²	2	53.9 Å²	53.9	1%	0.01	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	149.2	172.7	-66.1	-178.4	0	0	0	110.6	R471 I473 F538 C540 W549	L458-R471 PolarHBondContact N-O 2.89Å; L458-R471 PolarHBondContact O-N 2.87Å; L458-I473 HydrophobicContact CB-CG1 3.94Å; L458-I473 HydrophobicContact CD1-CG1 4.16Å; L458-I473 HydrophobicContact CG-CG1 4.26Å; L458-F538 HydrophobicContact CD1-CB 4.39Å; L458-F538 HydrophobicContact CD1-CD1 3.84Å; L458-C540 HydrophobicContact CD2-CB 4.19Å; L458-C540 WeakPolarHBondContact CD2-SG 3.48Å; L458-W549 HydrophobicContact CD1-CD2 3.71Å; L458-W549 HydrophobicContact CD1-CE3 3.94Å; L458-W549 HydrophobicContact CD1-CG 4.18Å; L458-W549 HydrophobicContact CD1-CH2 4.28Å; L458-W549 HydrophobicContact CD1-CZ2 4.07Å; L458-W549 HydrophobicContact CD1-CZ3 4.2Å; L458-W549 HydrophobicContact CG-CD2 4.46Å; L458-W549 HydrophobicContact CG-CZ2 4.17Å
459	K	92.7	Very high	88.3	Confident	41 Å²	41	51.8 Å²	51.8	18%	0.178	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	130.1	163.7	-68.9	-174.3	-163.6	-78	0	108.7	K468 Q469 D470 W521 F538 F539	K459-K468 HydrophobicContact CB-CB 4.35Å; K459-K468 HydrophobicContact CD-CB 4.24Å; K459-K468 HydrophobicContact CD-CD 4.48Å; K459-Q469 CarbonylContact C-O 3.6Å; K459-Q469 WeakPolarHBondContact CA-O 3.41Å; K459-D470 WeakPolarHBondContact CG-OD1 3.43Å; K459-D470 IonicContact NZ-OD1 2.83Å; K459-D470 PolarHBondContact NZ-OD1 3.41Å; K459-D470 IonicContact NZ-OD2 2.72Å; K459-D470 PolarHBondContact NZ-OD2 3.33Å; K459-W521 HydrophobicContact CB-CE3 4.22Å; K459-W521 HydrophobicContact CD-CB 3.83Å; K459-W521 HydrophobicContact CD-CD2 3.86Å; K459-W521 HydrophobicContact CD-CE3 4.3Å; K459-W521 HydrophobicContact CD-CG 3.66Å; K459-W521 HydrophobicContact CG-CD2 3.91Å; K459-W521 HydrophobicContact CG-CE3 3.91Å; K459-W521 HydrophobicContact CG-CG 4.25Å; K459-W521 HydrophobicContact CG-CZ3 4.39Å; K459-F538 CarbonylContact O-C 3.6Å; K459-F539 HydrophobicContact CB-CB 4.27Å; K459-F539 HydrophobicContact CB-CD2 4.4Å; K459-F539 PolarHBondContact N-O 3.14Å; K459-F539 WeakPolarHBondContact O-CD2 3.5Å; K459-F539 PolarHBondContact O-N 3.47Å
460	V	93	Very high	88.1	Confident	10 Å²	10	54.8 Å²	54.8	6%	0.061	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	139.6	178	-176	0	0	0	0	109.9	Q469 R471 I473 F536 Q537 F538	V460-Q469 PolarHBondContact N-O 3.11Å; V460-Q469 PolarHBondContact O-N 3.42Å; V460-R471 HydrophobicContact CB-CG 4.24Å; V460-R471 HydrophobicContact CG2-CB 4.11Å; V460-R471 HydrophobicContact CG2-CG 4.18Å; V460-I473 HydrophobicContact CG2-CD1 3.91Å; V460-F536 HydrophobicContact CG1-CD1 4.09Å; V460-Q537 WeakPolarHBondContact CA-O 3.39Å; V460-F538 HydrophobicContact CG1-CE1 4.44Å; V460-F538 HydrophobicContact CG2-CD1 3.68Å; V460-F538 HydrophobicContact CG2-CE1 3.73Å
461	S	90.3	Very high	88.2	Confident	11 Å²	11	57.1 Å²	57.1	8%	0.077	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	158.5	162.3	70.9	0	0	0	0	110.5	T467 F536 Q537	S461-T467 WeakPolarHBondContact CB-O 3.43Å; S461-F536 WeakPolarHBondContact O-CA 3.5Å; S461-Q537 PolarHBondContact N-O 3.21Å; S461-Q537 PolarHBondContact O-N 3.45Å
462	S	85.3	Confident	88.2	Confident	16 Å²	16	54.5 Å²	54.5	11%	0.112	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	152.3	175	166.4	0	0	0	0	109.2	V464 N465 R466 Q534	S462-V464 PolarHBondContact O-N 3.06Å; S462-V464 VanDerWaalsContact O-N 3.15Å; S462-V464 PolarHBondContact OG-N 3.31Å; S462-N465 PolarHBondContact N-O 2.82Å; S462-N465 CarbonylContact O-C 3.42Å; S462-N465 PolarHBondContact O-N 2.9Å; S462-R466 PolarHBondContact O-N 3.39Å; S462-Q534 PolarHBondContact OG-NE2 2.97Å
463	I	72.7	Confident	88.3	Confident	105 Å²	105	53.3 Å²	53.3	54%	0.538	26%	0.262	S	S	.	.	S	Bend	trans	-55.1	-32.6	171.4	-67.4	176.1	0	0	0	111	G535	I463-G535 PolarHBondContact N-O 2.96Å
464	V	73.9	Confident	88.5	Confident	118 Å²	118	51.2 Å²	51.2	72%	0.715	25%	0.253	S	S	*	.	S	Bend	trans	-78.2	-39.8	176	-172.3	0	0	0	0	111.7	S462	S462-V464 PolarHBondContact O-N 3.06Å; S462-V464 VanDerWaalsContact O-N 3.15Å; S462-V464 PolarHBondContact OG-N 3.31Å
465	N	73.6	Confident	88.7	Confident	72 Å²	72	49.4 Å²	49.4	39%	0.385	24%	0.243	S	C	.	.			trans	-120.6	91.7	-180	-170.1	-16.5	0	0	0	110.9	S462 T467 Q469	S462-N465 PolarHBondContact N-O 2.82Å; S462-N465 CarbonylContact O-C 3.42Å; S462-N465 PolarHBondContact O-N 2.9Å; N465-T467 PolarHBondContact O-N 3.41Å; N465-T467 VanDerWaalsContact O-N 3.12Å; N465-T467 PolarHBondContact OD1-N 2.95Å; N465-T467 PolarHBondContact OD1-OG1 3.46Å; N465-Q469 PolarHBondContact ND2-NE2 3.33Å
466	R	77.6	Confident	88.8	Confident	220 Å²	220	48.9 Å²	48.9	83%	0.83	24%	0.241	S	C	*	.			trans	-71.2	1.1	-176	-61.1	-175.4	-180	-169.2	-1.2	114.8	S462	S462-R466 PolarHBondContact O-N 3.39Å
467	T	85.4	Confident	89.1	Confident	76 Å²	76	48.7 Å²	48.7	47%	0.466	24%	0.238	S	C	.	.	S	Bend	trans	-70	137.2	172.5	60.3	0	0	0	0	110	S461 N465 Q469	S461-T467 WeakPolarHBondContact CB-O 3.43Å; N465-T467 PolarHBondContact O-N 3.41Å; N465-T467 VanDerWaalsContact O-N 3.12Å; N465-T467 PolarHBondContact OD1-N 2.95Å; N465-T467 PolarHBondContact OD1-OG1 3.46Å; T467-Q469 PolarHBondContact O-N 2.87Å; T467-Q469 PolarHBondContact OG1-NE2 2.9Å
468	K	88.5	Confident	89.3	Confident	95 Å²	95	49.3 Å²	49.3	41%	0.413	24%	0.24	S	C	.	.			trans	-75.7	121.4	169.3	-67	-167.2	179.6	-169.3	0	108.3	K459 W521 F539	K459-K468 HydrophobicContact CB-CB 4.35Å; K459-K468 HydrophobicContact CD-CB 4.24Å; K459-K468 HydrophobicContact CD-CD 4.48Å; K468-W521 PolarHBondContact NZ-O 2.86Å; K468-F539 HydrophobicContact CD-CD2 3.83Å; K468-F539 HydrophobicContact CD-CE2 3.93Å; K468-F539 HydrophobicContact CD-CG 4.15Å; K468-F539 HydrophobicContact CD-CZ 4.31Å; K468-F539 VanDerWaalsContact CE-CE1 3.47Å; K468-F539 VanDerWaalsContact CE-CZ 3.41Å; K468-F539 HydrophobicContact CG-CD2 4.01Å; K468-F539 HydrophobicContact CG-CE2 3.79Å; K468-F539 HydrophobicContact CG-CZ 4.38Å
469	Q	90.8	Very high	89.4	Confident	57 Å²	57	49.4 Å²	49.4	27%	0.266	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	127.4	-175.7	-52.3	-172.6	-14.5	0	0	110.1	K459 V460 N465 T467 R471	K459-Q469 CarbonylContact C-O 3.6Å; K459-Q469 WeakPolarHBondContact CA-O 3.41Å; V460-Q469 PolarHBondContact N-O 3.11Å; V460-Q469 PolarHBondContact O-N 3.42Å; N465-Q469 PolarHBondContact ND2-NE2 3.33Å; T467-Q469 PolarHBondContact O-N 2.87Å; T467-Q469 PolarHBondContact OG1-NE2 2.9Å; Q469-R471 PolarHBondContact O-N 3.14Å
470	D	91.2	Very high	89.6	Confident	96 Å²	96	47.4 Å²	47.4	51%	0.513	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	121.5	176.3	-59.7	-73.7	0	0	0	111	K459	K459-D470 WeakPolarHBondContact CG-OD1 3.43Å; K459-D470 IonicContact NZ-OD1 2.83Å; K459-D470 PolarHBondContact NZ-OD1 3.41Å; K459-D470 IonicContact NZ-OD2 2.72Å; K459-D470 PolarHBondContact NZ-OD2 3.33Å
471	R	94.8	Very high	89.8	Confident	49 Å²	49	47 Å²	47	19%	0.185	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	150.3	-177.7	-65.2	-65.4	174.4	-102.6	3.1	110.6	E457 L458 V460 Q469 I473 V482 C483	E457-R471 WeakPolarHBondContact CA-O 3.36Å; L458-R471 PolarHBondContact N-O 2.89Å; L458-R471 PolarHBondContact O-N 2.87Å; V460-R471 HydrophobicContact CB-CG 4.24Å; V460-R471 HydrophobicContact CG2-CB 4.11Å; V460-R471 HydrophobicContact CG2-CG 4.18Å; Q469-R471 PolarHBondContact O-N 3.14Å; R471-I473 HydrophobicContact CB-CD1 3.82Å; R471-V482 HydrophobicContact CB-CG1 4.03Å; R471-V482 HydrophobicContact CG-CG1 3.76Å; R471-C483 WeakPolarHBondContact CA-O 3.44Å; R471-C483 WeakPolarHBondContact CB-O 3.31Å; R471-C483 WeakPolarHBondContact CD-O 3.47Å
472	Y	94.9	Very high	90	Very high	1 Å²	1	46.7 Å²	46.7	0%	0.004	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	130.6	165.4	-160.5	-83.3	0	0	0	107.8	Q113 F114 D455 E457 F474 C483 Y490	Q113-Y472 HydrophobicContact CG-CE2 4.41Å; Q113-Y472 VanDerWaalsContact OE1-CE2 3.28Å; F114-Y472 PolarHBondContact N-OH 3.21Å; D455-Y472 HydrophobicContact CB-CE1 4.22Å; D455-Y472 PolarHBondContact OD2-OH 3.1Å; E457-Y472 HydrophobicContact CG-CD2 3.55Å; E457-Y472 HydrophobicContact CG-CE2 4.04Å; Y472-F474 HydrophobicContact CD1-CD2 4.09Å; Y472-F474 HydrophobicContact CD1-CE1 4.24Å; Y472-F474 AromaticContact CD1-CE2 3.57Å; Y472-F474 HydrophobicContact CD1-CE2 3.57Å; Y472-F474 AromaticContact CD1-CZ 3.66Å; Y472-F474 HydrophobicContact CD1-CZ 3.66Å; Y472-F474 HydrophobicContact CE1-CD1 4.22Å; Y472-F474 HydrophobicContact CE1-CD2 4.41Å; Y472-F474 AromaticContact CE1-CE1 3.69Å; Y472-F474 HydrophobicContact CE1-CE1 3.69Å; Y472-F474 AromaticContact CE1-CE2 3.9Å; Y472-F474 HydrophobicContact CE1-CE2 3.9Å; Y472-F474 AromaticContact CE1-CZ 3.51Å; Y472-F474 HydrophobicContact CE1-CZ 3.51Å; Y472-C483 PolarHBondContact N-O 2.81Å; Y472-C483 WeakPolarHBondContact O-CA 3.09Å; Y472-C483 WeakPolarHBondContact O-CB 3.28Å; Y472-C483 PolarHBondContact O-N 3.31Å; Y472-Y490 AromaticContact CD1-CD1 3.85Å; Y472-Y490 HydrophobicContact CD1-CD1 3.85Å; Y472-Y490 AromaticContact CD1-CE1 3.57Å; Y472-Y490 HydrophobicContact CD1-CE1 3.57Å; Y472-Y490 HydrophobicContact CD2-CD1 4.34Å; Y472-Y490 AromaticContact CD2-CE1 3.56Å; Y472-Y490 HydrophobicContact CD2-CE1 3.56Å; Y472-Y490 AromaticContact CE1-CE1 3.92Å; Y472-Y490 HydrophobicContact CE1-CE1 3.92Å; Y472-Y490 AromaticContact CE2-CE1 3.93Å; Y472-Y490 HydrophobicContact CE2-CE1 3.93Å; Y472-Y490 AromaticContact CG-CD1 3.73Å; Y472-Y490 HydrophobicContact CG-CD1 3.73Å; Y472-Y490 AromaticContact CG-CE1 3.37Å; Y472-Y490 HydrophobicContact CG-CE1 3.37Å
473	I	96.4	Very high	90.5	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	134.1	-171.5	-54.4	-57	0	0	0	109.1	D455 G456 L458 V460 R471 V480 I481 V482 F538 W549	D455-I473 CarbonylContact C-O 3.56Å; D455-I473 VanDerWaalsContact CA-O 3.28Å; D455-I473 WeakPolarHBondContact CA-O 3.37Å; G456-I473 PolarHBondContact N-O 3.47Å; G456-I473 PolarHBondContact O-N 2.92Å; L458-I473 HydrophobicContact CB-CG1 3.94Å; L458-I473 HydrophobicContact CD1-CG1 4.16Å; L458-I473 HydrophobicContact CG-CG1 4.26Å; V460-I473 HydrophobicContact CG2-CD1 3.91Å; R471-I473 HydrophobicContact CB-CD1 3.82Å; I473-V480 HydrophobicContact CG2-CG1 3.43Å; I473-V480 VanDerWaalsContact CG2-CG1 3.43Å; I473-I481 WeakPolarHBondContact CA-O 3.26Å; I473-V482 HydrophobicContact CD1-CB 4.2Å; I473-V482 HydrophobicContact CD1-CG1 3.88Å; I473-V482 HydrophobicContact CD1-CG2 4.07Å; I473-F538 HydrophobicContact CD1-CE1 4.22Å; I473-F538 HydrophobicContact CG1-CE1 4.48Å; I473-W549 HydrophobicContact CB-CH2 3.69Å; I473-W549 HydrophobicContact CB-CZ3 4.09Å; I473-W549 HydrophobicContact CG2-CH2 3.7Å; I473-W549 HydrophobicContact CG2-CZ3 3.58Å
474	F	96.4	Very high	91.5	Very high	1 Å²	1	45.8 Å²	45.8	0%	0.004	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	119.8	165.1	-55.6	-96.2	0	0	0	108.6	F435 I439 D455 Y472 F476 I481 Y490	F435-F474 HydrophobicContact CD1-CE1 4.09Å; F435-F474 AromaticContact CD2-CD1 3.84Å; F435-F474 HydrophobicContact CD2-CD1 3.84Å; F435-F474 HydrophobicContact CD2-CE1 4.21Å; F435-F474 HydrophobicContact CE1-CD1 4.49Å; F435-F474 HydrophobicContact CE1-CE1 4.19Å; F435-F474 AromaticContact CE2-CD1 3.82Å; F435-F474 HydrophobicContact CE2-CD1 3.82Å; F435-F474 HydrophobicContact CE2-CE1 4.31Å; F435-F474 HydrophobicContact CG-CD1 4.18Å; F435-F474 HydrophobicContact CG-CE1 4.08Å; F435-F474 HydrophobicContact CZ-CD1 4.14Å; F435-F474 HydrophobicContact CZ-CE1 4.28Å; I439-F474 HydrophobicContact CD1-CD2 3.96Å; I439-F474 HydrophobicContact CD1-CE2 3.76Å; I439-F474 HydrophobicContact CD1-CZ 4.18Å; I439-F474 HydrophobicContact CG1-CE2 3.99Å; I439-F474 HydrophobicContact CG1-CZ 4.3Å; D455-F474 HydrophobicContact CB-CD1 3.83Å; D455-F474 HydrophobicContact CB-CE1 4.28Å; Y472-F474 HydrophobicContact CD1-CD2 4.09Å; Y472-F474 HydrophobicContact CD1-CE1 4.24Å; Y472-F474 AromaticContact CD1-CE2 3.57Å; Y472-F474 HydrophobicContact CD1-CE2 3.57Å; Y472-F474 AromaticContact CD1-CZ 3.66Å; Y472-F474 HydrophobicContact CD1-CZ 3.66Å; Y472-F474 HydrophobicContact CE1-CD1 4.22Å; Y472-F474 HydrophobicContact CE1-CD2 4.41Å; Y472-F474 AromaticContact CE1-CE1 3.69Å; Y472-F474 HydrophobicContact CE1-CE1 3.69Å; Y472-F474 AromaticContact CE1-CE2 3.9Å; Y472-F474 HydrophobicContact CE1-CE2 3.9Å; Y472-F474 AromaticContact CE1-CZ 3.51Å; Y472-F474 HydrophobicContact CE1-CZ 3.51Å; F474-F476 HydrophobicContact CB-CD2 4.37Å; F474-F476 HydrophobicContact CB-CE2 4Å; F474-I481 HydrophobicContact CB-CB 4.28Å; F474-I481 PolarHBondContact N-O 3.29Å; F474-I481 PolarHBondContact O-N 2.89Å; F474-Y490 HydrophobicContact CE2-CD1 4.42Å; F474-Y490 HydrophobicContact CE2-CD2 4.26Å; F474-Y490 HydrophobicContact CE2-CG 4.07Å; F474-Y490 HydrophobicContact CZ-CD1 4.43Å; F474-Y490 AromaticContact CZ-CD2 3.78Å; F474-Y490 HydrophobicContact CZ-CD2 3.78Å; F474-Y490 AromaticContact CZ-CE2 3.94Å; F474-Y490 HydrophobicContact CZ-CE2 3.94Å; F474-Y490 HydrophobicContact CZ-CG 4.03Å
475	L	96.9	Very high	92.1	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	127.6	174.9	-175.8	64.1	0	0	0	110.5	P452 K453 I454 V480 L498 W549 Q552 F553	P452-L475 CarbonylContact C-O 3.59Å; P452-L475 WeakPolarHBondContact CA-O 3.3Å; K453-L475 HydrophobicContact CB-CB 4.3Å; K453-L475 HydrophobicContact CB-CD2 4.04Å; K453-L475 HydrophobicContact CB-CG 4.06Å; K453-L475 HydrophobicContact CG-CG 4.42Å; K453-L475 PolarHBondContact N-O 2.75Å; I454-L475 HydrophobicContact CG2-CB 3.93Å; I454-L475 HydrophobicContact CG2-CD2 3.9Å; I454-L475 PolarHBondContact O-N 2.95Å; L475-V480 HydrophobicContact CD1-CG2 3.98Å; L475-L498 HydrophobicContact CD1-CD1 3.92Å; L475-L498 HydrophobicContact CD1-CD2 4.5Å; L475-W549 HydrophobicContact CB-CZ3 4.09Å; L475-Q552 HydrophobicContact CD2-CB 3.92Å; L475-F553 HydrophobicContact CD1-CD1 3.9Å; L475-F553 HydrophobicContact CD1-CE1 3.65Å; L475-F553 HydrophobicContact CD1-CE2 4.46Å; L475-F553 HydrophobicContact CD1-CG 4.43Å; L475-F553 HydrophobicContact CD1-CZ 3.94Å; L475-F553 HydrophobicContact CD2-CD1 4.27Å; L475-F553 HydrophobicContact CD2-CD2 3.99Å; L475-F553 HydrophobicContact CD2-CE2 4.25Å; L475-F553 HydrophobicContact CD2-CG 3.99Å
476	F	96.9	Very high	92.8	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	166.5	173.6	-78.4	-104	0	0	0	110.1	I432 F435 L446 G450 P452 F474 K478 V479 I481 L498	I432-F476 HydrophobicContact CD1-CE1 4.42Å; I432-F476 HydrophobicContact CG1-CE1 4.09Å; F435-F476 HydrophobicContact CD2-CE2 4.38Å; F435-F476 HydrophobicContact CD2-CZ 4.04Å; L446-F476 HydrophobicContact CB-CE1 4.13Å; L446-F476 HydrophobicContact CB-CZ 4.05Å; L446-F476 HydrophobicContact CD1-CZ 3.93Å; L446-F476 HydrophobicContact CD2-CE2 4.49Å; L446-F476 HydrophobicContact CD2-CZ 4.32Å; L446-F476 HydrophobicContact CG-CZ 4.34Å; G450-F476 WeakPolarHBondContact O-CD1 3.41Å; P452-F476 HydrophobicContact CB-CD1 4.48Å; P452-F476 HydrophobicContact CB-CE1 4.27Å; P452-F476 HydrophobicContact CB-CZ 4.36Å; F474-F476 HydrophobicContact CB-CD2 4.37Å; F474-F476 HydrophobicContact CB-CE2 4Å; F476-K478 PolarHBondContact O-N 2.86Å; F476-V479 HydrophobicContact CB-CG2 4.27Å; F476-V479 PolarHBondContact N-O 2.83Å; F476-I481 HydrophobicContact CD2-CD1 4.09Å; F476-I481 HydrophobicContact CD2-CG1 4.43Å; F476-I481 HydrophobicContact CE2-CD1 3.94Å; F476-L498 WeakPolarHBondContact O-CD1 3.39Å
477	D	95.3	Very high	93	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.005	19%	0.186	C	C	.	.	S	Bend	trans	-51	-41	175.9	-79.5	-58.6	0	0	0	113.4	Y449 R451 K453 N559 I560 M574	Y449-D477 PolarHBondContact O-N 2.71Å; R451-D477 WeakPolarHBondContact CA-OD2 3.3Å; R451-D477 WeakPolarHBondContact CB-OD2 3.18Å; R451-D477 PolarHBondContact N-OD2 3.12Å; R451-D477 PolarHBondContact O-N 3Å; R451-D477 VanDerWaalsContact O-N 3.12Å; K453-D477 WeakPolarHBondContact CE-OD1 3.48Å; K453-D477 IonicContact NZ-OD1 3.95Å; K453-D477 PolarHBondContact NZ-OD1 3.1Å; K453-D477 IonicContact NZ-OD2 2.72Å; K453-D477 PolarHBondContact NZ-OD2 3.34Å; D477-N559 WeakPolarHBondContact OD1-CB 3.11Å; D477-N559 PolarHBondContact OD1-ND2 3.01Å; D477-I560 VanDerWaalsContact O-CD1 3.24Å; D477-I560 WeakPolarHBondContact O-CD1 3.46Å; D477-I560 WeakPolarHBondContact O-CG1 3.46Å; D477-M574 HydrophobicContact CB-CE 3.9Å; D477-M574 HydrophobicContact CB-SD 4.1Å
478	K	95.4	Very high	92.4	Very high	65 Å²	65	41.9 Å²	41.9	28%	0.283	20%	0.196	S	C	.	.	S	Bend	trans	-102	-23.1	-175.4	-58.8	-176.1	-162.9	167.4	0	115.4	E448 Y449 F476 L498 Y595	E448-K478 WeakPolarHBondContact O-CD 3.37Å; E448-K478 WeakPolarHBondContact O-CE 3.16Å; E448-K478 PolarHBondContact O-NZ 3.08Å; Y449-K478 WeakPolarHBondContact O-CB 3.31Å; Y449-K478 WeakPolarHBondContact O-CG 3.34Å; Y449-K478 PolarHBondContact O-N 3.45Å; F476-K478 PolarHBondContact O-N 2.86Å; K478-L498 WeakPolarHBondContact O-CB 3.35Å; K478-L498 PolarHBondContact O-N 2.92Å; K478-Y595 PolarHBondContact NZ-OH 3.37Å
479	V	96.5	Very high	92.3	Very high	3 Å²	3	38.8 Å²	38.8	2%	0.018	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	156.8	-172.1	-50.2	0	0	0	0	113.7	Y449 F476 I481 I495 I496	Y449-V479 HydrophobicContact CD1-CB 4.42Å; Y449-V479 HydrophobicContact CD1-CG1 3.51Å; Y449-V479 HydrophobicContact CD1-CG2 3.98Å; Y449-V479 HydrophobicContact CD2-CG2 3.63Å; Y449-V479 HydrophobicContact CE1-CG1 3.76Å; Y449-V479 HydrophobicContact CE1-CG2 4.43Å; Y449-V479 HydrophobicContact CE2-CG2 4.11Å; Y449-V479 HydrophobicContact CG-CB 4.44Å; Y449-V479 HydrophobicContact CG-CG1 4Å; Y449-V479 HydrophobicContact CG-CG2 3.56Å; F476-V479 HydrophobicContact CB-CG2 4.27Å; F476-V479 PolarHBondContact N-O 2.83Å; V479-I481 HydrophobicContact CG2-CD1 4.31Å; V479-I481 HydrophobicContact CG2-CG1 3.78Å; V479-I495 HydrophobicContact CB-CG2 3.91Å; V479-I495 HydrophobicContact CG1-CG2 4.04Å; V479-I495 HydrophobicContact CG2-CG2 4.12Å; V479-I496 CarbonylContact C-O 3.37Å; V479-I496 VanDerWaalsContact CA-O 3.25Å; V479-I496 WeakPolarHBondContact CA-O 3.48Å
480	V	96.9	Very high	92.4	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	131.7	158	-159	0	0	0	0	108.7	I473 L475 V482 I495 I496 L498 L527 F553	I473-V480 HydrophobicContact CG2-CG1 3.43Å; I473-V480 VanDerWaalsContact CG2-CG1 3.43Å; L475-V480 HydrophobicContact CD1-CG2 3.98Å; V480-V482 HydrophobicContact CG1-CG2 4.46Å; V480-I495 WeakPolarHBondContact O-CA 3.43Å; V480-I496 HydrophobicContact CB-CB 3.98Å; V480-I496 HydrophobicContact CB-CD1 4.26Å; V480-I496 HydrophobicContact CB-CG1 4.41Å; V480-I496 HydrophobicContact CG2-CB 4.08Å; V480-I496 HydrophobicContact CG2-CG2 4.44Å; V480-I496 PolarHBondContact N-O 3.26Å; V480-I496 PolarHBondContact O-N 3.36Å; V480-L498 HydrophobicContact CG2-CD2 3.68Å; V480-L498 HydrophobicContact CG2-CG 4.25Å; V480-L527 HydrophobicContact CG2-CD1 4.03Å; V480-F553 HydrophobicContact CG1-CZ 4.25Å; V480-F553 HydrophobicContact CG2-CE1 3.45Å; V480-F553 VanDerWaalsContact CG2-CE1 3.45Å; V480-F553 HydrophobicContact CG2-CZ 3.75Å
481	I	95.8	Very high	92.6	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	118	172.4	-49.1	-175.2	0	0	0	108	L446 Y449 I473 F474 F476 V479 L492	L446-I481 HydrophobicContact CD2-CD1 3.29Å; Y449-I481 HydrophobicContact CD2-CD1 4.32Å; Y449-I481 HydrophobicContact CE2-CD1 4.45Å; I473-I481 WeakPolarHBondContact CA-O 3.26Å; F474-I481 HydrophobicContact CB-CB 4.28Å; F474-I481 PolarHBondContact N-O 3.29Å; F474-I481 PolarHBondContact O-N 2.89Å; F476-I481 HydrophobicContact CD2-CD1 4.09Å; F476-I481 HydrophobicContact CD2-CG1 4.43Å; F476-I481 HydrophobicContact CE2-CD1 3.94Å; V479-I481 HydrophobicContact CG2-CD1 4.31Å; V479-I481 HydrophobicContact CG2-CG1 3.78Å; I481-L492 HydrophobicContact CG2-CD1 3.45Å; I481-L492 VanDerWaalsContact CG2-CD1 3.45Å
482	V	95.3	Very high	92.5	Very high	6 Å²	6	32.5 Å²	32.5	4%	0.036	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	115.6	-177.5	-175.2	0	0	0	0	108.7	R471 I473 V480 K493 E494 I496	R471-V482 HydrophobicContact CB-CG1 4.03Å; R471-V482 HydrophobicContact CG-CG1 3.76Å; I473-V482 HydrophobicContact CD1-CB 4.2Å; I473-V482 HydrophobicContact CD1-CG1 3.88Å; I473-V482 HydrophobicContact CD1-CG2 4.07Å; V480-V482 HydrophobicContact CG1-CG2 4.46Å; V482-K493 WeakPolarHBondContact O-CA 3.4Å; V482-K493 WeakPolarHBondContact O-CB 3.22Å; V482-K493 PolarHBondContact O-N 2.88Å; V482-E494 HydrophobicContact CB-CB 4.03Å; V482-E494 HydrophobicContact CG2-CB 4.28Å; V482-E494 PolarHBondContact N-O 3.39Å; V482-E494 PolarHBondContact O-N 3.07Å; V482-E494 VanDerWaalsContact O-N 3.15Å; V482-I496 HydrophobicContact CG2-CD1 3.77Å; V482-I496 HydrophobicContact CG2-CG1 4.29Å
483	C	95.2	Very high	92.5	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	160.3	-176.5	-67.3	0	0	0	0	112.6	R471 Y472 E491	R471-C483 WeakPolarHBondContact CA-O 3.44Å; R471-C483 WeakPolarHBondContact CB-O 3.31Å; R471-C483 WeakPolarHBondContact CD-O 3.47Å; Y472-C483 PolarHBondContact N-O 2.81Å; Y472-C483 WeakPolarHBondContact O-CA 3.09Å; Y472-C483 WeakPolarHBondContact O-CB 3.28Å; Y472-C483 PolarHBondContact O-N 3.31Å; C483-E491 CarbonylContact C-O 3.59Å; C483-E491 VanDerWaalsContact CA-O 3.28Å; C483-E491 WeakPolarHBondContact CA-O 3.22Å
484	K	93.8	Very high	92.3	Very high	101 Å²	101	40.9 Å²	40.9	44%	0.439	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	123.6	165.9	-178.5	-170.9	173.1	-168.8	0	108.9	E491 K493	K484-E491 HydrophobicContact CB-CB 4.48Å; K484-E491 PolarHBondContact N-O 3.38Å; K484-E491 WeakPolarHBondContact O-CB 3.18Å; K484-E491 PolarHBondContact O-N 3.48Å; K484-K493 HydrophobicContact CB-CG 4.14Å
485	R	86.9	Confident	92.2	Very high	90 Å²	90	43.8 Å²	43.8	34%	0.34	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	136	178	-158.7	176.2	87.1	-179	19.1	111.6	F142 E457 Y490	F142-R485 VanDerWaalsContact CE2-NH1 3.33Å; E457-R485 WeakPolarHBondContact OE1-CD 3.28Å; E457-R485 IonicContact OE1-CZ 2.69Å; E457-R485 IonicContact OE1-NE 2.74Å; E457-R485 IonicContact OE1-NH1 3.72Å; E457-R485 PolarHBondContact OE1-NH1 3.32Å; E457-R485 IonicContact OE2-NH1 3.56Å; R485-Y490 HydrophobicContact CG-CD1 4.36Å; R485-Y490 HydrophobicContact CG-CE1 4.04Å
486	K	87.6	Confident	92	Very high	87 Å²	87	43.8 Å²	43.8	38%	0.378	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	72.7	174.7	-78.2	-176.4	179.5	166	0	109.6	E440 Y488 S489 E491	E440-K486 WeakPolarHBondContact OE2-CD 3.27Å; E440-K486 IonicContact OE2-NZ 3.08Å; E440-K486 PolarHBondContact OE2-NZ 2.81Å; K486-Y488 PolarHBondContact O-N 3.38Å; K486-S489 WeakPolarHBondContact CB-OG 3.43Å; K486-S489 PolarHBondContact N-O 2.93Å; K486-S489 PolarHBondContact O-N 3Å; K486-S489 PolarHBondContact O-OG 3.29Å; K486-E491 HydrophobicContact CD-CB 3.99Å; K486-E491 WeakPolarHBondContact CE-OE1 3.34Å; K486-E491 HydrophobicContact CG-CB 4.29Å; K486-E491 IonicContact NZ-OE1 2.69Å; K486-E491 PolarHBondContact NZ-OE1 3.43Å; K486-E491 IonicContact NZ-OE2 2.97Å
487	G	81.3	Confident	91.9	Very high	54 Å²	54	48.2 Å²	48.2	56%	0.557	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.5	-104.9	-172.6	0	0	0	0	0	110.6
488	Y	74.4	Confident	91.9	Very high	173 Å²	173	48.2 Å²	48.2	68%	0.678	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.2	-15.4	179.5	-58.6	-61.1	0	0	0	114.8	R121 K486	R121-Y488 HydrophobicContact CG-CE1 4.4Å; K486-Y488 PolarHBondContact O-N 3.38Å
489	S	86.4	Confident	91.8	Very high	30 Å²	30	49.6 Å²	49.6	21%	0.21	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	164.2	176.8	64.3	0	0	0	0	112.6	E440 K486	E440-S489 WeakPolarHBondContact OE1-CB 3.44Å; E440-S489 PolarHBondContact OE1-OG 2.88Å; K486-S489 WeakPolarHBondContact CB-OG 3.43Å; K486-S489 PolarHBondContact N-O 2.93Å; K486-S489 PolarHBondContact O-N 3Å; K486-S489 PolarHBondContact O-OG 3.29Å
490	Y	92.8	Very high	91.6	Very high	2 Å²	2	51.9 Å²	51.9	1%	0.008	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	113.8	179.7	-60.1	-77.2	0	0	0	110.4	F114 S438 I439 E440 Y472 F474 R485 L492	F114-Y490 AromaticContact CD2-CE2 3.87Å; F114-Y490 HydrophobicContact CD2-CE2 3.87Å; F114-Y490 AromaticContact CE2-CE2 3.99Å; F114-Y490 HydrophobicContact CE2-CE2 3.99Å; S438-Y490 PolarHBondContact O-N 2.89Å; S438-Y490 WeakPolarHBondContact OG-CD2 3.49Å; I439-Y490 CarbonylContact C-O 3.08Å; I439-Y490 VanDerWaalsContact CA-O 3.31Å; I439-Y490 WeakPolarHBondContact CA-O 3.44Å; E440-Y490 PolarHBondContact N-O 3.44Å; Y472-Y490 AromaticContact CD1-CD1 3.85Å; Y472-Y490 HydrophobicContact CD1-CD1 3.85Å; Y472-Y490 AromaticContact CD1-CE1 3.57Å; Y472-Y490 HydrophobicContact CD1-CE1 3.57Å; Y472-Y490 HydrophobicContact CD2-CD1 4.34Å; Y472-Y490 AromaticContact CD2-CE1 3.56Å; Y472-Y490 HydrophobicContact CD2-CE1 3.56Å; Y472-Y490 AromaticContact CE1-CE1 3.92Å; Y472-Y490 HydrophobicContact CE1-CE1 3.92Å; Y472-Y490 AromaticContact CE2-CE1 3.93Å; Y472-Y490 HydrophobicContact CE2-CE1 3.93Å; Y472-Y490 AromaticContact CG-CD1 3.73Å; Y472-Y490 HydrophobicContact CG-CD1 3.73Å; Y472-Y490 AromaticContact CG-CE1 3.37Å; Y472-Y490 HydrophobicContact CG-CE1 3.37Å; F474-Y490 HydrophobicContact CE2-CD1 4.42Å; F474-Y490 HydrophobicContact CE2-CD2 4.26Å; F474-Y490 HydrophobicContact CE2-CG 4.07Å; F474-Y490 HydrophobicContact CZ-CD1 4.43Å; F474-Y490 AromaticContact CZ-CD2 3.78Å; F474-Y490 HydrophobicContact CZ-CD2 3.78Å; F474-Y490 AromaticContact CZ-CE2 3.94Å; F474-Y490 HydrophobicContact CZ-CE2 3.94Å; F474-Y490 HydrophobicContact CZ-CG 4.03Å; R485-Y490 HydrophobicContact CG-CD1 4.36Å; R485-Y490 HydrophobicContact CG-CE1 4.04Å; Y490-L492 PolarHBondContact O-N 3.2Å
491	E	93.9	Very high	91.4	Very high	35 Å²	35	53.4 Å²	53.4	16%	0.164	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	115	177.2	-179.2	-178.1	-126.9	0	0	110.6	C483 K484 K486 K493	C483-E491 CarbonylContact C-O 3.59Å; C483-E491 VanDerWaalsContact CA-O 3.28Å; C483-E491 WeakPolarHBondContact CA-O 3.22Å; K484-E491 HydrophobicContact CB-CB 4.48Å; K484-E491 PolarHBondContact N-O 3.38Å; K484-E491 WeakPolarHBondContact O-CB 3.18Å; K484-E491 PolarHBondContact O-N 3.48Å; K486-E491 HydrophobicContact CD-CB 3.99Å; K486-E491 WeakPolarHBondContact CE-OE1 3.34Å; K486-E491 HydrophobicContact CG-CB 4.29Å; K486-E491 IonicContact NZ-OE1 2.69Å; K486-E491 PolarHBondContact NZ-OE1 3.43Å; K486-E491 IonicContact NZ-OE2 2.97Å; E491-K493 IonicContact OE1-NZ 3.14Å; E491-K493 WeakPolarHBondContact OE2-CE 3.39Å; E491-K493 IonicContact OE2-NZ 2.71Å; E491-K493 PolarHBondContact OE2-NZ 2.7Å
492	L	94.6	Very high	91.3	Very high	33 Å²	33	58.9 Å²	58.9	17%	0.173	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.8	140.2	176.7	-176.6	61.1	0	0	0	112.2	I439 E440 L442 I481 Y490 I495	I439-L492 HydrophobicContact CG2-CB 4.21Å; E440-L492 VanDerWaalsContact O-CB 3.31Å; E440-L492 WeakPolarHBondContact O-CB 3.44Å; E440-L492 PolarHBondContact O-N 3.48Å; L442-L492 HydrophobicContact CD1-CD2 4.28Å; I481-L492 HydrophobicContact CG2-CD1 3.45Å; I481-L492 VanDerWaalsContact CG2-CD1 3.45Å; Y490-L492 PolarHBondContact O-N 3.2Å; L492-I495 HydrophobicContact CD1-CD1 4.43Å; L492-I495 HydrophobicContact CD1-CG1 3.92Å; L492-I495 HydrophobicContact CD2-CD1 4.15Å; L492-I495 HydrophobicContact CD2-CG1 4.38Å
493	K	93.2	Very high	91.2	Very high	98 Å²	98	60 Å²	60	43%	0.426	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	-41.9	176.3	-63.5	-63.6	164.2	-157.3	0	114.5	V482 K484 E491	V482-K493 WeakPolarHBondContact O-CA 3.4Å; V482-K493 WeakPolarHBondContact O-CB 3.22Å; V482-K493 PolarHBondContact O-N 2.88Å; K484-K493 HydrophobicContact CB-CG 4.14Å; E491-K493 IonicContact OE1-NZ 3.14Å; E491-K493 WeakPolarHBondContact OE2-CE 3.39Å; E491-K493 IonicContact OE2-NZ 2.71Å; E491-K493 PolarHBondContact OE2-NZ 2.7Å
494	E	92.2	Very high	91.1	Very high	79 Å²	79	62.4 Å²	62.4	37%	0.369	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	146.8	-179.8	-161.2	117.4	-106.5	0	0	109.6	V482 I496 Q534 F536	V482-E494 HydrophobicContact CB-CB 4.03Å; V482-E494 HydrophobicContact CG2-CB 4.28Å; V482-E494 PolarHBondContact N-O 3.39Å; V482-E494 PolarHBondContact O-N 3.07Å; V482-E494 VanDerWaalsContact O-N 3.15Å; E494-I496 HydrophobicContact CG-CG1 4.27Å; E494-Q534 PolarHBondContact OE2-NE2 3.37Å; E494-F536 HydrophobicContact CG-CE1 4.31Å; E494-F536 HydrophobicContact CG-CZ 3.96Å; E494-F536 WeakPolarHBondContact OE2-CE1 3.36Å; E494-F536 VanDerWaalsContact OE2-CZ 3.25Å; E494-F536 WeakPolarHBondContact OE2-CZ 3.43Å
495	I	94.2	Very high	90.9	Very high	62 Å²	62	60.9 Å²	60.9	32%	0.318	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	127.1	168	-58.4	-179.1	0	0	0	107.3	L442 V479 V480 L492	L442-I495 HydrophobicContact CD1-CD1 4.24Å; V479-I495 HydrophobicContact CB-CG2 3.91Å; V479-I495 HydrophobicContact CG1-CG2 4.04Å; V479-I495 HydrophobicContact CG2-CG2 4.12Å; V480-I495 WeakPolarHBondContact O-CA 3.43Å; L492-I495 HydrophobicContact CD1-CD1 4.43Å; L492-I495 HydrophobicContact CD1-CG1 3.92Å; L492-I495 HydrophobicContact CD2-CD1 4.15Å; L492-I495 HydrophobicContact CD2-CG1 4.38Å
496	I	94.3	Very high	90.7	Very high	1 Å²	1	57.1 Å²	57.1	1%	0.005	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	103.4	-174	-53.1	174.1	0	0	0	108.5	V479 V480 V482 E494 L498 Y501 L527 F536 F538	V479-I496 CarbonylContact C-O 3.37Å; V479-I496 VanDerWaalsContact CA-O 3.25Å; V479-I496 WeakPolarHBondContact CA-O 3.48Å; V480-I496 HydrophobicContact CB-CB 3.98Å; V480-I496 HydrophobicContact CB-CD1 4.26Å; V480-I496 HydrophobicContact CB-CG1 4.41Å; V480-I496 HydrophobicContact CG2-CB 4.08Å; V480-I496 HydrophobicContact CG2-CG2 4.44Å; V480-I496 PolarHBondContact N-O 3.26Å; V480-I496 PolarHBondContact O-N 3.36Å; V482-I496 HydrophobicContact CG2-CD1 3.77Å; V482-I496 HydrophobicContact CG2-CG1 4.29Å; E494-I496 HydrophobicContact CG-CG1 4.27Å; I496-L498 PolarHBondContact O-N 3.11Å; I496-L498 VanDerWaalsContact O-N 3.11Å; I496-Y501 HydrophobicContact CG2-CD1 4.45Å; I496-Y501 HydrophobicContact CG2-CD2 3.76Å; I496-Y501 HydrophobicContact CG2-CE1 4.15Å; I496-Y501 HydrophobicContact CG2-CE2 3.42Å; I496-Y501 VanDerWaalsContact CG2-CE2 3.42Å; I496-Y501 HydrophobicContact CG2-CG 4.29Å; I496-L527 HydrophobicContact CG2-CD1 4.29Å; I496-F536 HydrophobicContact CD1-CD1 4.05Å; I496-F536 HydrophobicContact CD1-CD2 3.69Å; I496-F536 HydrophobicContact CD1-CE1 3.97Å; I496-F536 HydrophobicContact CD1-CE2 3.63Å; I496-F536 HydrophobicContact CD1-CG 3.9Å; I496-F536 HydrophobicContact CD1-CZ 3.76Å; I496-F536 HydrophobicContact CG1-CD2 4.36Å; I496-F536 HydrophobicContact CG1-CE2 3.84Å; I496-F536 HydrophobicContact CG1-CZ 3.93Å; I496-F536 HydrophobicContact CG2-CD2 4.46Å; I496-F536 HydrophobicContact CG2-CE2 4.25Å; I496-F538 HydrophobicContact CD1-CZ 4.11Å
497	E	94.8	Very high	89.9	Confident	92 Å²	92	57.4 Å²	57.4	43%	0.43	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	103.5	174.6	-77.8	-176.1	-132.6	0	0	111.9	Q499 L500 Y501	E497-Q499 HydrophobicContact CB-CG 4.34Å; E497-Q499 PolarHBondContact O-N 2.91Å; E497-Q499 PolarHBondContact OE2-NE2 3.26Å; E497-L500 HydrophobicContact CB-CD1 4.16Å; E497-L500 HydrophobicContact CB-CG 4.17Å; E497-L500 PolarHBondContact O-N 2.95Å; E497-Y501 WeakPolarHBondContact O-CD2 3.33Å
498	L	94.9	Very high	88.8	Confident	2 Å²	2	61.8 Å²	61.8	1%	0.01	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-57.2	-29.1	-175.5	-70.5	170.3	0	0	0	113.3	L475 F476 K478 V480 I496 L500 Y501 F553 A556 M557 I560	L475-L498 HydrophobicContact CD1-CD1 3.92Å; L475-L498 HydrophobicContact CD1-CD2 4.5Å; F476-L498 WeakPolarHBondContact O-CD1 3.39Å; K478-L498 WeakPolarHBondContact O-CB 3.35Å; K478-L498 PolarHBondContact O-N 2.92Å; V480-L498 HydrophobicContact CG2-CD2 3.68Å; V480-L498 HydrophobicContact CG2-CG 4.25Å; I496-L498 PolarHBondContact O-N 3.11Å; I496-L498 VanDerWaalsContact O-N 3.11Å; L498-L500 PolarHBondContact O-N 3.42Å; L498-L500 VanDerWaalsContact O-N 3.08Å; L498-Y501 PolarHBondContact O-N 3.23Å; L498-Y501 VanDerWaalsContact O-N 3.14Å; L498-F553 HydrophobicContact CD2-CD1 3.82Å; L498-F553 HydrophobicContact CD2-CE1 3.71Å; L498-A556 HydrophobicContact CD1-CB 3.86Å; L498-M557 HydrophobicContact CD2-CE 3.84Å; L498-I560 HydrophobicContact CB-CD1 3.42Å; L498-I560 VanDerWaalsContact CB-CD1 3.42Å; L498-I560 HydrophobicContact CD1-CD1 4.36Å
499	Q	92.5	Very high	87.8	Confident	93 Å²	93	56.8 Å²	56.8	44%	0.435	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-58.7	-22.3	177.5	69.7	165.7	-12.4	0	0	114.2	E497 I560 K561	E497-Q499 HydrophobicContact CB-CG 4.34Å; E497-Q499 PolarHBondContact O-N 2.91Å; E497-Q499 PolarHBondContact OE2-NE2 3.26Å; Q499-I560 HydrophobicContact CB-CG2 4.08Å; Q499-K561 PolarHBondContact O-NZ 3.32Å
500	L	92.5	Very high	86	Confident	52 Å²	52	58.9 Å²	58.9	27%	0.272	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-96.3	-2.9	-176.9	-57.5	-176.7	0	0	0	113.7	E497 L498 L530	E497-L500 HydrophobicContact CB-CD1 4.16Å; E497-L500 HydrophobicContact CB-CG 4.17Å; E497-L500 PolarHBondContact O-N 2.95Å; L498-L500 PolarHBondContact O-N 3.42Å; L498-L500 VanDerWaalsContact O-N 3.08Å; L500-L530 WeakPolarHBondContact O-CB 3.35Å; L500-L530 WeakPolarHBondContact O-CG 3.28Å; L500-L530 PolarHBondContact O-N 2.91Å
501	Y	93.8	Very high	83.9	Confident	31 Å²	31	69.8 Å²	69.8	12%	0.122	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	163.9	-175.5	-64.4	-104.3	0	0	0	111.3	I496 E497 L498 L527 I528 H529 Q534 F536	I496-Y501 HydrophobicContact CG2-CD1 4.45Å; I496-Y501 HydrophobicContact CG2-CD2 3.76Å; I496-Y501 HydrophobicContact CG2-CE1 4.15Å; I496-Y501 HydrophobicContact CG2-CE2 3.42Å; I496-Y501 VanDerWaalsContact CG2-CE2 3.42Å; I496-Y501 HydrophobicContact CG2-CG 4.29Å; E497-Y501 WeakPolarHBondContact O-CD2 3.33Å; L498-Y501 PolarHBondContact O-N 3.23Å; L498-Y501 VanDerWaalsContact O-N 3.14Å; Y501-L527 HydrophobicContact CD1-CB 3.94Å; Y501-L527 HydrophobicContact CG-CB 4.45Å; Y501-I528 CarbonylContact C-O 3.57Å; Y501-I528 WeakPolarHBondContact CA-O 3.33Å; Y501-H529 HydrophobicContact CD1-CB 3.96Å; Y501-H529 HydrophobicContact CE1-CB 3.69Å; Y501-H529 AromaticContact CE2-CD2 3.88Å; Y501-H529 AromaticContact CZ-CD2 3.64Å; Y501-Q534 WeakPolarHBondContact CE1-O 3.44Å; Y501-F536 AromaticContact CE1-CD2 3.96Å; Y501-F536 HydrophobicContact CE1-CD2 3.96Å; Y501-F536 HydrophobicContact CE1-CE2 4.02Å
502	K	92.9	Very high	81.6	Confident	115 Å²	115	74.8 Å²	74.8	50%	0.5	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	144.5	159.2	60.1	176	-175.4	170.4	0	109	I528 L530	K502-I528 HydrophobicContact CG-CB 4.05Å; K502-I528 PolarHBondContact N-O 3.14Å; K502-I528 PolarHBondContact O-N 2.77Å; K502-L530 HydrophobicContact CB-CD2 4.04Å; K502-L530 HydrophobicContact CD-CD2 4.33Å; K502-L530 HydrophobicContact CG-CD2 4.11Å
503	M	94.1	Very high	79.4	Confident	31 Å²	31	78.8 Å²	78.8	15%	0.153	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	152.3	166.5	-163.6	173.5	70.8	0	0	110.3	F525 Y526 L527 M550 F553 E554 M557	M503-F525 HydrophobicContact CG-CD2 4.11Å; M503-F525 HydrophobicContact SD-CD2 4.07Å; M503-F525 HydrophobicContact SD-CE2 4.39Å; M503-Y526 CarbonylContact C-O 3.57Å; M503-Y526 WeakPolarHBondContact CA-O 3.48Å; M503-L527 HydrophobicContact CB-CD2 4.19Å; M503-L527 HydrophobicContact CG-CD2 4.27Å; M503-M550 HydrophobicContact CE-CB 3.76Å; M503-M550 HydrophobicContact CE-CE 3.82Å; M503-M550 HydrophobicContact CE-CG 3.99Å; M503-M550 HydrophobicContact SD-CB 4.02Å; M503-M550 HydrophobicContact SD-CG 3.84Å; M503-F553 HydrophobicContact SD-CB 3.58Å; M503-F553 VanDerWaalsContact SD-CB 3.58Å; M503-F553 HydrophobicContact SD-CG 4.21Å; M503-E554 HydrophobicContact CE-CG 3.54Å; M503-E554 WeakPolarHBondContact CE-OE1 3.4Å; M503-M557 HydrophobicContact CB-CE 4.19Å; M503-M557 HydrophobicContact CB-SD 4.37Å
504	S	92.2	Very high	77	Confident	50 Å²	50	84 Å²	84	35%	0.35	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	141.3	167.2	-179.8	0	0	0	0	108.8	Y526	S504-Y526 PolarHBondContact N-O 3.39Å; S504-Y526 PolarHBondContact O-N 2.72Å
505	D	90.4	Very high	74.5	Confident	69 Å²	69	90 Å²	90	37%	0.369	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	156.1	170.5	-166.5	17.5	0	0	0	111.7	P507 K546 M550	D505-P507 WeakPolarHBondContact O-CD 3.46Å; D505-K546 WeakPolarHBondContact OD1-CE 3.38Å; D505-K546 IonicContact OD1-NZ 3.17Å; D505-K546 PolarHBondContact OD1-NZ 3.02Å; D505-K546 IonicContact OD2-NZ 3.48Å; D505-M550 HydrophobicContact CB-CE 3.98Å
506	D	82.9	Confident	71.9	Confident	11 Å²	11	90 Å²	90	6%	0.059	44%	0.438	C	S	.	.			trans	-109	96.6	163.5	-176.6	6.9	0	0	0	110.5	M508 Y526 Q537	D506-M508 VanDerWaalsContact C-N 3.3Å; D506-M508 PolarHBondContact O-N 2.75Å; D506-M508 VanDerWaalsContact OD1-CB 3.29Å; D506-M508 WeakPolarHBondContact OD1-CB 3.43Å; D506-M508 PolarHBondContact OD1-N 2.99Å; D506-Y526 HydrophobicContact CB-CD2 4.01Å; D506-Y526 HydrophobicContact CB-CE2 3.61Å; D506-Q537 PolarHBondContact OD2-NE2 3.14Å
507	P	69.4	Low	69.4	Low	92 Å²	92	96.5 Å²	96.5	60%	0.597	48%	0.484	S	S	*	.			trans	-81.2	-3.3	177.6	33.4	-36.3	0	0	0	113.7	D505	D505-P507 WeakPolarHBondContact O-CD 3.46Å
508	M	57.6	Low	67.1	Low	147 Å²	147	95.1 Å²	95.1	72%	0.724	50%	0.495	S	S	*	.	S	Bend	trans	-73.9	-32.2	-168.1	-70	-81.8	-76.8	0	0	113.5	D506 N510	D506-M508 VanDerWaalsContact C-N 3.3Å; D506-M508 PolarHBondContact O-N 2.75Å; D506-M508 VanDerWaalsContact OD1-CB 3.29Å; D506-M508 WeakPolarHBondContact OD1-CB 3.43Å; D506-M508 PolarHBondContact OD1-N 2.99Å; M508-N510 PolarHBondContact O-N 3.07Å
509	N	54.3	Low	65.2	Low	67 Å²	67	102 Å²	102	36%	0.358	53%	0.525	S	S	.	.	G	3₁₀ helix	trans	-74.9	-17.9	-174.4	-74.2	-32.6	0	0	0	114.7	R511 S522	N509-R511 PolarHBondContact O-N 3.48Å; N509-R511 VanDerWaalsContact O-N 3.16Å; N509-S522 PolarHBondContact ND2-O 2.93Å
510	N	49.4	Very low	63.8	Low	74 Å²	74	102.3 Å²	102.3	40%	0.396	53%	0.527	S	S	.	.	G	3₁₀ helix	trans	-73.6	-1.8	-179.9	-80	4.5	0	0	0	114.2	M508 E543	M508-N510 PolarHBondContact O-N 3.07Å; N510-E543 PolarHBondContact ND2-OE1 3.01Å
511	R	47.8	Very low	63	Low	231 Å²	231	101.8 Å²	101.8	87%	0.872	52%	0.522	S	S	*	.	G	3₁₀ helix	trans	-89.1	-23.8	179.8	-76.7	-172.9	170.6	-174	-1.8	115.8	N509 M513	N509-R511 PolarHBondContact O-N 3.48Å; N509-R511 VanDerWaalsContact O-N 3.16Å; R511-M513 VanDerWaalsContact C-N 3.34Å
512	D	45.7	Very low	62.4	Low	140 Å²	140	101.8 Å²	101.8	75%	0.749	53%	0.526	S	S	*	.	S	Bend	trans	-89.3	3.6	179.1	-85.7	-32.5	0	0	0	113.9	K514	D512-K514 PolarHBondContact O-N 3.24Å
513	M	49.4	Very low	62	Low	117 Å²	117	98.4 Å²	98.4	58%	0.576	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-17.5	-166.3	-151.2	-176	-162.4	0	0	115.5	R511 K515 Y523	R511-M513 VanDerWaalsContact C-N 3.34Å; M513-K515 PolarHBondContact O-N 3.08Å; M513-Y523 WeakPolarHBondContact CE-OH 3.47Å
514	K	42.6	Very low	61.8	Low	209 Å²	209	97 Å²	97	91%	0.909	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	11.1	-171.8	-82.5	-169.6	173.3	-178.3	0	116.7	D512	D512-K514 PolarHBondContact O-N 3.24Å
515	K	39.9	Very low	61.9	Low	204 Å²	204	94.6 Å²	94.6	89%	0.887	49%	0.487	S	S	*	.	S	Bend	trans	-136.7	1.6	-177.3	-93.3	-171.5	175.9	-178.6	0	118.7	M513	M513-K515 PolarHBondContact O-N 3.08Å
516	S	38.3	Very low	62	Low	62 Å²	62	94.9 Å²	94.9	43%	0.434	48%	0.483	S	S	.	.			trans	-157	112.2	171.5	57.8	0	0	0	0	113	G518	S516-G518 PolarHBondContact O-N 3.1Å
517	S	41.3	Very low	62.5	Low	137 Å²	137	94.3 Å²	94.3	96%	0.958	48%	0.48	S	S	*	.	S	Bend	trans	-74.2	66	168.8	53.9	0	0	0	0	110.8
518	G	47.7	Very low	63.5	Low	64 Å²	64	92.9 Å²	92.9	66%	0.66	47%	0.467	S	S	*	.			trans	170	54.1	-170.3	0	0	0	0	0	115.4	S516	S516-G518 PolarHBondContact O-N 3.1Å
519	K	55	Low	65.2	Low	147 Å²	147	86.4 Å²	86.4	64%	0.639	44%	0.435	S	S	*	.			trans	-135.1	72.1	164.6	-73.6	-170.8	-178.4	173.5	0	110.9	S522	K519-S522 VanDerWaalsContact O-CB 3.26Å; K519-S522 WeakPolarHBondContact O-CB 2.89Å; K519-S522 PolarHBondContact O-OG 3.22Å
520	M	62.8	Low	66.8	Low	98 Å²	98	88 Å²	88	48%	0.483	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.4	150.8	159.9	-71.1	175.4	156.5	0	0	110.5	E191 S522	E191-M520 HydrophobicContact CG-CE 4.5Å; M520-S522 VanDerWaalsContact C-N 3.32Å; M520-S522 PolarHBondContact O-N 3.36Å
521	W	75.6	Confident	68.7	Low	42 Å²	42	90.9 Å²	90.9	16%	0.159	45%	0.454	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.8	31.1	179	-50.2	98.1	0	0	0	114.4	K459 K468 F539 C540 K541	K459-W521 HydrophobicContact CB-CE3 4.22Å; K459-W521 HydrophobicContact CD-CB 3.83Å; K459-W521 HydrophobicContact CD-CD2 3.86Å; K459-W521 HydrophobicContact CD-CE3 4.3Å; K459-W521 HydrophobicContact CD-CG 3.66Å; K459-W521 HydrophobicContact CG-CD2 3.91Å; K459-W521 HydrophobicContact CG-CE3 3.91Å; K459-W521 HydrophobicContact CG-CG 4.25Å; K459-W521 HydrophobicContact CG-CZ3 4.39Å; K468-W521 PolarHBondContact NZ-O 2.86Å; W521-F539 VanDerWaalsContact CE3-O 3.26Å; W521-F539 WeakPolarHBondContact CZ3-O 3.41Å; W521-C540 VanDerWaalsContact CA-O 3.29Å; W521-C540 WeakPolarHBondContact CA-O 3.42Å; W521-K541 HydrophobicContact CD2-CG 4.13Å; W521-K541 HydrophobicContact CE3-CG 4.32Å; W521-K541 HydrophobicContact CH2-CG 3.74Å; W521-K541 HydrophobicContact CZ2-CD 4.27Å; W521-K541 HydrophobicContact CZ2-CG 3.49Å; W521-K541 VanDerWaalsContact CZ2-CG 3.49Å; W521-K541 HydrophobicContact CZ3-CG 4.12Å
522	S	80.2	Confident	70.3	Confident	30 Å²	30	83.1 Å²	83.1	21%	0.21	45%	0.446	C	S	.	.			trans	-94.2	-40.2	176.1	47.8	0	0	0	0	112.9	N509 K519 M520	N509-S522 PolarHBondContact ND2-O 2.93Å; K519-S522 VanDerWaalsContact O-CB 3.26Å; K519-S522 WeakPolarHBondContact O-CB 2.89Å; K519-S522 PolarHBondContact O-OG 3.22Å; M520-S522 VanDerWaalsContact C-N 3.32Å; M520-S522 PolarHBondContact O-N 3.36Å
523	Y	85.8	Confident	72.1	Confident	44 Å²	44	82.4 Å²	82.4	17%	0.173	44%	0.436	C	S	.	.			trans	-62.6	136	173.3	-48.3	-77.9	0	0	0	110.5	M513 F539 C540 K541 T542 E543	M513-Y523 WeakPolarHBondContact CE-OH 3.47Å; Y523-F539 CarbonylContact O-C 3.6Å; Y523-F539 WeakPolarHBondContact O-CA 3.48Å; Y523-C540 PolarHBondContact O-N 3.25Å; Y523-K541 WeakPolarHBondContact CD2-O 3.47Å; Y523-T542 VanDerWaalsContact CD2-CA 3.43Å; Y523-E543 HydrophobicContact CD1-CB 3.69Å; Y523-E543 HydrophobicContact CD1-CG 4.09Å; Y523-E543 HydrophobicContact CE1-CB 3.71Å; Y523-E543 HydrophobicContact CE1-CG 4.3Å; Y523-E543 HydrophobicContact CG-CB 4.17Å
524	G	89.6	Confident	73.8	Confident	1 Å²	1	80 Å²	80	1%	0.01	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.6	176.7	-179.7	0	0	0	0	0	114.1	F538 K546	G524-F538 CarbonylContact C-O 3.59Å; G524-F538 WeakPolarHBondContact CA-O 3.18Å; G524-K546 VanDerWaalsContact O-CE 3.22Å; G524-K546 WeakPolarHBondContact O-CE 3.2Å
525	F	93.9	Very high	76.1	Confident	0 Å²	0	70.1 Å²	70.1	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	163.9	179.3	61.7	-87	0	0	0	110.6	M503 Q537 F538 K546 W549 M550 F553	M503-F525 HydrophobicContact CG-CD2 4.11Å; M503-F525 HydrophobicContact SD-CD2 4.07Å; M503-F525 HydrophobicContact SD-CE2 4.39Å; F525-Q537 WeakPolarHBondContact O-CA 3.4Å; F525-F538 HydrophobicContact CD1-CB 4.2Å; F525-F538 HydrophobicContact CD2-CB 4.38Å; F525-F538 HydrophobicContact CD2-CD2 4.4Å; F525-F538 HydrophobicContact CE1-CB 3.73Å; F525-F538 HydrophobicContact CE2-CB 3.92Å; F525-F538 AromaticContact CE2-CD2 3.87Å; F525-F538 HydrophobicContact CE2-CD2 3.87Å; F525-F538 AromaticContact CE2-CG 3.99Å; F525-F538 HydrophobicContact CE2-CG 3.99Å; F525-F538 HydrophobicContact CZ-CB 3.57Å; F525-F538 HydrophobicContact CZ-CD2 4.27Å; F525-F538 AromaticContact CZ-CG 3.9Å; F525-F538 HydrophobicContact CZ-CG 3.9Å; F525-F538 PolarHBondContact N-O 3.03Å; F525-F538 PolarHBondContact O-N 2.69Å; F525-K546 HydrophobicContact CD1-CG 4.34Å; F525-W549 HydrophobicContact CE1-CB 4.03Å; F525-W549 HydrophobicContact CZ-CB 4.12Å; F525-M550 HydrophobicContact CB-CG 4.11Å; F525-M550 HydrophobicContact CB-SD 3.88Å; F525-M550 HydrophobicContact CD1-CG 3.85Å; F525-M550 HydrophobicContact CD1-SD 4.34Å; F525-M550 HydrophobicContact CD2-CG 4.32Å; F525-M550 HydrophobicContact CE1-CG 4.34Å; F525-M550 HydrophobicContact CG-CG 3.84Å; F525-M550 HydrophobicContact CG-SD 4.25Å; F525-F553 AromaticContact CE2-CD2 3.72Å; F525-F553 HydrophobicContact CE2-CD2 3.72Å; F525-F553 AromaticContact CE2-CE2 3.62Å; F525-F553 HydrophobicContact CE2-CE2 3.62Å; F525-F553 HydrophobicContact CE2-CG 4.46Å; F525-F553 HydrophobicContact CE2-CZ 4.25Å; F525-F553 AromaticContact CZ-CD2 3.81Å; F525-F553 HydrophobicContact CZ-CD2 3.81Å; F525-F553 AromaticContact CZ-CE2 3.59Å; F525-F553 HydrophobicContact CZ-CE2 3.59Å
526	Y	92.1	Very high	78.6	Confident	75 Å²	75	60.8 Å²	60.8	29%	0.294	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	140.3	-174.8	-67.8	-75.1	0	0	0	112.8	M503 S504 D506 F536 Q537	M503-Y526 CarbonylContact C-O 3.57Å; M503-Y526 WeakPolarHBondContact CA-O 3.48Å; S504-Y526 PolarHBondContact N-O 3.39Å; S504-Y526 PolarHBondContact O-N 2.72Å; D506-Y526 HydrophobicContact CB-CD2 4.01Å; D506-Y526 HydrophobicContact CB-CE2 3.61Å; Y526-F536 WeakPolarHBondContact CA-O 3.31Å; Y526-Q537 HydrophobicContact CD1-CB 3.72Å; Y526-Q537 HydrophobicContact CD1-CG 3.75Å; Y526-Q537 HydrophobicContact CE1-CB 3.64Å; Y526-Q537 HydrophobicContact CE1-CG 3.5Å; Y526-Q537 HydrophobicContact CG-CG 4.47Å; Y526-Q537 VanDerWaalsContact OH-CD 3.31Å; Y526-Q537 PolarHBondContact OH-NE2 3.14Å; Y526-Q537 PolarHBondContact OH-OE1 2.92Å; Y526-Q537 VanDerWaalsContact OH-OE1 3.08Å
527	L	94.1	Very high	81.2	Confident	0 Å²	0	59 Å²	59	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	113.1	156.7	-65	-176	0	0	0	109	V480 I496 Y501 M503 G535 F536 F538 F553 M557	V480-L527 HydrophobicContact CG2-CD1 4.03Å; I496-L527 HydrophobicContact CG2-CD1 4.29Å; Y501-L527 HydrophobicContact CD1-CB 3.94Å; Y501-L527 HydrophobicContact CG-CB 4.45Å; M503-L527 HydrophobicContact CB-CD2 4.19Å; M503-L527 HydrophobicContact CG-CD2 4.27Å; L527-G535 VanDerWaalsContact O-CA 3.28Å; L527-G535 WeakPolarHBondContact O-CA 3.39Å; L527-F536 HydrophobicContact CB-CB 4.5Å; L527-F536 PolarHBondContact N-O 3.05Å; L527-F536 PolarHBondContact O-N 3.02Å; L527-F538 HydrophobicContact CB-CE2 4.31Å; L527-F538 HydrophobicContact CD1-CD2 4.48Å; L527-F538 HydrophobicContact CD1-CE2 3.52Å; L527-F538 HydrophobicContact CD1-CZ 3.97Å; L527-F538 HydrophobicContact CG-CD2 4.28Å; L527-F538 HydrophobicContact CG-CE2 3.7Å; L527-F553 HydrophobicContact CD1-CE1 3.65Å; L527-F553 HydrophobicContact CD1-CZ 4.1Å; L527-F553 HydrophobicContact CD2-CD1 4.07Å; L527-F553 HydrophobicContact CD2-CE1 3.99Å; L527-F553 HydrophobicContact CG-CE1 4.3Å; L527-M557 HydrophobicContact CD2-CE 3.77Å
528	I	91.4	Very high	83.7	Confident	62 Å²	62	52.5 Å²	52.5	32%	0.318	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	118.4	-175.1	-53.9	175	0	0	0	108.9	Y501 K502 L530	Y501-I528 CarbonylContact C-O 3.57Å; Y501-I528 WeakPolarHBondContact CA-O 3.33Å; K502-I528 HydrophobicContact CG-CB 4.05Å; K502-I528 PolarHBondContact N-O 3.14Å; K502-I528 PolarHBondContact O-N 2.77Å; I528-L530 PolarHBondContact O-N 2.99Å
529	H	92.1	Very high	85.8	Confident	10 Å²	10	49.9 Å²	49.9	5%	0.046	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	128.3	179.3	-173	-75.8	0	0	0	111	Y501 Q531 G532 K533 Q534	Y501-H529 HydrophobicContact CD1-CB 3.96Å; Y501-H529 HydrophobicContact CE1-CB 3.69Å; Y501-H529 AromaticContact CE2-CD2 3.88Å; Y501-H529 AromaticContact CZ-CD2 3.64Å; H529-Q531 VanDerWaalsContact C-N 3.28Å; H529-Q531 PolarHBondContact ND1-N 2.97Å; H529-Q531 PolarHBondContact O-N 3.05Å; H529-G532 PolarHBondContact O-N 3.39Å; H529-K533 HydrophobicContact CB-CB 4.24Å; H529-Q534 WeakPolarHBondContact CB-O 3.47Å
530	L	89.1	Confident	87.4	Confident	101 Å²	101	42.9 Å²	42.9	53%	0.529	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-32.6	-172.1	-66.4	171.6	0	0	0	113.4	L500 K502 I528	L500-L530 WeakPolarHBondContact O-CB 3.35Å; L500-L530 WeakPolarHBondContact O-CG 3.28Å; L500-L530 PolarHBondContact O-N 2.91Å; K502-L530 HydrophobicContact CB-CD2 4.04Å; K502-L530 HydrophobicContact CD-CD2 4.33Å; K502-L530 HydrophobicContact CG-CD2 4.11Å; I528-L530 PolarHBondContact O-N 2.99Å
531	Q	88.5	Confident	88.4	Confident	135 Å²	135	39.1 Å²	39.1	63%	0.631	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.7	13.4	174.2	-46.5	171.5	-23.7	0	0	114	H529 K533	H529-Q531 VanDerWaalsContact C-N 3.28Å; H529-Q531 PolarHBondContact ND1-N 2.97Å; H529-Q531 PolarHBondContact O-N 3.05Å; Q531-K533 PolarHBondContact O-N 2.85Å
532	G	81.4	Confident	88.7	Confident	68 Å²	68	38.1 Å²	38.1	70%	0.701	20%	0.199	S	C	*	.	S	Bend	trans	70.4	23.9	177.7	0	0	0	0	0	116.2	H529	H529-G532 PolarHBondContact O-N 3.39Å
533	K	84	Confident	88.7	Confident	125 Å²	125	40.9 Å²	40.9	54%	0.543	21%	0.208	S	C	.	.			trans	-80.4	-165.3	171.4	-55.5	-176.5	-168.5	157.5	0	110.6	H529 Q531 G535	H529-K533 HydrophobicContact CB-CB 4.24Å; Q531-K533 PolarHBondContact O-N 2.85Å; K533-G535 PolarHBondContact O-N 3.32Å
534	Q	85.5	Confident	88.4	Confident	67 Å²	67	41.2 Å²	41.2	31%	0.313	21%	0.211	S	C	.	.			trans	-45.6	126.7	172.5	175.5	167.3	-30.6	0	0	111.7	S462 E494 Y501 H529 F536	S462-Q534 PolarHBondContact OG-NE2 2.97Å; E494-Q534 PolarHBondContact OE2-NE2 3.37Å; Y501-Q534 WeakPolarHBondContact CE1-O 3.44Å; H529-Q534 WeakPolarHBondContact CB-O 3.47Å; Q534-F536 HydrophobicContact CG-CE2 4.14Å; Q534-F536 HydrophobicContact CG-CZ 4.04Å
535	G	89.6	Confident	88.2	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.221	C	C	.	.			trans	-115.1	164.4	168.8	0	0	0	0	0	110.6	I463 L527 K533	I463-G535 PolarHBondContact N-O 2.96Å; L527-G535 VanDerWaalsContact O-CA 3.28Å; L527-G535 WeakPolarHBondContact O-CA 3.39Å; K533-G535 PolarHBondContact O-N 3.32Å
536	F	92.9	Very high	88	Confident	8 Å²	8	43.6 Å²	43.6	4%	0.035	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	148.2	-175	-60.5	-93.1	0	0	0	110.6	V460 S461 E494 I496 Y501 Y526 L527 Q534 F538	V460-F536 HydrophobicContact CG1-CD1 4.09Å; S461-F536 WeakPolarHBondContact O-CA 3.5Å; E494-F536 HydrophobicContact CG-CE1 4.31Å; E494-F536 HydrophobicContact CG-CZ 3.96Å; E494-F536 WeakPolarHBondContact OE2-CE1 3.36Å; E494-F536 VanDerWaalsContact OE2-CZ 3.25Å; E494-F536 WeakPolarHBondContact OE2-CZ 3.43Å; I496-F536 HydrophobicContact CD1-CD1 4.05Å; I496-F536 HydrophobicContact CD1-CD2 3.69Å; I496-F536 HydrophobicContact CD1-CE1 3.97Å; I496-F536 HydrophobicContact CD1-CE2 3.63Å; I496-F536 HydrophobicContact CD1-CG 3.9Å; I496-F536 HydrophobicContact CD1-CZ 3.76Å; I496-F536 HydrophobicContact CG1-CD2 4.36Å; I496-F536 HydrophobicContact CG1-CE2 3.84Å; I496-F536 HydrophobicContact CG1-CZ 3.93Å; I496-F536 HydrophobicContact CG2-CD2 4.46Å; I496-F536 HydrophobicContact CG2-CE2 4.25Å; Y501-F536 AromaticContact CE1-CD2 3.96Å; Y501-F536 HydrophobicContact CE1-CD2 3.96Å; Y501-F536 HydrophobicContact CE1-CE2 4.02Å; Y526-F536 WeakPolarHBondContact CA-O 3.31Å; L527-F536 HydrophobicContact CB-CB 4.5Å; L527-F536 PolarHBondContact N-O 3.05Å; L527-F536 PolarHBondContact O-N 3.02Å; Q534-F536 HydrophobicContact CG-CE2 4.14Å; Q534-F536 HydrophobicContact CG-CZ 4.04Å; F536-F538 HydrophobicContact CB-CD2 4.4Å; F536-F538 HydrophobicContact CB-CE2 3.7Å; F536-F538 HydrophobicContact CB-CZ 4.31Å
537	Q	92.6	Very high	87.8	Confident	26 Å²	26	45.3 Å²	45.3	12%	0.121	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	126.4	167.1	-168.4	172.5	5.5	0	0	109	V460 S461 D506 F525 Y526 F539	V460-Q537 WeakPolarHBondContact CA-O 3.39Å; S461-Q537 PolarHBondContact N-O 3.21Å; S461-Q537 PolarHBondContact O-N 3.45Å; D506-Q537 PolarHBondContact OD2-NE2 3.14Å; F525-Q537 WeakPolarHBondContact O-CA 3.4Å; Y526-Q537 HydrophobicContact CD1-CB 3.72Å; Y526-Q537 HydrophobicContact CD1-CG 3.75Å; Y526-Q537 HydrophobicContact CE1-CB 3.64Å; Y526-Q537 HydrophobicContact CE1-CG 3.5Å; Y526-Q537 HydrophobicContact CG-CG 4.47Å; Y526-Q537 VanDerWaalsContact OH-CD 3.31Å; Y526-Q537 PolarHBondContact OH-NE2 3.14Å; Y526-Q537 PolarHBondContact OH-OE1 2.92Å; Y526-Q537 VanDerWaalsContact OH-OE1 3.08Å; Q537-F539 HydrophobicContact CB-CE2 4.17Å; Q537-F539 HydrophobicContact CB-CZ 4.09Å; Q537-F539 HydrophobicContact CG-CE1 3.9Å; Q537-F539 HydrophobicContact CG-CE2 3.94Å; Q537-F539 HydrophobicContact CG-CZ 3.51Å; Q537-F539 VanDerWaalsContact NE2-CE1 3.33Å
538	F	94.2	Very high	87.5	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	144.7	176.1	-65	-99.5	0	0	0	108.6	L458 K459 V460 I473 I496 G524 F525 L527 F536	L458-F538 HydrophobicContact CD1-CB 4.39Å; L458-F538 HydrophobicContact CD1-CD1 3.84Å; K459-F538 CarbonylContact O-C 3.6Å; V460-F538 HydrophobicContact CG1-CE1 4.44Å; V460-F538 HydrophobicContact CG2-CD1 3.68Å; V460-F538 HydrophobicContact CG2-CE1 3.73Å; I473-F538 HydrophobicContact CD1-CE1 4.22Å; I473-F538 HydrophobicContact CG1-CE1 4.48Å; I496-F538 HydrophobicContact CD1-CZ 4.11Å; G524-F538 CarbonylContact C-O 3.59Å; G524-F538 WeakPolarHBondContact CA-O 3.18Å; F525-F538 HydrophobicContact CD1-CB 4.2Å; F525-F538 HydrophobicContact CD2-CB 4.38Å; F525-F538 HydrophobicContact CD2-CD2 4.4Å; F525-F538 HydrophobicContact CE1-CB 3.73Å; F525-F538 HydrophobicContact CE2-CB 3.92Å; F525-F538 AromaticContact CE2-CD2 3.87Å; F525-F538 HydrophobicContact CE2-CD2 3.87Å; F525-F538 AromaticContact CE2-CG 3.99Å; F525-F538 HydrophobicContact CE2-CG 3.99Å; F525-F538 HydrophobicContact CZ-CB 3.57Å; F525-F538 HydrophobicContact CZ-CD2 4.27Å; F525-F538 AromaticContact CZ-CG 3.9Å; F525-F538 HydrophobicContact CZ-CG 3.9Å; F525-F538 PolarHBondContact N-O 3.03Å; F525-F538 PolarHBondContact O-N 2.69Å; L527-F538 HydrophobicContact CB-CE2 4.31Å; L527-F538 HydrophobicContact CD1-CD2 4.48Å; L527-F538 HydrophobicContact CD1-CE2 3.52Å; L527-F538 HydrophobicContact CD1-CZ 3.97Å; L527-F538 HydrophobicContact CG-CD2 4.28Å; L527-F538 HydrophobicContact CG-CE2 3.7Å; F536-F538 HydrophobicContact CB-CD2 4.4Å; F536-F538 HydrophobicContact CB-CE2 3.7Å; F536-F538 HydrophobicContact CB-CZ 4.31Å
539	F	91.6	Very high	87.7	Confident	8 Å²	8	45.1 Å²	45.1	4%	0.035	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	137.7	174.6	-50.7	-89.8	0	0	0	110.3	K459 K468 W521 Y523 Q537	K459-F539 HydrophobicContact CB-CB 4.27Å; K459-F539 HydrophobicContact CB-CD2 4.4Å; K459-F539 PolarHBondContact N-O 3.14Å; K459-F539 WeakPolarHBondContact O-CD2 3.5Å; K459-F539 PolarHBondContact O-N 3.47Å; K468-F539 HydrophobicContact CD-CD2 3.83Å; K468-F539 HydrophobicContact CD-CE2 3.93Å; K468-F539 HydrophobicContact CD-CG 4.15Å; K468-F539 HydrophobicContact CD-CZ 4.31Å; K468-F539 VanDerWaalsContact CE-CE1 3.47Å; K468-F539 VanDerWaalsContact CE-CZ 3.41Å; K468-F539 HydrophobicContact CG-CD2 4.01Å; K468-F539 HydrophobicContact CG-CE2 3.79Å; K468-F539 HydrophobicContact CG-CZ 4.38Å; W521-F539 VanDerWaalsContact CE3-O 3.26Å; W521-F539 WeakPolarHBondContact CZ3-O 3.41Å; Y523-F539 CarbonylContact O-C 3.6Å; Y523-F539 WeakPolarHBondContact O-CA 3.48Å; Q537-F539 HydrophobicContact CB-CE2 4.17Å; Q537-F539 HydrophobicContact CB-CZ 4.09Å; Q537-F539 HydrophobicContact CG-CE1 3.9Å; Q537-F539 HydrophobicContact CG-CE2 3.94Å; Q537-F539 HydrophobicContact CG-CZ 3.51Å; Q537-F539 VanDerWaalsContact NE2-CE1 3.33Å
540	C	89.5	Confident	87.8	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.23	C	C	.	.			trans	-114.8	157.5	-177.5	-53.6	0	0	0	0	110.1	L458 W521 Y523 N545 K546	L458-C540 HydrophobicContact CD2-CB 4.19Å; L458-C540 WeakPolarHBondContact CD2-SG 3.48Å; W521-C540 VanDerWaalsContact CA-O 3.29Å; W521-C540 WeakPolarHBondContact CA-O 3.42Å; Y523-C540 PolarHBondContact O-N 3.25Å; C540-N545 HydrophobicContact CB-CB 4.25Å; C540-K546 HydrophobicContact CB-CB 4.04Å; C540-K546 VanDerWaalsContact SG-CA 3.58Å
541	K	82.9	Confident	88	Confident	20 Å²	20	44.9 Å²	44.9	9%	0.087	22%	0.222	C	C	.	.	S	Bend	trans	-60.2	-50.8	177.3	-70.4	-169.8	-172.4	178.4	0	111.8	D146 E191 D195 W521 Y523	D146-K541 IonicContact OD2-NZ 2.85Å; D146-K541 PolarHBondContact OD2-NZ 3.23Å; E191-K541 IonicContact OE1-NZ 3.68Å; E191-K541 PolarHBondContact OE1-NZ 2.9Å; D195-K541 IonicContact OD1-NZ 2.72Å; D195-K541 WeakPolarHBondContact OD2-CD 3.48Å; D195-K541 IonicContact OD2-NZ 3.17Å; W521-K541 HydrophobicContact CD2-CG 4.13Å; W521-K541 HydrophobicContact CE3-CG 4.32Å; W521-K541 HydrophobicContact CH2-CG 3.74Å; W521-K541 HydrophobicContact CZ2-CD 4.27Å; W521-K541 HydrophobicContact CZ2-CG 3.49Å; W521-K541 VanDerWaalsContact CZ2-CG 3.49Å; W521-K541 HydrophobicContact CZ3-CG 4.12Å; Y523-K541 WeakPolarHBondContact CD2-O 3.47Å
542	T	80.9	Confident	88.3	Confident	21 Å²	21	40.6 Å²	40.6	13%	0.129	20%	0.203	C	C	.	.	S	Bend	trans	-122.1	167.4	-177.1	50.2	0	0	0	0	113.8	D195 E196 Y523 N545 K546	D195-T542 HydrophobicContact CB-CG2 3.46Å; D195-T542 VanDerWaalsContact CB-CG2 3.46Å; D195-T542 WeakPolarHBondContact O-CB 3.29Å; D195-T542 PolarHBondContact O-OG1 2.94Å; E196-T542 HydrophobicContact CG-CG2 4.38Å; Y523-T542 VanDerWaalsContact CD2-CA 3.43Å; T542-N545 WeakPolarHBondContact OG1-CB 3.3Å; T542-N545 PolarHBondContact OG1-N 3.34Å; T542-K546 PolarHBondContact O-N 3.36Å; T542-K546 VanDerWaalsContact O-N 3.09Å
543	E	81.9	Confident	89	Confident	88 Å²	88	37.4 Å²	37.4	41%	0.411	17%	0.169	S	C	.	.	H	α-helix	trans	-68.5	-36.3	176.7	-165.6	158.4	-131.1	0	0	112.2	N510 Y523 K546 R547	N510-E543 PolarHBondContact ND2-OE1 3.01Å; Y523-E543 HydrophobicContact CD1-CB 3.69Å; Y523-E543 HydrophobicContact CD1-CG 4.09Å; Y523-E543 HydrophobicContact CE1-CB 3.71Å; Y523-E543 HydrophobicContact CE1-CG 4.3Å; Y523-E543 HydrophobicContact CG-CB 4.17Å; E543-K546 WeakPolarHBondContact O-CB 3.33Å; E543-K546 PolarHBondContact O-N 2.78Å; E543-R547 PolarHBondContact O-N 3.37Å
544	E	79.6	Confident	89.5	Confident	50 Å²	50	36.8 Å²	36.8	23%	0.234	17%	0.168	C	C	.	.	H	α-helix	trans	-64.2	-45.8	174.4	171.9	55.5	-164.6	0	0	111.6	K546 R547 K548	E544-K546 VanDerWaalsContact C-N 3.33Å; E544-K546 PolarHBondContact O-N 2.72Å; E544-R547 VanDerWaalsContact CD-NH2 3.27Å; E544-R547 WeakPolarHBondContact O-CB 3.43Å; E544-R547 PolarHBondContact O-N 3.48Å; E544-R547 VanDerWaalsContact O-N 3.12Å; E544-R547 IonicContact OE1-CZ 2.71Å; E544-R547 IonicContact OE1-NE 2.62Å; E544-R547 IonicContact OE1-NH2 2.79Å; E544-R547 PolarHBondContact OE1-NH2 2.92Å; E544-R547 IonicContact OE2-CZ 2.94Å; E544-R547 VanDerWaalsContact OE2-CZ 3.31Å; E544-R547 IonicContact OE2-NE 3.58Å; E544-R547 PolarHBondContact OE2-NE 3.46Å; E544-R547 IonicContact OE2-NH2 3.07Å; E544-R547 PolarHBondContact OE2-NH2 3.48Å; E544-K548 WeakPolarHBondContact O-CG 3.44Å; E544-K548 PolarHBondContact O-N 3.19Å; E544-K548 WeakPolarHBondContact OE1-CE 3.32Å
545	N	84.5	Confident	89.9	Confident	38 Å²	38	38.2 Å²	38.2	20%	0.203	18%	0.176	C	C	.	.	H	α-helix	trans	-60.3	-42.6	174.4	-170.4	-19.5	0	0	0	110.9	C540 T542 R547 K548 W549	C540-N545 HydrophobicContact CB-CB 4.25Å; T542-N545 WeakPolarHBondContact OG1-CB 3.3Å; T542-N545 PolarHBondContact OG1-N 3.34Å; N545-R547 PolarHBondContact O-N 2.96Å; N545-K548 PolarHBondContact O-N 3.1Å; N545-W549 VanDerWaalsContact O-CD1 3.31Å; N545-W549 PolarHBondContact O-N 3.18Å; N545-W549 VanDerWaalsContact O-N 3.1Å; N545-W549 PolarHBondContact OD1-NE1 2.74Å
546	K	89.4	Confident	90.1	Very high	14 Å²	14	38.2 Å²	38.2	6%	0.061	18%	0.176	C	C	.	.	H	α-helix	trans	-55.7	-48.5	170.7	166.1	-171	168.5	-171.9	0	112.1	D505 G524 F525 C540 T542 E543 E544 W549 M550	D505-K546 WeakPolarHBondContact OD1-CE 3.38Å; D505-K546 IonicContact OD1-NZ 3.17Å; D505-K546 PolarHBondContact OD1-NZ 3.02Å; D505-K546 IonicContact OD2-NZ 3.48Å; G524-K546 VanDerWaalsContact O-CE 3.22Å; G524-K546 WeakPolarHBondContact O-CE 3.2Å; F525-K546 HydrophobicContact CD1-CG 4.34Å; C540-K546 HydrophobicContact CB-CB 4.04Å; C540-K546 VanDerWaalsContact SG-CA 3.58Å; T542-K546 PolarHBondContact O-N 3.36Å; T542-K546 VanDerWaalsContact O-N 3.09Å; E543-K546 WeakPolarHBondContact O-CB 3.33Å; E543-K546 PolarHBondContact O-N 2.78Å; E544-K546 VanDerWaalsContact C-N 3.33Å; E544-K546 PolarHBondContact O-N 2.72Å; K546-W549 PolarHBondContact O-N 3.38Å; K546-M550 HydrophobicContact CD-SD 4.31Å; K546-M550 WeakPolarHBondContact CE-SD 3.03Å; K546-M550 HydrophobicContact CG-CG 4.45Å; K546-M550 HydrophobicContact CG-SD 3.78Å; K546-M550 WeakPolarHBondContact O-CG 3.22Å; K546-M550 PolarHBondContact O-N 3.36Å
547	R	88.3	Confident	90.2	Very high	110 Å²	110	39.6 Å²	39.6	42%	0.415	18%	0.183	S	C	.	.	H	α-helix	trans	-57.2	-50.6	179.1	-174.9	-173.4	68.6	80.8	2.3	111.1	E543 E544 N545 W549 M550 E551	E543-R547 PolarHBondContact O-N 3.37Å; E544-R547 VanDerWaalsContact CD-NH2 3.27Å; E544-R547 WeakPolarHBondContact O-CB 3.43Å; E544-R547 PolarHBondContact O-N 3.48Å; E544-R547 VanDerWaalsContact O-N 3.12Å; E544-R547 IonicContact OE1-CZ 2.71Å; E544-R547 IonicContact OE1-NE 2.62Å; E544-R547 IonicContact OE1-NH2 2.79Å; E544-R547 PolarHBondContact OE1-NH2 2.92Å; E544-R547 IonicContact OE2-CZ 2.94Å; E544-R547 VanDerWaalsContact OE2-CZ 3.31Å; E544-R547 IonicContact OE2-NE 3.58Å; E544-R547 PolarHBondContact OE2-NE 3.46Å; E544-R547 IonicContact OE2-NH2 3.07Å; E544-R547 PolarHBondContact OE2-NH2 3.48Å; N545-R547 PolarHBondContact O-N 2.96Å; R547-W549 PolarHBondContact O-N 3.08Å; R547-M550 PolarHBondContact O-N 2.91Å; R547-E551 VanDerWaalsContact CG-OE1 3.3Å; R547-E551 WeakPolarHBondContact CG-OE1 3.16Å; R547-E551 IonicContact CZ-OE1 3.79Å; R547-E551 IonicContact CZ-OE2 2.75Å; R547-E551 IonicContact NH1-OE1 2.72Å; R547-E551 PolarHBondContact NH1-OE1 2.64Å; R547-E551 IonicContact NH1-OE2 2.86Å; R547-E551 PolarHBondContact NH1-OE2 2.94Å; R547-E551 WeakPolarHBondContact O-CG 3.45Å; R547-E551 PolarHBondContact O-N 3.33Å
548	K	88.4	Confident	90.2	Very high	51 Å²	51	40.7 Å²	40.7	22%	0.222	19%	0.194	C	C	.	.	H	α-helix	trans	-56.2	-46.6	177.9	-69	-173.7	-179.6	-155.1	0	112.7	D198 E544 N545 Q552	D198-K548 PolarHBondContact O-NZ 3.46Å; D198-K548 IonicContact OD2-NZ 3.87Å; D198-K548 PolarHBondContact OD2-NZ 3.21Å; E544-K548 WeakPolarHBondContact O-CG 3.44Å; E544-K548 PolarHBondContact O-N 3.19Å; E544-K548 WeakPolarHBondContact OE1-CE 3.32Å; N545-K548 PolarHBondContact O-N 3.1Å; K548-Q552 WeakPolarHBondContact O-CG 3.33Å; K548-Q552 PolarHBondContact O-N 2.66Å; K548-Q552 VanDerWaalsContact O-N 3.16Å
549	W	94.3	Very high	90.2	Very high	7 Å²	7	42.2 Å²	42.2	3%	0.027	20%	0.202	C	C	.	.	H	α-helix	trans	-63.3	-46.4	176.5	-83.6	91	0	0	0	111.9	I454 L458 I473 L475 F525 N545 K546 R547 E551 Q552 F553	I454-W549 HydrophobicContact CD1-CD2 4.01Å; I454-W549 HydrophobicContact CD1-CG 4.22Å; I454-W549 HydrophobicContact CD1-CZ2 4.18Å; I454-W549 HydrophobicContact CG1-CD2 4.38Å; I454-W549 HydrophobicContact CG1-CH2 4.19Å; I454-W549 HydrophobicContact CG1-CZ2 3.88Å; I454-W549 HydrophobicContact CG2-CD2 4Å; I454-W549 HydrophobicContact CG2-CE3 3.56Å; I454-W549 HydrophobicContact CG2-CH2 3.98Å; I454-W549 HydrophobicContact CG2-CZ2 4.37Å; I454-W549 HydrophobicContact CG2-CZ3 3.57Å; L458-W549 HydrophobicContact CD1-CD2 3.71Å; L458-W549 HydrophobicContact CD1-CE3 3.94Å; L458-W549 HydrophobicContact CD1-CG 4.18Å; L458-W549 HydrophobicContact CD1-CH2 4.28Å; L458-W549 HydrophobicContact CD1-CZ2 4.07Å; L458-W549 HydrophobicContact CD1-CZ3 4.2Å; L458-W549 HydrophobicContact CG-CD2 4.46Å; L458-W549 HydrophobicContact CG-CZ2 4.17Å; I473-W549 HydrophobicContact CB-CH2 3.69Å; I473-W549 HydrophobicContact CB-CZ3 4.09Å; I473-W549 HydrophobicContact CG2-CH2 3.7Å; I473-W549 HydrophobicContact CG2-CZ3 3.58Å; L475-W549 HydrophobicContact CB-CZ3 4.09Å; F525-W549 HydrophobicContact CE1-CB 4.03Å; F525-W549 HydrophobicContact CZ-CB 4.12Å; N545-W549 VanDerWaalsContact O-CD1 3.31Å; N545-W549 PolarHBondContact O-N 3.18Å; N545-W549 VanDerWaalsContact O-N 3.1Å; N545-W549 PolarHBondContact OD1-NE1 2.74Å; K546-W549 PolarHBondContact O-N 3.38Å; R547-W549 PolarHBondContact O-N 3.08Å; W549-E551 PolarHBondContact O-N 2.98Å; W549-Q552 PolarHBondContact O-N 3.42Å; W549-F553 HydrophobicContact CE3-CD2 4.37Å; W549-F553 AromaticContact CE3-CE2 3.85Å; W549-F553 HydrophobicContact CE3-CE2 3.85Å; W549-F553 HydrophobicContact CZ3-CE2 4.46Å; W549-F553 VanDerWaalsContact O-CD2 3.28Å; W549-F553 WeakPolarHBondContact O-CD2 3.48Å; W549-F553 PolarHBondContact O-N 3.48Å
550	M	93.9	Very high	90.1	Very high	26 Å²	26	43.4 Å²	43.4	13%	0.128	21%	0.208	C	C	.	.	H	α-helix	trans	-59.2	-43.9	179.3	-74.6	178.6	64.6	0	0	112.3	M503 D505 F525 K546 R547 Q552 F553 E554	M503-M550 HydrophobicContact CE-CB 3.76Å; M503-M550 HydrophobicContact CE-CE 3.82Å; M503-M550 HydrophobicContact CE-CG 3.99Å; M503-M550 HydrophobicContact SD-CB 4.02Å; M503-M550 HydrophobicContact SD-CG 3.84Å; D505-M550 HydrophobicContact CB-CE 3.98Å; F525-M550 HydrophobicContact CB-CG 4.11Å; F525-M550 HydrophobicContact CB-SD 3.88Å; F525-M550 HydrophobicContact CD1-CG 3.85Å; F525-M550 HydrophobicContact CD1-SD 4.34Å; F525-M550 HydrophobicContact CD2-CG 4.32Å; F525-M550 HydrophobicContact CE1-CG 4.34Å; F525-M550 HydrophobicContact CG-CG 3.84Å; F525-M550 HydrophobicContact CG-SD 4.25Å; K546-M550 HydrophobicContact CD-SD 4.31Å; K546-M550 WeakPolarHBondContact CE-SD 3.03Å; K546-M550 HydrophobicContact CG-CG 4.45Å; K546-M550 HydrophobicContact CG-SD 3.78Å; K546-M550 WeakPolarHBondContact O-CG 3.22Å; K546-M550 PolarHBondContact O-N 3.36Å; R547-M550 PolarHBondContact O-N 2.91Å; M550-Q552 PolarHBondContact O-N 3.47Å; M550-F553 WeakPolarHBondContact O-CB 3.32Å; M550-F553 PolarHBondContact O-N 3.21Å; M550-E554 WeakPolarHBondContact O-CG 3.47Å; M550-E554 PolarHBondContact O-N 3.23Å
551	E	94.5	Very high	90	Very high	80 Å²	80	49.1 Å²	49.1	37%	0.374	23%	0.233	S	C	.	.	H	α-helix	trans	-60.9	-42.4	175.8	-73.5	169.8	-175.6	0	0	112	R547 W549 E554 M555	R547-E551 VanDerWaalsContact CG-OE1 3.3Å; R547-E551 WeakPolarHBondContact CG-OE1 3.16Å; R547-E551 IonicContact CZ-OE1 3.79Å; R547-E551 IonicContact CZ-OE2 2.75Å; R547-E551 IonicContact NH1-OE1 2.72Å; R547-E551 PolarHBondContact NH1-OE1 2.64Å; R547-E551 IonicContact NH1-OE2 2.86Å; R547-E551 PolarHBondContact NH1-OE2 2.94Å; R547-E551 WeakPolarHBondContact O-CG 3.45Å; R547-E551 PolarHBondContact O-N 3.33Å; W549-E551 PolarHBondContact O-N 2.98Å; E551-E554 PolarHBondContact O-N 3.1Å; E551-M555 VanDerWaalsContact O-CG 3.31Å; E551-M555 WeakPolarHBondContact O-CG 3.22Å; E551-M555 PolarHBondContact O-N 3.4Å
552	Q	94.7	Very high	90.2	Very high	46 Å²	46	48.6 Å²	48.6	22%	0.215	23%	0.232	C	C	.	.	H	α-helix	trans	-68.6	-33.4	175.9	-67.6	-54.6	-42.1	0	0	113.1	K453 I454 L475 K548 W549 M550 M555 A556	K453-Q552 HydrophobicContact CB-CB 4.18Å; I454-Q552 HydrophobicContact CB-CB 4.44Å; I454-Q552 HydrophobicContact CB-CG 4.18Å; I454-Q552 HydrophobicContact CG2-CB 3.68Å; I454-Q552 HydrophobicContact CG2-CG 3.95Å; L475-Q552 HydrophobicContact CD2-CB 3.92Å; K548-Q552 WeakPolarHBondContact O-CG 3.33Å; K548-Q552 PolarHBondContact O-N 2.66Å; K548-Q552 VanDerWaalsContact O-N 3.16Å; W549-Q552 PolarHBondContact O-N 3.42Å; M550-Q552 PolarHBondContact O-N 3.47Å; Q552-M555 PolarHBondContact NE2-SD 3.39Å; Q552-M555 VanDerWaalsContact NE2-SD 3.44Å; Q552-A556 WeakPolarHBondContact O-CB 3.18Å; Q552-A556 PolarHBondContact O-N 2.69Å
553	F	96.2	Very high	89.9	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-64.5	-42	170.9	-93.3	-77.8	0	0	0	112	L475 V480 L498 M503 F525 L527 W549 M550 A556 M557	L475-F553 HydrophobicContact CD1-CD1 3.9Å; L475-F553 HydrophobicContact CD1-CE1 3.65Å; L475-F553 HydrophobicContact CD1-CE2 4.46Å; L475-F553 HydrophobicContact CD1-CG 4.43Å; L475-F553 HydrophobicContact CD1-CZ 3.94Å; L475-F553 HydrophobicContact CD2-CD1 4.27Å; L475-F553 HydrophobicContact CD2-CD2 3.99Å; L475-F553 HydrophobicContact CD2-CE2 4.25Å; L475-F553 HydrophobicContact CD2-CG 3.99Å; V480-F553 HydrophobicContact CG1-CZ 4.25Å; V480-F553 HydrophobicContact CG2-CE1 3.45Å; V480-F553 VanDerWaalsContact CG2-CE1 3.45Å; V480-F553 HydrophobicContact CG2-CZ 3.75Å; L498-F553 HydrophobicContact CD2-CD1 3.82Å; L498-F553 HydrophobicContact CD2-CE1 3.71Å; M503-F553 HydrophobicContact SD-CB 3.58Å; M503-F553 VanDerWaalsContact SD-CB 3.58Å; M503-F553 HydrophobicContact SD-CG 4.21Å; F525-F553 AromaticContact CE2-CD2 3.72Å; F525-F553 HydrophobicContact CE2-CD2 3.72Å; F525-F553 AromaticContact CE2-CE2 3.62Å; F525-F553 HydrophobicContact CE2-CE2 3.62Å; F525-F553 HydrophobicContact CE2-CG 4.46Å; F525-F553 HydrophobicContact CE2-CZ 4.25Å; F525-F553 AromaticContact CZ-CD2 3.81Å; F525-F553 HydrophobicContact CZ-CD2 3.81Å; F525-F553 AromaticContact CZ-CE2 3.59Å; F525-F553 HydrophobicContact CZ-CE2 3.59Å; L527-F553 HydrophobicContact CD1-CE1 3.65Å; L527-F553 HydrophobicContact CD1-CZ 4.1Å; L527-F553 HydrophobicContact CD2-CD1 4.07Å; L527-F553 HydrophobicContact CD2-CE1 3.99Å; L527-F553 HydrophobicContact CG-CE1 4.3Å; W549-F553 HydrophobicContact CE3-CD2 4.37Å; W549-F553 AromaticContact CE3-CE2 3.85Å; W549-F553 HydrophobicContact CE3-CE2 3.85Å; W549-F553 HydrophobicContact CZ3-CE2 4.46Å; W549-F553 VanDerWaalsContact O-CD2 3.28Å; W549-F553 WeakPolarHBondContact O-CD2 3.48Å; W549-F553 PolarHBondContact O-N 3.48Å; M550-F553 WeakPolarHBondContact O-CB 3.32Å; M550-F553 PolarHBondContact O-N 3.21Å; F553-A556 PolarHBondContact O-N 3.16Å; F553-M557 HydrophobicContact CD1-CE 4.4Å; F553-M557 WeakPolarHBondContact O-CG 3.16Å; F553-M557 PolarHBondContact O-N 2.86Å
554	E	94.2	Very high	89.8	Confident	113 Å²	113	57 Å²	57	53%	0.528	27%	0.265	S	S	.	.	H	α-helix	trans	-66.7	-42.5	175.5	-73.4	176.9	-171	0	0	111.8	M503 M550 E551 A556 M557 S558	M503-E554 HydrophobicContact CE-CG 3.54Å; M503-E554 WeakPolarHBondContact CE-OE1 3.4Å; M550-E554 WeakPolarHBondContact O-CG 3.47Å; M550-E554 PolarHBondContact O-N 3.23Å; E551-E554 PolarHBondContact O-N 3.1Å; E554-A556 VanDerWaalsContact C-N 3.34Å; E554-A556 PolarHBondContact O-N 2.75Å; E554-M557 PolarHBondContact O-N 3.34Å; E554-S558 WeakPolarHBondContact O-CB 3.47Å; E554-S558 PolarHBondContact O-N 3.17Å
555	M	93.4	Very high	89.6	Confident	97 Å²	97	55.1 Å²	55.1	48%	0.478	26%	0.258	S	S	.	.	H	α-helix	trans	-58.5	-44.1	173.6	-73.6	175.7	65.8	0	0	112	E551 Q552 N559	E551-M555 VanDerWaalsContact O-CG 3.31Å; E551-M555 WeakPolarHBondContact O-CG 3.22Å; E551-M555 PolarHBondContact O-N 3.4Å; Q552-M555 PolarHBondContact NE2-SD 3.39Å; Q552-M555 VanDerWaalsContact NE2-SD 3.44Å; M555-N559 VanDerWaalsContact O-CG 3.25Å; M555-N559 PolarHBondContact O-N 3.17Å; M555-N559 VanDerWaalsContact O-N 3.12Å; M555-N559 PolarHBondContact O-ND2 3.33Å
556	A	94.9	Very high	89.4	Confident	0 Å²	0	58 Å²	58	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-62.7	-53.9	175.4	0	0	0	0	0	111.8	K453 L498 Q552 F553 E554 S558 N559 I560	K453-A556 HydrophobicContact CG-CB 4.38Å; L498-A556 HydrophobicContact CD1-CB 3.86Å; Q552-A556 WeakPolarHBondContact O-CB 3.18Å; Q552-A556 PolarHBondContact O-N 2.69Å; F553-A556 PolarHBondContact O-N 3.16Å; E554-A556 VanDerWaalsContact C-N 3.34Å; E554-A556 PolarHBondContact O-N 2.75Å; A556-S558 VanDerWaalsContact C-N 3.29Å; A556-S558 PolarHBondContact O-N 3.45Å; A556-N559 WeakPolarHBondContact O-CA 3.44Å; A556-N559 WeakPolarHBondContact O-CB 3.28Å; A556-N559 PolarHBondContact O-N 3.22Å; A556-I560 PolarHBondContact O-N 3.47Å; A556-I560 VanDerWaalsContact O-N 3.1Å
557	M	93.6	Very high	88.8	Confident	37 Å²	37	58.6 Å²	58.6	18%	0.182	29%	0.285	C	S	.	.	H	α-helix	trans	-60	-38.5	179.5	-69.6	-173.9	-173.7	0	0	112.5	L498 M503 L527 F553 E554 N559 I560 K561	L498-M557 HydrophobicContact CD2-CE 3.84Å; M503-M557 HydrophobicContact CB-CE 4.19Å; M503-M557 HydrophobicContact CB-SD 4.37Å; L527-M557 HydrophobicContact CD2-CE 3.77Å; F553-M557 HydrophobicContact CD1-CE 4.4Å; F553-M557 WeakPolarHBondContact O-CG 3.16Å; F553-M557 PolarHBondContact O-N 2.86Å; E554-M557 PolarHBondContact O-N 3.34Å; M557-N559 PolarHBondContact O-N 2.97Å; M557-I560 PolarHBondContact O-N 3.24Å; M557-K561 PolarHBondContact O-N 3.27Å
558	S	93.3	Very high	88.3	Confident	48 Å²	48	56.7 Å²	56.7	34%	0.336	28%	0.283	S	S	.	.	H	α-helix	trans	-65	-23.3	174.1	-177.9	0	0	0	0	113.2	E554 A556 P562 K609	E554-S558 WeakPolarHBondContact O-CB 3.47Å; E554-S558 PolarHBondContact O-N 3.17Å; A556-S558 VanDerWaalsContact C-N 3.29Å; A556-S558 PolarHBondContact O-N 3.45Å; S558-P562 VanDerWaalsContact O-CA 3.27Å; S558-P562 WeakPolarHBondContact O-CA 3.48Å; S558-P562 WeakPolarHBondContact O-CB 3.25Å; S558-P562 VanDerWaalsContact O-N 3.15Å; S558-K609 WeakPolarHBondContact O-CE 3.39Å; S558-K609 PolarHBondContact O-NZ 3.49Å; S558-K609 VanDerWaalsContact O-NZ 3.13Å; S558-K609 PolarHBondContact OG-NZ 3Å
559	N	93.6	Very high	87.8	Confident	32 Å²	32	60.5 Å²	60.5	17%	0.171	30%	0.301	C	S	.	.	H	α-helix	trans	-83	-36.9	172.4	-71.3	-17.3	0	0	0	112.1	D477 M555 A556 M557 M574 Y598 K609	D477-N559 WeakPolarHBondContact OD1-CB 3.11Å; D477-N559 PolarHBondContact OD1-ND2 3.01Å; M555-N559 VanDerWaalsContact O-CG 3.25Å; M555-N559 PolarHBondContact O-N 3.17Å; M555-N559 VanDerWaalsContact O-N 3.12Å; M555-N559 PolarHBondContact O-ND2 3.33Å; A556-N559 WeakPolarHBondContact O-CA 3.44Å; A556-N559 WeakPolarHBondContact O-CB 3.28Å; A556-N559 PolarHBondContact O-N 3.22Å; M557-N559 PolarHBondContact O-N 2.97Å; N559-M574 VanDerWaalsContact C-SD 3.58Å; N559-M574 HydrophobicContact CB-CE 4.08Å; N559-M574 HydrophobicContact CB-SD 3.82Å; N559-M574 WeakPolarHBondContact O-CG 3.05Å; N559-M574 VanDerWaalsContact O-SD 3.38Å; N559-Y598 WeakPolarHBondContact CA-OH 3.18Å; N559-Y598 VanDerWaalsContact O-CE1 3.3Å; N559-Y598 WeakPolarHBondContact O-CE1 3.47Å; N559-Y598 PolarHBondContact O-OH 3.23Å; N559-K609 WeakPolarHBondContact OD1-CE 3.33Å; N559-K609 PolarHBondContact OD1-NZ 2.91Å
560	I	90.9	Very high	87.3	Confident	33 Å²	33	60.4 Å²	60.4	17%	0.169	30%	0.301	C	S	.	.	H	α-helix	trans	-65.8	-43.5	174.5	-49.3	168	0	0	0	110.9	D477 L498 Q499 A556 M557	D477-I560 VanDerWaalsContact O-CD1 3.24Å; D477-I560 WeakPolarHBondContact O-CD1 3.46Å; D477-I560 WeakPolarHBondContact O-CG1 3.46Å; L498-I560 HydrophobicContact CB-CD1 3.42Å; L498-I560 VanDerWaalsContact CB-CD1 3.42Å; L498-I560 HydrophobicContact CD1-CD1 4.36Å; Q499-I560 HydrophobicContact CB-CG2 4.08Å; A556-I560 PolarHBondContact O-N 3.47Å; A556-I560 VanDerWaalsContact O-N 3.1Å; M557-I560 PolarHBondContact O-N 3.24Å
561	K	85.8	Confident	87	Confident	120 Å²	120	61.6 Å²	61.6	52%	0.522	31%	0.308	S	S	.	.	S	Bend	trans	-134.8	73.9	-174.7	-70.4	168.7	-175.4	168.3	0	110.2	Q499 M557	Q499-K561 PolarHBondContact O-NZ 3.32Å; M557-K561 PolarHBondContact O-N 3.27Å
562	P	86.9	Confident	86.8	Confident	10 Å²	10	58 Å²	58	7%	0.065	29%	0.291	C	S	.	.			trans	-61.7	145	169.9	25	-31.7	0	0	0	109.8	S558 R564 A565 Y598 K609 L612	S558-P562 VanDerWaalsContact O-CA 3.27Å; S558-P562 WeakPolarHBondContact O-CA 3.48Å; S558-P562 WeakPolarHBondContact O-CB 3.25Å; S558-P562 VanDerWaalsContact O-N 3.15Å; P562-R564 PolarHBondContact O-N 2.94Å; P562-A565 HydrophobicContact CG-CB 4.03Å; P562-A565 VanDerWaalsContact O-CB 3.29Å; P562-A565 WeakPolarHBondContact O-CB 3.47Å; P562-A565 PolarHBondContact O-N 3.1Å; P562-Y598 HydrophobicContact CG-CD1 4.21Å; P562-Y598 HydrophobicContact CG-CE1 3.58Å; P562-K609 HydrophobicContact CB-CG 4.23Å; P562-L612 HydrophobicContact CB-CD1 4.11Å; P562-L612 HydrophobicContact CG-CD1 3.59Å
563	E	75.3	Confident	86.7	Confident	173 Å²	173	60.8 Å²	60.8	81%	0.808	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.7	-33.6	-168.7	-60.4	-177.5	167.4	0	0	114.4
564	R	79.4	Confident	86.6	Confident	112 Å²	112	62.1 Å²	62.1	42%	0.423	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.6	21.5	-174	-52.2	-157.7	-163	149.2	26	113.5	P562 T566 A567 E613	P562-R564 PolarHBondContact O-N 2.94Å; R564-T566 PolarHBondContact O-N 3.46Å; R564-T566 VanDerWaalsContact O-N 3.13Å; R564-A567 HydrophobicContact CB-CB 3.88Å; R564-A567 VanDerWaalsContact O-CB 3.27Å; R564-A567 WeakPolarHBondContact O-CB 3.41Å; R564-A567 PolarHBondContact O-N 3.46Å; R564-E613 HydrophobicContact CB-CG 4.33Å; R564-E613 WeakPolarHBondContact CD-OE1 3.49Å; R564-E613 HydrophobicContact CG-CG 4.43Å; R564-E613 IonicContact CZ-OE1 3.03Å; R564-E613 IonicContact CZ-OE2 3.66Å; R564-E613 VanDerWaalsContact CZ-OE2 3.29Å; R564-E613 IonicContact NE-OE1 2.62Å; R564-E613 PolarHBondContact NE-OE1 3.46Å; R564-E613 VanDerWaalsContact NE-OE1 3.14Å; R564-E613 IonicContact NH1-OE1 3.49Å; R564-E613 PolarHBondContact NH1-OE1 3.19Å; R564-E613 IonicContact NH1-OE2 3.87Å; R564-E613 PolarHBondContact NH1-OE2 3.4Å; R564-E613 IonicContact NH2-OE1 2.76Å; R564-E613 PolarHBondContact NH2-OE1 3.18Å; R564-E613 VanDerWaalsContact NH2-OE1 3.14Å; R564-E613 IonicContact NH2-OE2 2.7Å
565	A	76.8	Confident	86.6	Confident	11 Å²	11	59.9 Å²	59.9	9%	0.091	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-28.1	175.7	0	0	0	0	0	114.6	P562 F572	P562-A565 HydrophobicContact CG-CB 4.03Å; P562-A565 VanDerWaalsContact O-CB 3.29Å; P562-A565 WeakPolarHBondContact O-CB 3.47Å; P562-A565 PolarHBondContact O-N 3.1Å; A565-F572 HydrophobicContact CB-CB 4.42Å; A565-F572 WeakPolarHBondContact O-CD2 3.16Å; A565-F572 PolarHBondContact O-N 3.24Å
566	T	80.3	Confident	86.6	Confident	99 Å²	99	57.2 Å²	57.2	61%	0.607	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.1	5.3	179.8	54.1	0	0	0	0	113.4	R564 Q569 H570	R564-T566 PolarHBondContact O-N 3.46Å; R564-T566 VanDerWaalsContact O-N 3.13Å; T566-Q569 PolarHBondContact O-N 3.2Å; T566-H570 WeakPolarHBondContact CA-O 3.46Å
567	A	76.1	Confident	86.4	Confident	26 Å²	26	58.2 Å²	58.2	22%	0.215	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-58.6	150	178.1	0	0	0	0	0	111	R564 Q569 H570	R564-A567 HydrophobicContact CB-CB 3.88Å; R564-A567 VanDerWaalsContact O-CB 3.27Å; R564-A567 WeakPolarHBondContact O-CB 3.41Å; R564-A567 PolarHBondContact O-N 3.46Å; A567-Q569 PolarHBondContact O-N 3.47Å; A567-H570 WeakPolarHBondContact O-CB 3.24Å; A567-H570 PolarHBondContact O-CD2 2.73Å; A567-H570 VanDerWaalsContact O-CD2 3.3Å; A567-H570 PolarHBondContact O-N 3.26Å
568	N	76.8	Confident	86	Confident	70 Å²	70	64 Å²	64	37%	0.374	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	52.4	32.1	177.2	-55.4	-31.7	0	0	0	113.6	H570 I615 I617 C618	N568-H570 VanDerWaalsContact C-N 3.29Å; N568-H570 PolarHBondContact O-N 3.14Å; N568-I615 PolarHBondContact ND2-O 3.3Å; N568-I617 HydrophobicContact CB-CG1 4.41Å; N568-I617 WeakPolarHBondContact O-CA 3.36Å; N568-C618 PolarHBondContact O-N 2.95Å
569	Q	79.6	Confident	85.6	Confident	131 Å²	131	69.8 Å²	69.8	61%	0.612	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	67.1	15.3	-179.1	-50.9	-177.9	7.4	0	0	116.1	T566 A567 R602 C618	T566-Q569 PolarHBondContact O-N 3.2Å; A567-Q569 PolarHBondContact O-N 3.47Å; Q569-R602 WeakPolarHBondContact O-CD 3.41Å; Q569-R602 PolarHBondContact O-NH1 3.31Å; Q569-C618 HydrophobicContact CB-CB 4.16Å; Q569-C618 WeakPolarHBondContact O-CB 3.26Å
570	H	83.2	Confident	85.2	Confident	4 Å²	4	72.4 Å²	72.4	2%	0.019	36%	0.358	C	S	.	.			trans	-72.3	176.2	172.4	-69.4	-77.4	0	0	0	112.3	T566 A567 N568 F572 C600 C603 T616 C618	T566-H570 WeakPolarHBondContact CA-O 3.46Å; A567-H570 WeakPolarHBondContact O-CB 3.24Å; A567-H570 PolarHBondContact O-CD2 2.73Å; A567-H570 VanDerWaalsContact O-CD2 3.3Å; A567-H570 PolarHBondContact O-N 3.26Å; N568-H570 VanDerWaalsContact C-N 3.29Å; N568-H570 PolarHBondContact O-N 3.14Å; H570-F572 HydrophobicContact CB-CD2 3.52Å; H570-F572 HydrophobicContact CB-CE2 3.38Å; H570-F572 HydrophobicContact CB-CG 4.47Å; H570-F572 HydrophobicContact CB-CZ 4.23Å; H570-F572 AromaticContact CD2-CE2 3.82Å; H570-F572 AromaticContact CG-CE2 3.41Å; H570-F572 VanDerWaalsContact CG-CE2 3.41Å; H570-F572 AromaticContact CG-CZ 3.94Å; H570-F572 AromaticContact ND1-CE2 3.92Å; H570-F572 AromaticContact ND1-CZ 3.96Å; H570-C600 HydrophobicContact CB-CB 4.47Å; H570-C600 PolarHBondContact ND1-SG 2.97Å; H570-C600 VanDerWaalsContact ND1-SG 3.45Å; H570-C603 VanDerWaalsContact CE1-SG 3.53Å; H570-C603 PolarHBondContact ND1-SG 3.32Å; H570-C603 VanDerWaalsContact ND1-SG 3.44Å; H570-T616 PolarHBondContact NE2-O 3.31Å; H570-C618 VanDerWaalsContact CE1-CA 3.46Å; H570-C618 WeakPolarHBondContact CE1-CA 3.29Å; H570-C618 PolarHBondContact NE2-N 3.27Å
571	N	87.6	Confident	85.2	Confident	51 Å²	51	72.6 Å²	72.6	27%	0.273	36%	0.361	S	S	.	.			trans	-146.4	76.4	168.4	-176.8	44.2	0	0	0	107.5	C600 S601 R602	N571-C600 PolarHBondContact N-SG 3.16Å; N571-C600 WeakPolarHBondContact O-CA 3.33Å; N571-S601 PolarHBondContact ND2-OG 3.24Å; N571-S601 PolarHBondContact O-N 3.39Å; N571-S601 PolarHBondContact O-OG 3.2Å; N571-R602 HydrophobicContact CB-CG 4.2Å
572	F	91.2	Very high	85.3	Confident	5 Å²	5	70.2 Å²	70.2	2%	0.022	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	133.3	-178.5	-76.9	-73.2	0	0	0	111.3	A565 H570 Y598 Y599 C600 T605 A607 L612 I615	A565-F572 HydrophobicContact CB-CB 4.42Å; A565-F572 WeakPolarHBondContact O-CD2 3.16Å; A565-F572 PolarHBondContact O-N 3.24Å; H570-F572 HydrophobicContact CB-CD2 3.52Å; H570-F572 HydrophobicContact CB-CE2 3.38Å; H570-F572 HydrophobicContact CB-CG 4.47Å; H570-F572 HydrophobicContact CB-CZ 4.23Å; H570-F572 AromaticContact CD2-CE2 3.82Å; H570-F572 AromaticContact CG-CE2 3.41Å; H570-F572 VanDerWaalsContact CG-CE2 3.41Å; H570-F572 AromaticContact CG-CZ 3.94Å; H570-F572 AromaticContact ND1-CE2 3.92Å; H570-F572 AromaticContact ND1-CZ 3.96Å; F572-Y598 HydrophobicContact CB-CD1 4.46Å; F572-Y599 WeakPolarHBondContact CA-O 3.33Å; F572-C600 HydrophobicContact CD1-CB 3.77Å; F572-C600 HydrophobicContact CE1-CB 3.63Å; F572-C600 HydrophobicContact CG-CB 4.27Å; F572-C600 HydrophobicContact CZ-CB 4.02Å; F572-T605 WeakPolarHBondContact CE1-O 3.44Å; F572-A607 HydrophobicContact CE1-CB 3.94Å; F572-A607 HydrophobicContact CZ-CB 4.38Å; F572-L612 HydrophobicContact CB-CD1 4.45Å; F572-L612 HydrophobicContact CB-CD2 4.21Å; F572-L612 HydrophobicContact CD1-CD2 3.77Å; F572-L612 HydrophobicContact CD2-CB 4.49Å; F572-L612 HydrophobicContact CD2-CD2 3.82Å; F572-L612 HydrophobicContact CE1-CD2 4.03Å; F572-L612 HydrophobicContact CE2-CD2 4.07Å; F572-L612 HydrophobicContact CG-CD2 3.68Å; F572-L612 HydrophobicContact CZ-CD2 4.19Å; F572-I615 HydrophobicContact CE1-CD1 4.29Å; F572-I615 HydrophobicContact CE2-CD1 4.35Å; F572-I615 HydrophobicContact CZ-CD1 3.62Å; F572-I615 HydrophobicContact CZ-CG2 4.41Å
573	Q	92.3	Very high	85.5	Confident	104 Å²	104	69.8 Å²	69.8	49%	0.486	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	145.6	178.8	-65.5	176.6	-21.5	0	0	109.3	H575 Y598 Y599	Q573-H575 PolarHBondContact O-N 3.16Å; Q573-Y598 CarbonylContact O-C 3.3Å; Q573-Y598 VanDerWaalsContact O-CA 3.22Å; Q573-Y598 WeakPolarHBondContact O-CA 3.41Å; Q573-Y599 PolarHBondContact N-O 2.89Å; Q573-Y599 PolarHBondContact O-N 3.48Å
574	M	94.1	Very high	86.1	Confident	29 Å²	29	68.8 Å²	68.8	14%	0.143	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.4	129.4	175.6	-65	-176.7	72.4	0	0	110.6	D477 N559 Y595 Y598	D477-M574 HydrophobicContact CB-CE 3.9Å; D477-M574 HydrophobicContact CB-SD 4.1Å; N559-M574 VanDerWaalsContact C-SD 3.58Å; N559-M574 HydrophobicContact CB-CE 4.08Å; N559-M574 HydrophobicContact CB-SD 3.82Å; N559-M574 WeakPolarHBondContact O-CG 3.05Å; N559-M574 VanDerWaalsContact O-SD 3.38Å; M574-Y595 HydrophobicContact CB-CD1 3.8Å; M574-Y595 HydrophobicContact CB-CE1 4.06Å; M574-Y595 HydrophobicContact CE-CD1 4.21Å; M574-Y595 HydrophobicContact CE-CG 4.37Å; M574-Y598 HydrophobicContact CG-CD1 4.37Å; M574-Y598 HydrophobicContact CG-CE1 3.73Å
575	H	93.8	Very high	86.5	Confident	66 Å²	66	64.9 Å²	64.9	31%	0.306	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	138.7	-170.7	-169.8	-91.8	0	0	0	112.6	Q573 F577 Y595 G597 Y599	Q573-H575 PolarHBondContact O-N 3.16Å; H575-F577 HydrophobicContact CB-CE2 3.88Å; H575-F577 HydrophobicContact CB-CZ 4.17Å; H575-F577 AromaticContact ND1-CD1 3.75Å; H575-F577 AromaticContact ND1-CD2 3.64Å; H575-F577 AromaticContact ND1-CE1 3.72Å; H575-F577 AromaticContact ND1-CE2 3.59Å; H575-F577 AromaticContact ND1-CG 3.71Å; H575-F577 AromaticContact ND1-CZ 3.64Å; H575-F577 WeakPolarHBondContact O-CD2 3.26Å; H575-Y595 WeakPolarHBondContact O-CA 3.44Å; H575-G597 PolarHBondContact N-O 2.89Å; H575-Y599 VanDerWaalsContact CB-CB 3.46Å; H575-Y599 VanDerWaalsContact CG-CB 3.46Å
576	T	93.6	Very high	87	Confident	41 Å²	41	67 Å²	67	25%	0.252	35%	0.346	S	S	.	.			trans	-93.8	125.1	169.1	-60.8	0	0	0	0	108.9	I593 Y595	T576-I593 WeakPolarHBondContact CG2-O 3.32Å; T576-Y595 PolarHBondContact OG1-N 3.25Å
577	F	91.3	Very high	87.2	Confident	21 Å²	21	68.2 Å²	68.2	9%	0.092	34%	0.342	C	S	.	.			trans	-100.5	117.3	-178.7	-64.5	-100	0	0	0	109.9	H575 K579 T581 L590 Q596 Y599	H575-F577 HydrophobicContact CB-CE2 3.88Å; H575-F577 HydrophobicContact CB-CZ 4.17Å; H575-F577 AromaticContact ND1-CD1 3.75Å; H575-F577 AromaticContact ND1-CD2 3.64Å; H575-F577 AromaticContact ND1-CE1 3.72Å; H575-F577 AromaticContact ND1-CE2 3.59Å; H575-F577 AromaticContact ND1-CG 3.71Å; H575-F577 AromaticContact ND1-CZ 3.64Å; H575-F577 WeakPolarHBondContact O-CD2 3.26Å; F577-K579 PolarHBondContact O-N 3.16Å; F577-K579 VanDerWaalsContact O-N 3.14Å; F577-T581 HydrophobicContact CD1-CG2 3.93Å; F577-T581 HydrophobicContact CE1-CG2 4.1Å; F577-L590 HydrophobicContact CD1-CD1 4.43Å; F577-L590 HydrophobicContact CD2-CD1 3.92Å; F577-L590 HydrophobicContact CE1-CD1 4.17Å; F577-L590 HydrophobicContact CE2-CD1 3.63Å; F577-L590 HydrophobicContact CG-CD1 4.33Å; F577-L590 HydrophobicContact CZ-CD1 3.76Å; F577-Q596 PolarHBondContact O-NE2 2.89Å; F577-Y599 HydrophobicContact CE1-CD2 4.15Å; F577-Y599 HydrophobicContact CZ-CD2 4.47Å
578	D	85.1	Confident	87.6	Confident	158 Å²	158	70 Å²	70	85%	0.845	35%	0.347	S	S	*	.	S	Bend	trans	-70.1	-5.9	179.3	-42.5	-57.9	0	0	0	113.7
579	K	84.8	Confident	88.2	Confident	170 Å²	170	66.9 Å²	66.9	74%	0.739	33%	0.33	S	S	*	.	S	Bend	trans	-136.2	142.6	-177.1	-64.6	-177.3	-178.5	178.8	0	110.1	F577 T581	F577-K579 PolarHBondContact O-N 3.16Å; F577-K579 VanDerWaalsContact O-N 3.14Å; K579-T581 WeakPolarHBondContact O-CB 3.37Å; K579-T581 PolarHBondContact O-N 3.05Å; K579-T581 PolarHBondContact O-OG1 3.2Å
580	N	85.4	Confident	88.7	Confident	86 Å²	86	60.8 Å²	60.8	46%	0.46	30%	0.302	S	S	.	.			trans	-47.8	112.4	171.5	-61.3	-20.5	0	0	0	109.9	L327 Y418 L589	L327-N580 VanDerWaalsContact CB-ND2 3.32Å; L327-N580 WeakPolarHBondContact CB-ND2 3.41Å; L327-N580 HydrophobicContact CD1-CB 3.81Å; L327-N580 WeakPolarHBondContact CD1-ND2 3.47Å; Y418-N580 PolarHBondContact OH-OD1 3.17Å; N580-L589 HydrophobicContact CB-CD1 4.21Å
581	T	88.9	Confident	89.1	Confident	38 Å²	38	63.4 Å²	63.4	23%	0.233	31%	0.312	C	S	.	.			trans	-130.1	125.1	-170	-64.9	0	0	0	0	109.7	F577 K579 L590	F577-T581 HydrophobicContact CD1-CG2 3.93Å; F577-T581 HydrophobicContact CE1-CG2 4.1Å; K579-T581 WeakPolarHBondContact O-CB 3.37Å; K579-T581 PolarHBondContact O-N 3.05Å; K579-T581 PolarHBondContact O-OG1 3.2Å; T581-L590 HydrophobicContact CG2-CD1 3.8Å; T581-L590 VanDerWaalsContact O-CB 3.28Å; T581-L590 WeakPolarHBondContact O-CB 3.32Å; T581-L590 VanDerWaalsContact O-CG 3.26Å; T581-L590 WeakPolarHBondContact O-CG 3.39Å; T581-L590 PolarHBondContact O-N 3.29Å
582	N	89.1	Confident	89.1	Confident	70 Å²	70	61.1 Å²	61.1	37%	0.374	30%	0.3	S	S	.	.	B	Isolated β-bridge	trans	-85.6	140.7	177.3	-60.5	68	0	0	0	111.2	R584 K587	N582-R584 PolarHBondContact O-N 2.77Å; N582-K587 PolarHBondContact ND2-O 3.47Å
583	C	90.4	Very high	89.1	Confident	1 Å²	1	63.9 Å²	63.9	1%	0.007	31%	0.314	C	S	.	.			trans	-62.1	133.3	174.6	171.4	0	0	0	0	111.6	A585 C586 K587 M588 L590 H608 C611	C583-A585 VanDerWaalsContact C-N 3.25Å; C583-A585 PolarHBondContact O-N 2.74Å; C583-A585 PolarHBondContact SG-N 2.73Å; C583-A585 VanDerWaalsContact SG-N 3.39Å; C583-C586 VanDerWaalsContact CB-SG 3.57Å; C583-K587 WeakPolarHBondContact O-CA 3.33Å; C583-K587 PolarHBondContact O-N 3.12Å; C583-M588 PolarHBondContact N-O 3.29Å; C583-L590 HydrophobicContact CB-CD2 3.91Å; C583-H608 WeakPolarHBondContact CB-CE1 3.45Å; C583-H608 WeakPolarHBondContact CB-ND1 3.47Å; C583-C611 VanDerWaalsContact SG-CB 3.56Å; C583-C611 VanDerWaalsContact SG-SG 3.68Å
584	R	89.3	Confident	89.1	Confident	152 Å²	152	59.4 Å²	59.4	57%	0.574	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-33.7	-179.4	-172.8	66.5	-175.8	-174.9	1.8	113.9	N582 K587 T605 G606 I615	N582-R584 PolarHBondContact O-N 2.77Å; R584-K587 PolarHBondContact O-NZ 3.4Å; R584-T605 HydrophobicContact CB-CG2 3.46Å; R584-T605 VanDerWaalsContact CB-CG2 3.46Å; R584-T605 HydrophobicContact CG-CG2 3.6Å; R584-G606 PolarHBondContact N-O 2.69Å; R584-I615 HydrophobicContact CB-CD1 4.31Å; R584-I615 HydrophobicContact CG-CG2 4.41Å
585	A	87.7	Confident	89.1	Confident	30 Å²	30	59.4 Å²	59.4	25%	0.248	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.5	-73.8	179.5	0	0	0	0	0	111.6	C583 K587 C611 V614 I615	C583-A585 VanDerWaalsContact C-N 3.25Å; C583-A585 PolarHBondContact O-N 2.74Å; C583-A585 PolarHBondContact SG-N 2.73Å; C583-A585 VanDerWaalsContact SG-N 3.39Å; A585-K587 PolarHBondContact O-N 3.46Å; A585-C611 HydrophobicContact CB-CB 3.94Å; A585-V614 HydrophobicContact CB-CB 4.23Å; A585-V614 HydrophobicContact CB-CG1 4.5Å; A585-I615 HydrophobicContact CB-CG1 3.97Å
586	C	86.2	Confident	89.1	Confident	56 Å²	56	57.3 Å²	57.3	38%	0.378	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-9.4	-169.1	67.7	0	0	0	0	115.4	C583 M588 H608	C583-C586 VanDerWaalsContact CB-SG 3.57Å; C586-M588 HydrophobicContact CB-CG 4.32Å; C586-M588 PolarHBondContact O-N 3.46Å; C586-H608 VanDerWaalsContact SG-CE1 3.53Å; C586-H608 PolarHBondContact SG-ND1 3.01Å; C586-H608 VanDerWaalsContact SG-ND1 3.45Å
587	K	84.7	Confident	89.1	Confident	123 Å²	123	55.7 Å²	55.7	54%	0.535	27%	0.274	S	S	.	.			trans	64.9	-8.2	-175.4	-43.9	-52.9	179.2	-168.9	0	116.3	N582 C583 R584 A585	N582-K587 PolarHBondContact ND2-O 3.47Å; C583-K587 WeakPolarHBondContact O-CA 3.33Å; C583-K587 PolarHBondContact O-N 3.12Å; R584-K587 PolarHBondContact O-NZ 3.4Å; A585-K587 PolarHBondContact O-N 3.46Å
588	M	85.7	Confident	89.3	Confident	65 Å²	65	55.2 Å²	55.2	32%	0.32	27%	0.271	S	S	.	.			trans	-65.4	158	170.9	-49.8	-54.2	-82.1	0	0	110.7	D414 C583 C586	D414-M588 HydrophobicContact CB-CE 3.67Å; C583-M588 PolarHBondContact N-O 3.29Å; C586-M588 HydrophobicContact CB-CG 4.32Å; C586-M588 PolarHBondContact O-N 3.46Å
589	L	87.6	Confident	89.7	Confident	3 Å²	3	51.5 Å²	51.5	2%	0.016	25%	0.246	C	C	.	.	B	Isolated β-bridge	trans	-68.4	142.6	-177.4	-169.4	63.7	0	0	0	111.4	L327 D414 Y418 N580 R591 H608	L327-L589 HydrophobicContact CD1-CD1 4.35Å; L327-L589 HydrophobicContact CD1-CD2 4.03Å; L327-L589 HydrophobicContact CD2-CD2 3.57Å; L327-L589 HydrophobicContact CG-CD2 4.48Å; D414-L589 PolarHBondContact OD2-N 3.43Å; Y418-L589 HydrophobicContact CD1-CD2 4.3Å; Y418-L589 HydrophobicContact CD2-CD2 3.37Å; Y418-L589 HydrophobicContact CD2-CG 4.36Å; Y418-L589 HydrophobicContact CE2-CD2 3.85Å; Y418-L589 HydrophobicContact CG-CD2 3.62Å; N580-L589 HydrophobicContact CB-CD1 4.21Å; L589-R591 WeakPolarHBondContact O-CG 3.5Å; L589-R591 PolarHBondContact O-N 3.06Å; L589-H608 PolarHBondContact O-CE1 2.77Å; L589-H608 PolarHBondContact O-NE2 2.76Å
590	L	90.9	Very high	90	Very high	4 Å²	4	43.4 Å²	43.4	2%	0.021	21%	0.211	C	C	.	.			trans	-72.9	104.8	161.8	-60	-179.5	0	0	0	106.8	F577 T581 C583 Q596 A607	F577-L590 HydrophobicContact CD1-CD1 4.43Å; F577-L590 HydrophobicContact CD2-CD1 3.92Å; F577-L590 HydrophobicContact CE1-CD1 4.17Å; F577-L590 HydrophobicContact CE2-CD1 3.63Å; F577-L590 HydrophobicContact CG-CD1 4.33Å; F577-L590 HydrophobicContact CZ-CD1 3.76Å; T581-L590 HydrophobicContact CG2-CD1 3.8Å; T581-L590 VanDerWaalsContact O-CB 3.28Å; T581-L590 WeakPolarHBondContact O-CB 3.32Å; T581-L590 VanDerWaalsContact O-CG 3.26Å; T581-L590 WeakPolarHBondContact O-CG 3.39Å; T581-L590 PolarHBondContact O-N 3.29Å; C583-L590 HydrophobicContact CB-CD2 3.91Å; L590-Q596 HydrophobicContact CB-CB 3.8Å; L590-A607 VanDerWaalsContact CD2-C 3.43Å
591	R	91.2	Very high	90.1	Very high	59 Å²	59	42 Å²	42	22%	0.223	21%	0.208	C	C	.	.			trans	-84.8	151.2	-165	-55.1	-173.7	-168.9	117.1	-2.3	112.5	D414 E421 L589 Q596	D414-R591 IonicContact OD1-CZ 3.67Å; D414-R591 IonicContact OD1-NE 3.23Å; D414-R591 PolarHBondContact OD1-NE 2.97Å; D414-R591 IonicContact OD1-NH2 2.65Å; D414-R591 PolarHBondContact OD1-NH2 3.08Å; E421-R591 HydrophobicContact CB-CB 3.85Å; E421-R591 HydrophobicContact CG-CB 3.67Å; L589-R591 WeakPolarHBondContact O-CG 3.5Å; L589-R591 PolarHBondContact O-N 3.06Å; R591-Q596 VanDerWaalsContact O-CB 3.22Å; R591-Q596 WeakPolarHBondContact O-CB 3.45Å; R591-Q596 WeakPolarHBondContact O-CG 3.3Å
592	G	88.8	Confident	90	Very high	2 Å²	2	46.7 Å²	46.7	2%	0.021	22%	0.221	C	C	.	.	S	Bend	trans	91.3	-172.5	-177.1	0	0	0	0	0	113.8	D425 Q596	D425-G592 VanDerWaalsContact OD2-CA 3.28Å; D425-G592 WeakPolarHBondContact OD2-CA 3.41Å; G592-Q596 VanDerWaalsContact C-CG 3.46Å; G592-Q596 VanDerWaalsContact O-CG 3.22Å; G592-Q596 WeakPolarHBondContact O-CG 3.42Å; G592-Q596 PolarHBondContact O-NE2 3.44Å; G592-Q596 VanDerWaalsContact O-NE2 3.07Å
593	I	89.9	Confident	89.7	Confident	64 Å²	64	44.3 Å²	44.3	33%	0.328	21%	0.21	S	C	.	.	S	Bend	trans	-121.8	-5.1	178.1	58.6	161.1	0	0	0	113.6	V422 D425 N426 L429 T576	V422-I593 HydrophobicContact CG1-CG2 3.98Å; V422-I593 HydrophobicContact CG2-CG2 4.11Å; D425-I593 HydrophobicContact CB-CG1 3.71Å; D425-I593 PolarHBondContact OD2-N 3.25Å; N426-I593 WeakPolarHBondContact ND2-CD1 3.34Å; L429-I593 HydrophobicContact CD1-CD1 3.87Å; L429-I593 HydrophobicContact CD1-CG1 4.43Å; T576-I593 WeakPolarHBondContact CG2-O 3.32Å
594	F	92.9	Very high	89.5	Confident	10 Å²	10	46.5 Å²	46.5	4%	0.044	23%	0.232	C	C	.	.	S	Bend	trans	-134.2	119.3	-173.2	-177.5	-121	0	0	0	109.5	D425 T428 L429 I432 E447 G450 R451 Q596	D425-F594 HydrophobicContact CB-CB 4.08Å; D425-F594 PolarHBondContact OD2-N 3.38Å; T428-F594 HydrophobicContact CG2-CE1 4.49Å; L429-F594 HydrophobicContact CD1-CB 4.46Å; L429-F594 HydrophobicContact CD2-CD1 4.4Å; L429-F594 HydrophobicContact CD2-CD2 3.79Å; L429-F594 HydrophobicContact CD2-CE1 4.48Å; L429-F594 HydrophobicContact CD2-CE2 3.88Å; L429-F594 HydrophobicContact CD2-CG 4.06Å; L429-F594 HydrophobicContact CD2-CZ 4.24Å; L429-F594 HydrophobicContact CG-CG 4.39Å; I432-F594 HydrophobicContact CD1-CE1 3.66Å; I432-F594 HydrophobicContact CD1-CZ 3.78Å; E447-F594 HydrophobicContact CB-CE2 4.27Å; E447-F594 WeakPolarHBondContact O-CE2 3.27Å; E447-F594 WeakPolarHBondContact O-CZ 3.47Å; G450-F594 WeakPolarHBondContact O-CZ 3.47Å; R451-F594 HydrophobicContact CG-CD1 3.82Å; R451-F594 HydrophobicContact CG-CE1 3.74Å; R451-F594 PolarHBondContact NH1-O 2.84Å; R451-F594 PolarHBondContact NH2-O 3.4Å; F594-Q596 VanDerWaalsContact C-N 3.35Å; F594-Q596 PolarHBondContact O-N 3.33Å
595	Y	94.2	Very high	89.5	Confident	28 Å²	28	40.4 Å²	40.4	11%	0.11	21%	0.212	C	C	.	.			trans	42.2	56.2	-177.5	-68.5	-78.5	0	0	0	114	E447 E448 R451 K478 M574 H575 T576 G597	E447-Y595 WeakPolarHBondContact O-CE2 3.49Å; E448-Y595 PolarHBondContact O-OH 3Å; R451-Y595 PolarHBondContact NH1-O 3.13Å; K478-Y595 PolarHBondContact NZ-OH 3.37Å; M574-Y595 HydrophobicContact CB-CD1 3.8Å; M574-Y595 HydrophobicContact CB-CE1 4.06Å; M574-Y595 HydrophobicContact CE-CD1 4.21Å; M574-Y595 HydrophobicContact CE-CG 4.37Å; H575-Y595 WeakPolarHBondContact O-CA 3.44Å; T576-Y595 PolarHBondContact OG1-N 3.25Å; Y595-G597 PolarHBondContact O-N 3.4Å; Y595-G597 VanDerWaalsContact O-N 3.17Å
596	Q	93.7	Very high	89.8	Confident	23 Å²	23	39.4 Å²	39.4	11%	0.107	20%	0.204	C	C	.	.			trans	-67.2	-12	-177.3	-55.7	98.1	-36.1	0	0	113.6	F577 L590 R591 G592 F594	F577-Q596 PolarHBondContact O-NE2 2.89Å; L590-Q596 HydrophobicContact CB-CB 3.8Å; R591-Q596 VanDerWaalsContact O-CB 3.22Å; R591-Q596 WeakPolarHBondContact O-CB 3.45Å; R591-Q596 WeakPolarHBondContact O-CG 3.3Å; G592-Q596 VanDerWaalsContact C-CG 3.46Å; G592-Q596 VanDerWaalsContact O-CG 3.22Å; G592-Q596 WeakPolarHBondContact O-CG 3.42Å; G592-Q596 PolarHBondContact O-NE2 3.44Å; G592-Q596 VanDerWaalsContact O-NE2 3.07Å; F594-Q596 VanDerWaalsContact C-N 3.35Å; F594-Q596 PolarHBondContact O-N 3.33Å
597	G	93.8	Very high	90.1	Very high	7 Å²	7	36.7 Å²	36.7	7%	0.072	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	169.2	-142.3	-179.1	0	0	0	0	0	112.1	H575 Y595 A607	H575-G597 PolarHBondContact N-O 2.89Å; Y595-G597 PolarHBondContact O-N 3.4Å; Y595-G597 VanDerWaalsContact O-N 3.17Å; G597-A607 WeakPolarHBondContact CA-O 3.23Å
598	Y	94.4	Very high	90.5	Very high	10 Å²	10	31.7 Å²	31.7	4%	0.039	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	142	-171.7	-61.7	-102.3	0	0	0	111.4	N559 P562 F572 Q573 M574 G606 A607 K609 L612	N559-Y598 WeakPolarHBondContact CA-OH 3.18Å; N559-Y598 VanDerWaalsContact O-CE1 3.3Å; N559-Y598 WeakPolarHBondContact O-CE1 3.47Å; N559-Y598 PolarHBondContact O-OH 3.23Å; P562-Y598 HydrophobicContact CG-CD1 4.21Å; P562-Y598 HydrophobicContact CG-CE1 3.58Å; F572-Y598 HydrophobicContact CB-CD1 4.46Å; Q573-Y598 CarbonylContact O-C 3.3Å; Q573-Y598 VanDerWaalsContact O-CA 3.22Å; Q573-Y598 WeakPolarHBondContact O-CA 3.41Å; M574-Y598 HydrophobicContact CG-CD1 4.37Å; M574-Y598 HydrophobicContact CG-CE1 3.73Å; Y598-G606 CarbonylContact O-C 3.59Å; Y598-G606 WeakPolarHBondContact O-CA 3.48Å; Y598-A607 PolarHBondContact N-O 2.72Å; Y598-A607 PolarHBondContact O-N 3.22Å; Y598-K609 HydrophobicContact CD2-CB 4.38Å; Y598-K609 HydrophobicContact CE2-CB 3.64Å; Y598-K609 HydrophobicContact CE2-CD 4.48Å; Y598-K609 HydrophobicContact CE2-CG 3.77Å; Y598-L612 HydrophobicContact CD2-CD1 4.45Å; Y598-L612 HydrophobicContact CD2-CD2 4.43Å; Y598-L612 HydrophobicContact CG-CD1 4.33Å; Y598-L612 HydrophobicContact CG-CD2 4.28Å
599	Y	93.9	Very high	90.8	Very high	81 Å²	81	31.9 Å²	31.9	32%	0.318	16%	0.164	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	131.1	174.8	174.9	-99.6	0	0	0	110	F572 Q573 H575 F577 S601 T605	F572-Y599 WeakPolarHBondContact CA-O 3.33Å; Q573-Y599 PolarHBondContact N-O 2.89Å; Q573-Y599 PolarHBondContact O-N 3.48Å; H575-Y599 VanDerWaalsContact CB-CB 3.46Å; H575-Y599 VanDerWaalsContact CG-CB 3.46Å; F577-Y599 HydrophobicContact CE1-CD2 4.15Å; F577-Y599 HydrophobicContact CZ-CD2 4.47Å; Y599-S601 PolarHBondContact O-N 3.34Å; Y599-T605 WeakPolarHBondContact CA-O 3.22Å
600	C	91.7	Very high	90.9	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	108	170.3	-177.1	0	0	0	0	111.4	H570 N571 F572 R602 C603 G604 T605	H570-C600 HydrophobicContact CB-CB 4.47Å; H570-C600 PolarHBondContact ND1-SG 2.97Å; H570-C600 VanDerWaalsContact ND1-SG 3.45Å; N571-C600 PolarHBondContact N-SG 3.16Å; N571-C600 WeakPolarHBondContact O-CA 3.33Å; F572-C600 HydrophobicContact CD1-CB 3.77Å; F572-C600 HydrophobicContact CE1-CB 3.63Å; F572-C600 HydrophobicContact CG-CB 4.27Å; F572-C600 HydrophobicContact CZ-CB 4.02Å; C600-R602 PolarHBondContact O-N 2.96Å; C600-R602 PolarHBondContact SG-N 3.11Å; C600-C603 PolarHBondContact O-N 3.09Å; C600-G604 PolarHBondContact O-N 3.34Å; C600-T605 PolarHBondContact N-O 2.62Å
601	S	88.2	Confident	90.9	Very high	57 Å²	57	38.7 Å²	38.7	40%	0.399	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-7.5	174.7	52	0	0	0	0	116.4	N571 Y599	N571-S601 PolarHBondContact ND2-OG 3.24Å; N571-S601 PolarHBondContact O-N 3.39Å; N571-S601 PolarHBondContact O-OG 3.2Å; Y599-S601 PolarHBondContact O-N 3.34Å
602	R	85.1	Confident	90.7	Very high	135 Å²	135	36 Å²	36	51%	0.509	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-21.6	179.1	-66.3	177.1	174.2	-175.7	-3.6	114.5	Q569 N571 C600 C618	Q569-R602 WeakPolarHBondContact O-CD 3.41Å; Q569-R602 PolarHBondContact O-NH1 3.31Å; N571-R602 HydrophobicContact CB-CG 4.2Å; C600-R602 PolarHBondContact O-N 2.96Å; C600-R602 PolarHBondContact SG-N 3.11Å; R602-C618 VanDerWaalsContact CB-SG 3.57Å
603	C	83.4	Confident	90.2	Very high	21 Å²	21	39.9 Å²	39.9	14%	0.142	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-147.1	20.8	-173.1	69.6	0	0	0	0	114	H570 C600 T605 K619	H570-C603 VanDerWaalsContact CE1-SG 3.53Å; H570-C603 PolarHBondContact ND1-SG 3.32Å; H570-C603 VanDerWaalsContact ND1-SG 3.44Å; C600-C603 PolarHBondContact O-N 3.09Å; C603-T605 PolarHBondContact O-N 3.15Å; C603-T605 PolarHBondContact O-OG1 2.85Å; C603-T605 PolarHBondContact SG-OG1 3.08Å; C603-K619 WeakPolarHBondContact CB-O 3.2Å
604	G	86.9	Confident	89.7	Confident	46 Å²	46	41.9 Å²	41.9	47%	0.474	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.5	15.6	172.7	0	0	0	0	0	115.9	C600	C600-G604 PolarHBondContact O-N 3.34Å
605	T	89.6	Confident	88.9	Confident	25 Å²	25	41.7 Å²	41.7	15%	0.153	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	126	-162.1	-67.3	0	0	0	0	112.2	F572 R584 Y599 C600 C603	F572-T605 WeakPolarHBondContact CE1-O 3.44Å; R584-T605 HydrophobicContact CB-CG2 3.46Å; R584-T605 VanDerWaalsContact CB-CG2 3.46Å; R584-T605 HydrophobicContact CG-CG2 3.6Å; Y599-T605 WeakPolarHBondContact CA-O 3.22Å; C600-T605 PolarHBondContact N-O 2.62Å; C603-T605 PolarHBondContact O-N 3.15Å; C603-T605 PolarHBondContact O-OG1 2.85Å; C603-T605 PolarHBondContact SG-OG1 3.08Å
606	G	92.3	Very high	88	Confident	8 Å²	8	45.4 Å²	45.4	8%	0.082	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	144.6	176.1	0	0	0	0	0	114.7	R584 Y598	R584-G606 PolarHBondContact N-O 2.69Å; Y598-G606 CarbonylContact O-C 3.59Å; Y598-G606 WeakPolarHBondContact O-CA 3.48Å
607	A	93.2	Very high	87.1	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.4	150.9	-175.9	0	0	0	0	0	114.9	F572 L590 G597 Y598 L612 I615	F572-A607 HydrophobicContact CE1-CB 3.94Å; F572-A607 HydrophobicContact CZ-CB 4.38Å; L590-A607 VanDerWaalsContact CD2-C 3.43Å; G597-A607 WeakPolarHBondContact CA-O 3.23Å; Y598-A607 PolarHBondContact N-O 2.72Å; Y598-A607 PolarHBondContact O-N 3.22Å; A607-L612 HydrophobicContact CB-CD2 3.67Å; A607-I615 HydrophobicContact CB-CD1 3.38Å
608	H	93	Very high	86.2	Confident	18 Å²	18	49.7 Å²	49.7	8%	0.083	27%	0.266	C	S	.	.			trans	-72.2	163.5	165	-49.8	97.8	0	0	0	111.6	C583 C586 L589 E610 C611 L612	C583-H608 WeakPolarHBondContact CB-CE1 3.45Å; C583-H608 WeakPolarHBondContact CB-ND1 3.47Å; C586-H608 VanDerWaalsContact SG-CE1 3.53Å; C586-H608 PolarHBondContact SG-ND1 3.01Å; C586-H608 VanDerWaalsContact SG-ND1 3.45Å; L589-H608 PolarHBondContact O-CE1 2.77Å; L589-H608 PolarHBondContact O-NE2 2.76Å; H608-E610 HydrophobicContact CB-CG 4.29Å; H608-E610 VanDerWaalsContact CB-OE2 3.28Å; H608-E610 WeakPolarHBondContact CB-OE2 3.47Å; H608-E610 PolarHBondContact O-N 2.69Å; H608-C611 HydrophobicContact CB-CB 4.15Å; H608-C611 PolarHBondContact O-N 3.11Å; H608-C611 VanDerWaalsContact O-N 3.13Å; H608-L612 WeakPolarHBondContact O-CD2 3.42Å
609	K	92.7	Very high	84.9	Confident	68 Å²	68	57.7 Å²	57.7	30%	0.296	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-63	-43.2	-175.8	-165.3	179.4	179.5	-177.2	0	112.4	S558 N559 P562 Y598 C611 L612	S558-K609 WeakPolarHBondContact O-CE 3.39Å; S558-K609 PolarHBondContact O-NZ 3.49Å; S558-K609 VanDerWaalsContact O-NZ 3.13Å; S558-K609 PolarHBondContact OG-NZ 3Å; N559-K609 WeakPolarHBondContact OD1-CE 3.33Å; N559-K609 PolarHBondContact OD1-NZ 2.91Å; P562-K609 HydrophobicContact CB-CG 4.23Å; Y598-K609 HydrophobicContact CD2-CB 4.38Å; Y598-K609 HydrophobicContact CE2-CB 3.64Å; Y598-K609 HydrophobicContact CE2-CD 4.48Å; Y598-K609 HydrophobicContact CE2-CG 3.77Å; K609-C611 VanDerWaalsContact C-N 3.27Å; K609-C611 PolarHBondContact O-N 2.95Å; K609-L612 WeakPolarHBondContact O-CG 3.41Å
610	E	90.1	Very high	83.1	Confident	137 Å²	137	59.6 Å²	59.6	64%	0.64	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-72.3	-16.8	177.2	64.2	-87.8	-147.2	0	0	113.2	H608	H608-E610 HydrophobicContact CB-CG 4.29Å; H608-E610 VanDerWaalsContact CB-OE2 3.28Å; H608-E610 WeakPolarHBondContact CB-OE2 3.47Å; H608-E610 PolarHBondContact O-N 2.69Å
611	C	89.9	Confident	80.8	Confident	14 Å²	14	63.8 Å²	63.8	10%	0.095	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-92.2	-13.7	-176.6	-80.6	0	0	0	0	114.2	C583 A585 H608 K609 E613 V614	C583-C611 VanDerWaalsContact SG-CB 3.56Å; C583-C611 VanDerWaalsContact SG-SG 3.68Å; A585-C611 HydrophobicContact CB-CB 3.94Å; H608-C611 HydrophobicContact CB-CB 4.15Å; H608-C611 PolarHBondContact O-N 3.11Å; H608-C611 VanDerWaalsContact O-N 3.13Å; K609-C611 VanDerWaalsContact C-N 3.27Å; K609-C611 PolarHBondContact O-N 2.95Å; C611-E613 PolarHBondContact O-N 3.07Å; C611-V614 PolarHBondContact O-N 3.25Å
612	L	86.8	Confident	78.3	Confident	2 Å²	2	66 Å²	66	1%	0.01	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-56.9	-36.4	-171	-57.2	-178	0	0	0	113.1	P562 F572 Y598 A607 H608 K609 V614	P562-L612 HydrophobicContact CB-CD1 4.11Å; P562-L612 HydrophobicContact CG-CD1 3.59Å; F572-L612 HydrophobicContact CB-CD1 4.45Å; F572-L612 HydrophobicContact CB-CD2 4.21Å; F572-L612 HydrophobicContact CD1-CD2 3.77Å; F572-L612 HydrophobicContact CD2-CB 4.49Å; F572-L612 HydrophobicContact CD2-CD2 3.82Å; F572-L612 HydrophobicContact CE1-CD2 4.03Å; F572-L612 HydrophobicContact CE2-CD2 4.07Å; F572-L612 HydrophobicContact CG-CD2 3.68Å; F572-L612 HydrophobicContact CZ-CD2 4.19Å; Y598-L612 HydrophobicContact CD2-CD1 4.45Å; Y598-L612 HydrophobicContact CD2-CD2 4.43Å; Y598-L612 HydrophobicContact CG-CD1 4.33Å; Y598-L612 HydrophobicContact CG-CD2 4.28Å; A607-L612 HydrophobicContact CB-CD2 3.67Å; H608-L612 WeakPolarHBondContact O-CD2 3.42Å; K609-L612 WeakPolarHBondContact O-CG 3.41Å; L612-V614 VanDerWaalsContact C-N 3.33Å; L612-V614 PolarHBondContact O-N 3.09Å
613	E	77.8	Confident	76.1	Confident	84 Å²	84	67.5 Å²	67.5	39%	0.393	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-67.5	-32.7	-176.1	-24.7	-165.7	136.5	0	0	113.3	R564 C611 I615	R564-E613 HydrophobicContact CB-CG 4.33Å; R564-E613 WeakPolarHBondContact CD-OE1 3.49Å; R564-E613 HydrophobicContact CG-CG 4.43Å; R564-E613 IonicContact CZ-OE1 3.03Å; R564-E613 IonicContact CZ-OE2 3.66Å; R564-E613 VanDerWaalsContact CZ-OE2 3.29Å; R564-E613 IonicContact NE-OE1 2.62Å; R564-E613 PolarHBondContact NE-OE1 3.46Å; R564-E613 VanDerWaalsContact NE-OE1 3.14Å; R564-E613 IonicContact NH1-OE1 3.49Å; R564-E613 PolarHBondContact NH1-OE1 3.19Å; R564-E613 IonicContact NH1-OE2 3.87Å; R564-E613 PolarHBondContact NH1-OE2 3.4Å; R564-E613 IonicContact NH2-OE1 2.76Å; R564-E613 PolarHBondContact NH2-OE1 3.18Å; R564-E613 VanDerWaalsContact NH2-OE1 3.14Å; R564-E613 IonicContact NH2-OE2 2.7Å; C611-E613 PolarHBondContact O-N 3.07Å; E613-I615 VanDerWaalsContact C-N 3.31Å
614	V	80	Confident	74.1	Confident	106 Å²	106	73.3 Å²	73.3	64%	0.642	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-85	-10.1	-171.1	-169.1	0	0	0	0	111.3	A585 C611 L612 T616	A585-V614 HydrophobicContact CB-CB 4.23Å; A585-V614 HydrophobicContact CB-CG1 4.5Å; C611-V614 PolarHBondContact O-N 3.25Å; L612-V614 VanDerWaalsContact C-N 3.33Å; L612-V614 PolarHBondContact O-N 3.09Å; V614-T616 PolarHBondContact O-N 2.7Å
615	I	77.1	Confident	71.6	Confident	6 Å²	6	78.1 Å²	78.1	3%	0.031	41%	0.405	C	S	.	.	S	Bend	trans	-79.6	124.1	-175	-62.2	172.3	0	0	0	110.1	N568 F572 R584 A585 A607 E613	N568-I615 PolarHBondContact ND2-O 3.3Å; F572-I615 HydrophobicContact CE1-CD1 4.29Å; F572-I615 HydrophobicContact CE2-CD1 4.35Å; F572-I615 HydrophobicContact CZ-CD1 3.62Å; F572-I615 HydrophobicContact CZ-CG2 4.41Å; R584-I615 HydrophobicContact CB-CD1 4.31Å; R584-I615 HydrophobicContact CG-CG2 4.41Å; A585-I615 HydrophobicContact CB-CG1 3.97Å; A607-I615 HydrophobicContact CB-CD1 3.38Å; E613-I615 VanDerWaalsContact C-N 3.31Å
616	T	74.4	Confident	68.7	Low	105 Å²	105	85.3 Å²	85.3	64%	0.644	44%	0.437	S	S	*	.			trans	-57.8	160.1	178.7	53.4	0	0	0	0	112.9	H570 V614 C618	H570-T616 PolarHBondContact NE2-O 3.31Å; V614-T616 PolarHBondContact O-N 2.7Å; T616-C618 PolarHBondContact O-N 3.43Å
617	I	74.4	Confident	65.9	Low	110 Å²	110	91.2 Å²	91.2	56%	0.564	47%	0.474	S	S	*	.			trans	-43.9	131.4	-175.9	-58.3	174.2	0	0	0	112.4	N568 K619	N568-I617 HydrophobicContact CB-CG1 4.41Å; N568-I617 WeakPolarHBondContact O-CA 3.36Å; I617-K619 PolarHBondContact O-N 3.28Å
618	C	75.4	Confident	63.5	Low	11 Å²	11	94.1 Å²	94.1	7%	0.074	50%	0.503	C	S	.	.			trans	-54.2	106.6	-179.5	-167.7	0	0	0	0	111	N568 Q569 H570 R602 T616 I620	N568-C618 PolarHBondContact O-N 2.95Å; Q569-C618 HydrophobicContact CB-CB 4.16Å; Q569-C618 WeakPolarHBondContact O-CB 3.26Å; H570-C618 VanDerWaalsContact CE1-CA 3.46Å; H570-C618 WeakPolarHBondContact CE1-CA 3.29Å; H570-C618 PolarHBondContact NE2-N 3.27Å; R602-C618 VanDerWaalsContact CB-SG 3.57Å; T616-C618 PolarHBondContact O-N 3.43Å; C618-I620 PolarHBondContact O-N 2.83Å
619	K	66.3	Low	60.8	Low	177 Å²	177	102.4 Å²	102.4	77%	0.77	54%	0.544	S	S	*	.			trans	-84.3	101.9	170.5	-65.1	-168.6	178.3	-169.4	0	107.9	C603 I617 N621	C603-K619 WeakPolarHBondContact CB-O 3.2Å; I617-K619 PolarHBondContact O-N 3.28Å; K619-N621 PolarHBondContact O-N 3.1Å
620	I	57.6	Low	58.3	Low	121 Å²	121	104.6 Å²	104.6	62%	0.621	57%	0.569	S	S	*	*			trans	-53.2	128.8	169.3	-56.8	174	0	0	0	107.6	C618 P622	C618-I620 PolarHBondContact O-N 2.83Å; I620-P622 VanDerWaalsContact O-CD 3.31Å; I620-P622 WeakPolarHBondContact O-CD 3.24Å
621	N	43.4	Very low	56.6	Low	89 Å²	89	103 Å²	103	48%	0.476	57%	0.57	S	S	.	*			trans	-76	117.7	-173.9	-159.1	30.4	0	0	0	109.3	K619 H623	K619-N621 PolarHBondContact O-N 3.1Å; N621-H623 PolarHBondContact O-N 3.46Å
622	P	35.6	Very low	55	Low	104 Å²	104	103.2 Å²	103.2	68%	0.675	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-72.3	1.6	-168.4	-21.4	34.8	0	0	0	116.3	I620	I620-P622 VanDerWaalsContact O-CD 3.31Å; I620-P622 WeakPolarHBondContact O-CD 3.24Å
623	H	38.9	Very low	54.4	Low	166 Å²	166	107.2 Å²	107.2	77%	0.769	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	-87.6	-14.8	-170.1	-84.5	-73.3	0	0	0	115.2	N621	N621-H623 PolarHBondContact O-N 3.46Å
624	D	39.8	Very low	54.6	Low	142 Å²	142	108.7 Å²	108.7	76%	0.759	61%	0.606	S	S	*	*	G	3₁₀ helix	trans	-100.5	18.9	-179.1	-55	-60.2	0	0	0	112.9
625	M	35.1	Very low	54.8	Low	147 Å²	147	104.1 Å²	104.1	72%	0.724	58%	0.578	S	S	*	*	S	Bend	trans	-114.7	119.1	178.1	-64.9	-122.7	69.4	0	0	111
626	E	29	Very low	55.3	Low	176 Å²	176	104.8 Å²	104.8	82%	0.822	58%	0.582	S	S	*	*			trans	-47.5	137.4	168.5	-83.5	-73.4	131.2	0	0	111.3	G628	E626-G628 VanDerWaalsContact C-N 3.27Å; E626-G628 PolarHBondContact O-N 3.01Å
627	P	33.7	Very low	55.8	Low	133 Å²	133	99.9 Å²	99.9	86%	0.864	55%	0.552	S	S	*	*	S	Bend	trans	-76.8	70.2	-171.9	31.7	-36.4	0	0	0	112.8
628	G	41.5	Very low	56.4	Low	60 Å²	60	97.4 Å²	97.4	62%	0.619	54%	0.542	S	S	*	.			trans	-156	125.6	177.2	0	0	0	0	0	113.8	E626	E626-G628 VanDerWaalsContact C-N 3.27Å; E626-G628 PolarHBondContact O-N 3.01Å
629	M	36.3	Very low	56.9	Low	192 Å²	192	102.9 Å²	102.9	95%	0.946	56%	0.561	S	S	*	*			trans	65.9	77.1	167.8	-54.5	-173.3	64	0	0	117.5
630	S	42	Very low	57.9	Low	115 Å²	115	98.2 Å²	98.2	80%	0.804	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-94.5	126.6	141.2	48.5	0	0	0	0	108.7
631	P	52.8	Low	59.3	Low	102 Å²	102	92.7 Å²	92.7	66%	0.662	52%	0.516	S	S	*	.	P	Polyproline II helix	trans	-69.7	135.5	-179.9	-20.6	33.1	0	0	0	112.4	E662	P631-E662 WeakPolarHBondContact CA-OE1 3.28Å
632	G	57.8	Low	61.3	Low	19 Å²	19	93.6 Å²	93.6	20%	0.196	52%	0.517	C	S	.	.	P	Polyproline II helix	trans	-69.2	161.9	173.6	0	0	0	0	0	112.8	K634 E662	G632-K634 PolarHBondContact O-N 3.38Å; G632-E662 PolarHBondContact N-OE1 3.35Å
633	P	73.5	Confident	63.4	Low	86 Å²	86	89 Å²	89	56%	0.558	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-54.7	126.4	175.6	-25.3	34.5	0	0	0	111.6	L663	P633-L663 HydrophobicContact CB-CB 4.35Å; P633-L663 WeakPolarHBondContact O-CB 3.29Å; P633-L663 PolarHBondContact O-N 3.24Å
634	K	81.4	Confident	65	Low	116 Å²	116	86 Å²	86	50%	0.504	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	129.1	178.6	-67.6	-171.6	-175.7	-179.4	0	110.8	G632 I678 Y694	G632-K634 PolarHBondContact O-N 3.38Å; K634-I678 HydrophobicContact CD-CD1 4.08Å; K634-I678 HydrophobicContact CG-CD1 4.1Å; K634-Y694 WeakPolarHBondContact O-CB 3.47Å; K634-Y694 PolarHBondContact O-N 3.13Å
635	M	83.9	Confident	66.6	Low	10 Å²	10	83.7 Å²	83.7	5%	0.049	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	153.1	177.1	-50.8	-62.6	-77.9	0	0	109	F660 I661 L663 W673 V691 K692 P693	M635-F660 WeakPolarHBondContact O-CA 3.41Å; M635-I661 HydrophobicContact CB-CB 4.46Å; M635-I661 WeakPolarHBondContact CB-O 3.45Å; M635-I661 PolarHBondContact N-O 3.16Å; M635-I661 PolarHBondContact O-N 3.25Å; M635-L663 HydrophobicContact CG-CB 4.01Å; M635-W673 HydrophobicContact CE-CE3 4.48Å; M635-W673 HydrophobicContact CE-CZ3 3.77Å; M635-V691 HydrophobicContact CB-CB 4.14Å; M635-V691 HydrophobicContact CB-CG2 4.35Å; M635-V691 HydrophobicContact CE-CB 4.41Å; M635-V691 HydrophobicContact CE-CG2 3.67Å; M635-K692 CarbonylContact C-O 3.52Å; M635-K692 VanDerWaalsContact CA-O 3.26Å; M635-K692 WeakPolarHBondContact CA-O 3.27Å; M635-P693 HydrophobicContact CE-CG 4.18Å; M635-P693 HydrophobicContact SD-CB 4.37Å; M635-P693 HydrophobicContact SD-CG 4.33Å
636	V	87.9	Confident	68.6	Low	20 Å²	20	81.3 Å²	81.3	12%	0.121	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	134.2	169.2	63.9	0	0	0	0	109.6	V638 D659 F660 V691 K692	V636-V638 PolarHBondContact O-N 2.95Å; V636-D659 CarbonylContact C-O 3.51Å; V636-D659 WeakPolarHBondContact CA-O 3.4Å; V636-F660 HydrophobicContact CB-CD1 4.06Å; V636-F660 HydrophobicContact CB-CE1 4.1Å; V636-F660 HydrophobicContact CG2-CD1 4.1Å; V636-F660 HydrophobicContact CG2-CE1 3.9Å; V636-V691 CarbonylContact O-C 3.49Å; V636-V691 WeakPolarHBondContact O-CA 3.48Å; V636-K692 HydrophobicContact CG1-CD 4.3Å; V636-K692 HydrophobicContact CG1-CG 3.63Å; V636-K692 PolarHBondContact N-O 3.35Å; V636-K692 PolarHBondContact O-N 2.97Å
637	A	86.5	Confident	70.9	Confident	2 Å²	2	73.2 Å²	73.2	2%	0.017	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	123.6	176.4	0	0	0	0	0	110.7	F655 Q656 G658 D659 I661 C690	A637-F655 HydrophobicContact CB-CD2 3.46Å; A637-F655 VanDerWaalsContact CB-CD2 3.46Å; A637-F655 HydrophobicContact CB-CE2 3.63Å; A637-F655 HydrophobicContact CB-CG 4.43Å; A637-Q656 WeakPolarHBondContact CB-O 3.48Å; A637-G658 PolarHBondContact O-N 3.13Å; A637-D659 HydrophobicContact CB-CB 4.25Å; A637-D659 PolarHBondContact N-O 2.72Å; A637-I661 HydrophobicContact CB-CD1 4.33Å; A637-C690 WeakPolarHBondContact CA-O 3.23Å
638	V	86.8	Confident	72.7	Confident	58 Å²	58	71.7 Å²	71.7	35%	0.352	42%	0.422	S	S	.	.	S	Bend	trans	-102.2	-5.5	176.7	-63.4	0	0	0	0	112.9	V636 C690 K692	V636-V638 PolarHBondContact O-N 2.95Å; V638-C690 WeakPolarHBondContact CG2-O 3.45Å; V638-C690 PolarHBondContact N-O 3.35Å; V638-K692 HydrophobicContact CG1-CB 4.01Å; V638-K692 HydrophobicContact CG1-CD 3.6Å; V638-K692 HydrophobicContact CG1-CG 3.55Å
639	R	85.1	Confident	74	Confident	126 Å²	126	73 Å²	73	48%	0.475	44%	0.435	S	S	.	.	S	Bend	trans	-149.9	142	177.1	-143.8	-179.6	-60.3	112.5	7.3	108.9	F655 T657 S689 C690	R639-F655 WeakPolarHBondContact O-CE2 3.39Å; R639-T657 VanDerWaalsContact C-OG1 3.29Å; R639-T657 WeakPolarHBondContact CA-OG1 3.47Å; R639-S689 VanDerWaalsContact CZ-O 3.26Å; R639-S689 PolarHBondContact NH1-O 3.46Å; R639-S689 PolarHBondContact NH1-OG 3.32Å; R639-S689 VanDerWaalsContact NH1-OG 3.12Å; R639-S689 PolarHBondContact NH2-O 3.08Å; R639-C690 HydrophobicContact CB-CB 4.36Å; R639-C690 PolarHBondContact N-O 2.95Å; R639-C690 PolarHBondContact NH1-SG 2.91Å; R639-C690 VanDerWaalsContact NH1-SG 3.44Å
640	N	87.8	Confident	76.1	Confident	79 Å²	79	69.1 Å²	69.1	42%	0.422	41%	0.413	S	S	.	.			trans	-61.1	141.7	172.1	-66.2	5.8	0	0	0	109.7	T657	N640-T657 PolarHBondContact N-OG1 3.03Å; N640-T657 WeakPolarHBondContact OD1-CB 3.47Å; N640-T657 PolarHBondContact OD1-N 3.2Å; N640-T657 PolarHBondContact OD1-OG1 3.36Å
641	Y	87	Confident	78	Confident	5 Å²	5	68.4 Å²	68.4	2%	0.02	40%	0.404	C	S	.	.	B	Isolated β-bridge	trans	-138.6	123.8	173	175.7	-116.3	0	0	0	109.8	T644 P645 P652 L653 C654 F655 W672 F685 F686 P687	Y641-T644 WeakPolarHBondContact CE2-O 3.42Å; Y641-P645 WeakPolarHBondContact CE2-O 3.31Å; Y641-P645 PolarHBondContact OH-O 2.96Å; Y641-P652 HydrophobicContact CE1-CB 4.2Å; Y641-L653 WeakPolarHBondContact CD1-O 3.42Å; Y641-L653 WeakPolarHBondContact CE1-O 3.39Å; Y641-C654 CarbonylContact O-C 3.53Å; Y641-C654 VanDerWaalsContact O-CA 3.25Å; Y641-C654 WeakPolarHBondContact O-CA 3.4Å; Y641-F655 HydrophobicContact CD1-CE1 4.1Å; Y641-F655 HydrophobicContact CD1-CZ 4.33Å; Y641-F655 PolarHBondContact N-O 2.96Å; Y641-F655 PolarHBondContact O-N 3.06Å; Y641-F655 VanDerWaalsContact O-O 3.11Å; Y641-W672 HydrophobicContact CE2-CH2 4.46Å; Y641-W672 WeakPolarHBondContact OH-CH2 3.5Å; Y641-W672 WeakPolarHBondContact OH-CZ3 3.16Å; Y641-F685 WeakPolarHBondContact CE1-O 3.34Å; Y641-F686 HydrophobicContact CD1-CB 3.73Å; Y641-F686 HydrophobicContact CE1-CB 3.81Å; Y641-P687 HydrophobicContact CD2-CG 4.06Å; Y641-P687 HydrophobicContact CE2-CG 3.89Å
642	H	85.3	Confident	79.6	Confident	108 Å²	108	66 Å²	66	50%	0.5	39%	0.388	S	S	.	.	S	Bend	trans	-120.2	28.8	-172.7	-57.1	-49.6	0	0	0	112.2
643	G	78.7	Confident	81.1	Confident	8 Å²	8	65.3 Å²	65.3	8%	0.082	38%	0.38	C	S	.	.	S	Bend	trans	82.7	10.7	-177.7	0	0	0	0	0	115.2	P645 T646	G643-P645 CarbonylContact C-O 3.54Å; G643-P645 CarbonylContact O-C 3.44Å; G643-T646 WeakPolarHBondContact O-CA 3.48Å; G643-T646 PolarHBondContact O-N 3.03Å; G643-T646 PolarHBondContact O-OG1 3.11Å
644	T	74.1	Confident	81.8	Confident	103 Å²	103	64.3 Å²	64.3	63%	0.632	37%	0.374	S	S	*	.			trans	-124.5	125.4	177.9	50.6	0	0	0	0	110.8	Y641	Y641-T644 WeakPolarHBondContact CE2-O 3.42Å
645	P	72.2	Confident	82.1	Confident	93 Å²	93	59.1 Å²	59.1	60%	0.604	35%	0.352	S	S	*	.	S	Bend	cis	-59.1	158.3	-8.1	28.8	-36.3	0	0	0	111.7	Y641 G643 W672	Y641-P645 WeakPolarHBondContact CE2-O 3.31Å; Y641-P645 PolarHBondContact OH-O 2.96Å; G643-P645 CarbonylContact C-O 3.54Å; G643-P645 CarbonylContact O-C 3.44Å; P645-W672 HydrophobicContact CG-CH2 4.31Å; P645-W672 HydrophobicContact CG-CZ2 4.19Å; P645-W672 WeakPolarHBondContact O-CH2 3.31Å
646	T	76.8	Confident	82.4	Confident	97 Å²	97	64.4 Å²	64.4	60%	0.595	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-82.1	138.7	-178.9	-40.8	0	0	0	0	110.2	G643	G643-T646 WeakPolarHBondContact O-CA 3.48Å; G643-T646 PolarHBondContact O-N 3.03Å; G643-T646 PolarHBondContact O-OG1 3.11Å
647	P	78.1	Confident	82.3	Confident	6 Å²	6	67.3 Å²	67.3	4%	0.039	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-64.4	133.8	174.5	-14.6	27	0	0	0	110.5	G649 K650 P652 W672 F685	P647-G649 PolarHBondContact O-N 3.08Å; P647-K650 HydrophobicContact CB-CB 4.08Å; P647-K650 PolarHBondContact O-N 3.19Å; P647-P652 HydrophobicContact CG-CB 4.05Å; P647-W672 HydrophobicContact CB-CD2 4.35Å; P647-W672 HydrophobicContact CB-CE3 4.03Å; P647-W672 HydrophobicContact CB-CH2 4.25Å; P647-W672 HydrophobicContact CB-CZ3 3.97Å; P647-W672 HydrophobicContact CG-CE3 4.1Å; P647-W672 HydrophobicContact CG-CH2 3.99Å; P647-W672 HydrophobicContact CG-CZ3 3.62Å; P647-F685 HydrophobicContact CB-CB 3.96Å; P647-F685 HydrophobicContact CG-CB 3.87Å
648	P	71.2	Confident	81.8	Confident	101 Å²	101	69.1 Å²	69.1	66%	0.656	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	106	178.1	-26	35.4	0	0	0	112.2	K650	P648-K650 VanDerWaalsContact C-N 3.34Å; P648-K650 PolarHBondContact O-N 3.39Å
649	G	69.9	Low	81.8	Confident	88 Å²	88	67.4 Å²	67.4	91%	0.907	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.4	18.4	177.1	0	0	0	0	0	116.2	P647	P647-G649 PolarHBondContact O-N 3.08Å
650	K	79	Confident	81.8	Confident	110 Å²	110	65.2 Å²	65.2	48%	0.478	40%	0.396	S	S	.	.	S	Bend	trans	-135.3	158.1	-178.3	-49	-171.6	-171.7	179.6	0	113.4	P647 P648 F685	P647-K650 HydrophobicContact CB-CB 4.08Å; P647-K650 PolarHBondContact O-N 3.19Å; P648-K650 VanDerWaalsContact C-N 3.34Å; P648-K650 PolarHBondContact O-N 3.39Å; K650-F685 HydrophobicContact CB-CD2 3.7Å; K650-F685 HydrophobicContact CB-CE2 4.22Å; K650-F685 HydrophobicContact CB-CG 4.11Å; K650-F685 HydrophobicContact CD-CD1 3.81Å; K650-F685 HydrophobicContact CD-CD2 3.56Å; K650-F685 HydrophobicContact CD-CE1 3.66Å; K650-F685 HydrophobicContact CD-CE2 3.44Å; K650-F685 VanDerWaalsContact CD-CE2 3.44Å; K650-F685 HydrophobicContact CD-CG 3.76Å; K650-F685 HydrophobicContact CD-CZ 3.48Å; K650-F685 VanDerWaalsContact CD-CZ 3.48Å; K650-F685 HydrophobicContact CG-CD2 4.29Å; K650-F685 HydrophobicContact CG-CE2 4.41Å
651	T	83.4	Confident	81.7	Confident	99 Å²	99	61.5 Å²	61.5	61%	0.607	38%	0.376	S	S	*	.			trans	-69.4	127.1	178	42.4	0	0	0	0	111.7	F685	T651-F685 PolarHBondContact O-N 3.12Å
652	P	86.4	Confident	81.8	Confident	52 Å²	52	63.1 Å²	63.1	34%	0.338	38%	0.384	S	S	.	.	B	Isolated β-bridge	trans	-75.5	139.8	174.2	28.1	-32.1	0	0	0	112.1	Y641 P647 F685	Y641-P652 HydrophobicContact CE1-CB 4.2Å; P647-P652 HydrophobicContact CG-CB 4.05Å; P652-F685 WeakPolarHBondContact CA-O 3.35Å
653	L	88.5	Confident	81.7	Confident	5 Å²	5	59.2 Å²	59.2	3%	0.026	37%	0.366	C	S	.	.			trans	-93.5	105.9	166.9	-178.1	65.1	0	0	0	110.1	Y641 F655 I661 L677 K682 F685 F686	Y641-L653 WeakPolarHBondContact CD1-O 3.42Å; Y641-L653 WeakPolarHBondContact CE1-O 3.39Å; L653-F655 HydrophobicContact CD2-CD1 4.4Å; L653-F655 HydrophobicContact CG-CD1 4.21Å; L653-F655 VanDerWaalsContact O-CD1 3.28Å; L653-F655 WeakPolarHBondContact O-CD1 3.49Å; L653-I661 HydrophobicContact CD2-CG2 4.32Å; L653-L677 HydrophobicContact CD1-CB 4.16Å; L653-L677 HydrophobicContact CD2-CB 4.39Å; L653-K682 HydrophobicContact CD1-CB 4.06Å; L653-K682 VanDerWaalsContact CD1-O 3.3Å; L653-K682 WeakPolarHBondContact CD1-O 3.41Å; L653-F685 PolarHBondContact N-O 3.48Å; L653-F686 HydrophobicContact CB-CD1 4.3Å; L653-F686 HydrophobicContact CD2-CD1 4Å; L653-F686 HydrophobicContact CD2-CE1 4.23Å
654	C	87.8	Confident	81.8	Confident	65 Å²	65	63.1 Å²	63.1	44%	0.439	39%	0.385	S	S	.	.			trans	-80.7	136.8	177.1	-58	0	0	0	0	112.1	Y641	Y641-C654 CarbonylContact O-C 3.53Å; Y641-C654 VanDerWaalsContact O-CA 3.25Å; Y641-C654 WeakPolarHBondContact O-CA 3.4Å
655	F	88.9	Confident	81.9	Confident	6 Å²	6	65.5 Å²	65.5	3%	0.026	39%	0.386	C	S	.	.	B	Isolated β-bridge	trans	-155.7	166.2	178.3	53.7	-105	0	0	0	112.7	A637 R639 Y641 L653 D659 I661 L677 F686 C690 V691	A637-F655 HydrophobicContact CB-CD2 3.46Å; A637-F655 VanDerWaalsContact CB-CD2 3.46Å; A637-F655 HydrophobicContact CB-CE2 3.63Å; A637-F655 HydrophobicContact CB-CG 4.43Å; R639-F655 WeakPolarHBondContact O-CE2 3.39Å; Y641-F655 HydrophobicContact CD1-CE1 4.1Å; Y641-F655 HydrophobicContact CD1-CZ 4.33Å; Y641-F655 PolarHBondContact N-O 2.96Å; Y641-F655 PolarHBondContact O-N 3.06Å; Y641-F655 VanDerWaalsContact O-O 3.11Å; L653-F655 HydrophobicContact CD2-CD1 4.4Å; L653-F655 HydrophobicContact CG-CD1 4.21Å; L653-F655 VanDerWaalsContact O-CD1 3.28Å; L653-F655 WeakPolarHBondContact O-CD1 3.49Å; F655-D659 HydrophobicContact CB-CB 4.2Å; F655-D659 WeakPolarHBondContact CB-OD2 3.39Å; F655-I661 HydrophobicContact CD1-CD1 3.54Å; F655-I661 HydrophobicContact CD1-CG1 4.43Å; F655-I661 HydrophobicContact CD2-CD1 4.08Å; F655-I661 HydrophobicContact CE1-CD1 3.49Å; F655-I661 VanDerWaalsContact CE1-CD1 3.49Å; F655-I661 HydrophobicContact CE2-CD1 4.05Å; F655-I661 HydrophobicContact CG-CD1 3.83Å; F655-I661 HydrophobicContact CZ-CD1 3.76Å; F655-L677 HydrophobicContact CB-CD1 3.78Å; F655-L677 HydrophobicContact CB-CD2 4.33Å; F655-F686 HydrophobicContact CE1-CB 3.48Å; F655-F686 VanDerWaalsContact CE1-CB 3.48Å; F655-F686 AromaticContact CE1-CD1 3.95Å; F655-F686 HydrophobicContact CE1-CD1 3.95Å; F655-F686 HydrophobicContact CE1-CD2 4.12Å; F655-F686 AromaticContact CE1-CG 3.59Å; F655-F686 HydrophobicContact CE1-CG 3.59Å; F655-F686 HydrophobicContact CZ-CB 3.88Å; F655-F686 HydrophobicContact CZ-CD2 4.1Å; F655-F686 AromaticContact CZ-CG 4Å; F655-F686 HydrophobicContact CZ-CG 4Å; F655-C690 HydrophobicContact CE2-CB 4.09Å; F655-C690 HydrophobicContact CZ-CB 4.01Å; F655-V691 HydrophobicContact CE2-CG1 4.37Å; F655-V691 HydrophobicContact CZ-CG1 3.97Å
656	Q	88.7	Confident	82	Confident	122 Å²	122	62.6 Å²	62.6	57%	0.57	37%	0.373	S	S	*	.			trans	-110.7	160.2	177.7	-67.2	-176.7	-24.3	0	0	111.7	A637 G658 D659	A637-Q656 WeakPolarHBondContact CB-O 3.48Å; Q656-G658 PolarHBondContact O-N 3.33Å; Q656-D659 PolarHBondContact N-OD2 2.6Å; Q656-D659 VanDerWaalsContact O-CB 3.28Å; Q656-D659 WeakPolarHBondContact O-CB 3.44Å; Q656-D659 PolarHBondContact O-N 3.07Å; Q656-D659 VanDerWaalsContact O-N 3.11Å
657	T	85.4	Confident	81.7	Confident	81 Å²	81	61.7 Å²	61.7	50%	0.497	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	128.2	179	-55.1	0	0	0	0	110.2	R639 N640	R639-T657 VanDerWaalsContact C-OG1 3.29Å; R639-T657 WeakPolarHBondContact CA-OG1 3.47Å; N640-T657 PolarHBondContact N-OG1 3.03Å; N640-T657 WeakPolarHBondContact OD1-CB 3.47Å; N640-T657 PolarHBondContact OD1-N 3.2Å; N640-T657 PolarHBondContact OD1-OG1 3.36Å
658	G	76.8	Confident	81.3	Confident	39 Å²	39	66.9 Å²	66.9	40%	0.402	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.9	-13.9	-172.2	0	0	0	0	0	114.6	A637 Q656	A637-G658 PolarHBondContact O-N 3.13Å; Q656-G658 PolarHBondContact O-N 3.33Å
659	D	86.3	Confident	81	Confident	23 Å²	23	69.4 Å²	69.4	12%	0.123	41%	0.407	C	S	.	.			trans	-66.4	143.7	176.6	-80.4	-25.4	0	0	0	112.9	V636 A637 F655 Q656 L677 Q679	V636-D659 CarbonylContact C-O 3.51Å; V636-D659 WeakPolarHBondContact CA-O 3.4Å; A637-D659 HydrophobicContact CB-CB 4.25Å; A637-D659 PolarHBondContact N-O 2.72Å; F655-D659 HydrophobicContact CB-CB 4.2Å; F655-D659 WeakPolarHBondContact CB-OD2 3.39Å; Q656-D659 PolarHBondContact N-OD2 2.6Å; Q656-D659 VanDerWaalsContact O-CB 3.28Å; Q656-D659 WeakPolarHBondContact O-CB 3.44Å; Q656-D659 PolarHBondContact O-N 3.07Å; Q656-D659 VanDerWaalsContact O-N 3.11Å; D659-L677 HydrophobicContact CB-CD1 3.7Å; D659-Q679 PolarHBondContact OD1-NE2 3.25Å
660	F	85.9	Confident	81.4	Confident	80 Å²	80	67.6 Å²	67.6	35%	0.351	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	128.6	175.2	-58	-68.7	0	0	0	112	M635 V636 I678 Y694	M635-F660 WeakPolarHBondContact O-CA 3.41Å; V636-F660 HydrophobicContact CB-CD1 4.06Å; V636-F660 HydrophobicContact CB-CE1 4.1Å; V636-F660 HydrophobicContact CG2-CD1 4.1Å; V636-F660 HydrophobicContact CG2-CE1 3.9Å; F660-I678 HydrophobicContact CB-CB 4.44Å; F660-I678 HydrophobicContact CB-CD1 4.05Å; F660-I678 WeakPolarHBondContact O-CB 3.5Å; F660-I678 PolarHBondContact O-N 3.04Å; F660-Y694 HydrophobicContact CD1-CD2 4.15Å; F660-Y694 HydrophobicContact CD1-CG 4.42Å; F660-Y694 AromaticContact CE1-CD2 3.5Å; F660-Y694 HydrophobicContact CE1-CD2 3.5Å; F660-Y694 VanDerWaalsContact CE1-CD2 3.5Å; F660-Y694 AromaticContact CE1-CE2 3.71Å; F660-Y694 HydrophobicContact CE1-CE2 3.71Å; F660-Y694 HydrophobicContact CE1-CG 4.18Å; F660-Y694 HydrophobicContact CZ-CD2 4.44Å; F660-Y694 HydrophobicContact CZ-CE2 4.23Å
661	I	86	Confident	81.4	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	127.4	-176	-60.1	158.1	0	0	0	108.3	M635 A637 L653 F655 K676 L677 F686 V691	M635-I661 HydrophobicContact CB-CB 4.46Å; M635-I661 WeakPolarHBondContact CB-O 3.45Å; M635-I661 PolarHBondContact N-O 3.16Å; M635-I661 PolarHBondContact O-N 3.25Å; A637-I661 HydrophobicContact CB-CD1 4.33Å; L653-I661 HydrophobicContact CD2-CG2 4.32Å; F655-I661 HydrophobicContact CD1-CD1 3.54Å; F655-I661 HydrophobicContact CD1-CG1 4.43Å; F655-I661 HydrophobicContact CD2-CD1 4.08Å; F655-I661 HydrophobicContact CE1-CD1 3.49Å; F655-I661 VanDerWaalsContact CE1-CD1 3.49Å; F655-I661 HydrophobicContact CE2-CD1 4.05Å; F655-I661 HydrophobicContact CG-CD1 3.83Å; F655-I661 HydrophobicContact CZ-CD1 3.76Å; I661-K676 CarbonylContact C-O 3.54Å; I661-K676 WeakPolarHBondContact CA-O 3.42Å; I661-L677 HydrophobicContact CG1-CD1 3.67Å; I661-F686 HydrophobicContact CG2-CE1 3.78Å; I661-F686 HydrophobicContact CG2-CZ 3.94Å; I661-V691 HydrophobicContact CD1-CG1 3.68Å
662	E	88.2	Confident	81.4	Confident	39 Å²	39	64.6 Å²	64.6	18%	0.182	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	120	169.3	-179.5	172.1	-154.5	0	0	108.7	P631 G632 L664 G675 K676 I678	P631-E662 WeakPolarHBondContact CA-OE1 3.28Å; G632-E662 PolarHBondContact N-OE1 3.35Å; E662-L664 PolarHBondContact O-N 2.8Å; E662-G675 CarbonylContact O-C 3.49Å; E662-G675 WeakPolarHBondContact O-CA 3.2Å; E662-K676 HydrophobicContact CB-CB 4.37Å; E662-K676 PolarHBondContact N-O 3.08Å; E662-K676 PolarHBondContact O-N 3.46Å; E662-I678 HydrophobicContact CB-CD1 4.21Å; E662-I678 HydrophobicContact CB-CG1 4.02Å
663	L	83.3	Confident	81.4	Confident	26 Å²	26	64.2 Å²	64.2	14%	0.136	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	116.4	179.9	-172.6	69.4	0	0	0	109.7	P633 M635 W673 F686	P633-L663 HydrophobicContact CB-CB 4.35Å; P633-L663 WeakPolarHBondContact O-CB 3.29Å; P633-L663 PolarHBondContact O-N 3.24Å; M635-L663 HydrophobicContact CG-CB 4.01Å; L663-W673 HydrophobicContact CD1-CB 4.03Å; L663-W673 HydrophobicContact CD1-CD2 4.36Å; L663-W673 HydrophobicContact CD1-CE3 4.07Å; L663-W673 HydrophobicContact CD1-CG 4.41Å; L663-F686 HydrophobicContact CD1-CZ 4.28Å
664	L	80.3	Confident	81.3	Confident	91 Å²	91	66.7 Å²	66.7	48%	0.476	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	-39.4	177.5	-63.5	178.3	0	0	0	111.1	E662 E674 K676	E662-L664 PolarHBondContact O-N 2.8Å; L664-E674 PolarHBondContact N-O 3.33Å; L664-K676 HydrophobicContact CD1-CB 4.16Å; L664-K676 HydrophobicContact CG-CB 4.37Å
665	K	77.3	Confident	81.3	Confident	152 Å²	152	63.6 Å²	63.6	66%	0.661	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-154.3	112.8	175.9	-167.1	175	-175.9	172	0	110.8	E674	K665-E674 HydrophobicContact CB-CB 4.08Å; K665-E674 PolarHBondContact N-O 3.32Å; K665-E674 PolarHBondContact O-N 2.96Å
666	G	73.4	Confident	81.2	Confident	32 Å²	32	66.2 Å²	66.2	33%	0.33	36%	0.357	S	S	.	.			trans	-135.5	128.9	172.8	0	0	0	0	0	110.6
667	D	70.3	Confident	81	Confident	79 Å²	79	60.8 Å²	60.8	42%	0.422	33%	0.333	S	S	.	.			trans	-115.6	122.6	176.5	-178.9	-30.2	0	0	0	107.7	D669 T670 W673	D667-D669 PolarHBondContact O-N 2.93Å; D667-D669 VanDerWaalsContact O-N 3.15Å; D667-D669 PolarHBondContact OD1-N 3.05Å; D667-T670 HydrophobicContact CB-CG2 3.87Å; D667-T670 PolarHBondContact O-N 3.44Å; D667-T670 PolarHBondContact O-OG1 2.83Å; D667-W673 PolarHBondContact O-NE1 3.13Å
668	P	70.9	Confident	80.6	Confident	114 Å²	114	59.5 Å²	59.5	74%	0.74	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-32.6	-177.8	-27.9	36	0	0	0	114.9	T670	P668-T670 PolarHBondContact O-N 3.23Å
669	D	65.2	Low	80.5	Confident	154 Å²	154	64.1 Å²	64.1	82%	0.824	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-0.4	-177.8	-64.7	-31.1	0	0	0	112.4	D667	D667-D669 PolarHBondContact O-N 2.93Å; D667-D669 VanDerWaalsContact O-N 3.15Å; D667-D669 PolarHBondContact OD1-N 3.05Å
670	T	76.8	Confident	80.1	Confident	50 Å²	50	66.4 Å²	66.4	31%	0.307	35%	0.348	S	S	.	.			trans	-112.4	137	-179.8	69.4	0	0	0	0	112.8	D667 P668 W672 W673	D667-T670 HydrophobicContact CB-CG2 3.87Å; D667-T670 PolarHBondContact O-N 3.44Å; D667-T670 PolarHBondContact O-OG1 2.83Å; P668-T670 PolarHBondContact O-N 3.23Å; T670-W672 VanDerWaalsContact C-N 3.26Å; T670-W672 PolarHBondContact O-N 3.39Å; T670-W673 PolarHBondContact O-NE1 2.73Å
671	P	79.6	Confident	79.9	Confident	86 Å²	86	67.2 Å²	67.2	56%	0.558	35%	0.353	S	S	*	.	S	Bend	trans	-78.5	-6.4	177.3	31.4	-35.2	0	0	0	113.7	P687 S688	P671-P687 CarbonylContact O-C 3.58Å; P671-P687 VanDerWaalsContact O-CA 3.26Å; P671-P687 WeakPolarHBondContact O-CA 3.39Å; P671-S688 PolarHBondContact O-N 2.94Å
672	W	83.3	Confident	79.6	Confident	61 Å²	61	74.3 Å²	74.3	23%	0.231	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	109.9	-171.7	-77.4	110.4	0	0	0	111.5	Y641 P645 P647 T670 F685 P687	Y641-W672 HydrophobicContact CE2-CH2 4.46Å; Y641-W672 WeakPolarHBondContact OH-CH2 3.5Å; Y641-W672 WeakPolarHBondContact OH-CZ3 3.16Å; P645-W672 HydrophobicContact CG-CH2 4.31Å; P645-W672 HydrophobicContact CG-CZ2 4.19Å; P645-W672 WeakPolarHBondContact O-CH2 3.31Å; P647-W672 HydrophobicContact CB-CD2 4.35Å; P647-W672 HydrophobicContact CB-CE3 4.03Å; P647-W672 HydrophobicContact CB-CH2 4.25Å; P647-W672 HydrophobicContact CB-CZ3 3.97Å; P647-W672 HydrophobicContact CG-CE3 4.1Å; P647-W672 HydrophobicContact CG-CH2 3.99Å; P647-W672 HydrophobicContact CG-CZ3 3.62Å; T670-W672 VanDerWaalsContact C-N 3.26Å; T670-W672 PolarHBondContact O-N 3.39Å; W672-F685 HydrophobicContact CE3-CB 4.42Å; W672-P687 HydrophobicContact CE3-CG 4.49Å; W672-P687 HydrophobicContact CH2-CG 3.86Å; W672-P687 HydrophobicContact CZ3-CG 3.81Å
673	W	87.9	Confident	79.5	Confident	43 Å²	43	75.8 Å²	75.8	16%	0.163	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	157	179.3	-65.9	-8.3	0	0	0	111.6	M635 L663 D667 T670 F685 F686 S688 V691	M635-W673 HydrophobicContact CE-CE3 4.48Å; M635-W673 HydrophobicContact CE-CZ3 3.77Å; L663-W673 HydrophobicContact CD1-CB 4.03Å; L663-W673 HydrophobicContact CD1-CD2 4.36Å; L663-W673 HydrophobicContact CD1-CE3 4.07Å; L663-W673 HydrophobicContact CD1-CG 4.41Å; D667-W673 PolarHBondContact O-NE1 3.13Å; T670-W673 PolarHBondContact O-NE1 2.73Å; W673-F685 CarbonylContact O-C 3.54Å; W673-F685 VanDerWaalsContact O-CA 3.28Å; W673-F685 WeakPolarHBondContact O-CA 3.25Å; W673-F686 HydrophobicContact CB-CE2 3.96Å; W673-F686 HydrophobicContact CB-CZ 4.1Å; W673-F686 HydrophobicContact CE3-CE2 4.44Å; W673-F686 PolarHBondContact N-O 2.9Å; W673-F686 PolarHBondContact O-N 2.69Å; W673-S688 VanDerWaalsContact CD2-CB 3.41Å; W673-V691 HydrophobicContact CE3-CG2 3.98Å; W673-V691 HydrophobicContact CZ3-CG2 3.94Å
674	E	86.1	Confident	79.7	Confident	57 Å²	57	74.6 Å²	74.6	27%	0.266	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	135.1	177.9	-167.3	171.6	-168	0	0	110.1	L664 K665 F685	L664-E674 PolarHBondContact N-O 3.33Å; K665-E674 HydrophobicContact CB-CB 4.08Å; K665-E674 PolarHBondContact N-O 3.32Å; K665-E674 PolarHBondContact O-N 2.96Å; E674-F685 HydrophobicContact CB-CD1 4.1Å; E674-F685 HydrophobicContact CB-CE1 3.63Å; E674-F685 HydrophobicContact CB-CE2 4.22Å; E674-F685 HydrophobicContact CB-CZ 3.69Å; E674-F685 VanDerWaalsContact CD-CE2 3.48Å; E674-F685 HydrophobicContact CG-CD2 4.32Å; E674-F685 HydrophobicContact CG-CE1 4.11Å; E674-F685 HydrophobicContact CG-CE2 3.76Å; E674-F685 HydrophobicContact CG-CZ 3.66Å; E674-F685 WeakPolarHBondContact OE2-CZ 3.33Å
675	G	86.3	Confident	80.1	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.5	-177	178.6	0	0	0	0	0	113	E662 S683 G684	E662-G675 CarbonylContact O-C 3.49Å; E662-G675 WeakPolarHBondContact O-CA 3.2Å; G675-S683 WeakPolarHBondContact O-CA 3.38Å; G675-S683 WeakPolarHBondContact O-CB 3.34Å; G675-G684 PolarHBondContact N-O 3.02Å; G675-G684 VanDerWaalsContact N-O 3.17Å; G675-G684 PolarHBondContact O-N 3.09Å; G675-G684 VanDerWaalsContact O-N 3.11Å
676	K	86.8	Confident	80.6	Confident	61 Å²	61	64 Å²	64	27%	0.265	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	123.9	-177.1	-160	-173.2	-162.7	-170	0	109.9	I661 E662 L664 I678 Q681 K682	I661-K676 CarbonylContact C-O 3.54Å; I661-K676 WeakPolarHBondContact CA-O 3.42Å; E662-K676 HydrophobicContact CB-CB 4.37Å; E662-K676 PolarHBondContact N-O 3.08Å; E662-K676 PolarHBondContact O-N 3.46Å; L664-K676 HydrophobicContact CD1-CB 4.16Å; L664-K676 HydrophobicContact CG-CB 4.37Å; K676-I678 PolarHBondContact O-N 3.35Å; K676-Q681 WeakPolarHBondContact CE-O 3.45Å; K676-Q681 WeakPolarHBondContact CG-O 3.35Å; K676-K682 CarbonylContact C-O 3.55Å; K676-K682 WeakPolarHBondContact CA-O 3.22Å
677	L	85	Confident	81.2	Confident	9 Å²	9	63.3 Å²	63.3	5%	0.047	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	112.8	178.2	-166.8	65.9	0	0	0	108.9	L653 F655 D659 I661 Q679 T680 Q681 K682	L653-L677 HydrophobicContact CD1-CB 4.16Å; L653-L677 HydrophobicContact CD2-CB 4.39Å; F655-L677 HydrophobicContact CB-CD1 3.78Å; F655-L677 HydrophobicContact CB-CD2 4.33Å; D659-L677 HydrophobicContact CB-CD1 3.7Å; I661-L677 HydrophobicContact CG1-CD1 3.67Å; L677-Q679 PolarHBondContact O-N 2.83Å; L677-Q679 VanDerWaalsContact O-N 3.17Å; L677-T680 HydrophobicContact CD2-CG2 4.12Å; L677-T680 PolarHBondContact O-N 3.36Å; L677-T680 VanDerWaalsContact O-N 3.15Å; L677-Q681 WeakPolarHBondContact O-CA 3.2Å; L677-Q681 PolarHBondContact O-N 3.39Å; L677-K682 PolarHBondContact N-O 3.03Å
678	I	78.3	Confident	81.9	Confident	53 Å²	53	60.9 Å²	60.9	27%	0.272	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-35.6	-167.5	-67.9	175.8	0	0	0	111.6	K634 F660 E662 K676 Q681	K634-I678 HydrophobicContact CD-CD1 4.08Å; K634-I678 HydrophobicContact CG-CD1 4.1Å; F660-I678 HydrophobicContact CB-CB 4.44Å; F660-I678 HydrophobicContact CB-CD1 4.05Å; F660-I678 WeakPolarHBondContact O-CB 3.5Å; F660-I678 PolarHBondContact O-N 3.04Å; E662-I678 HydrophobicContact CB-CD1 4.21Å; E662-I678 HydrophobicContact CB-CG1 4.02Å; K676-I678 PolarHBondContact O-N 3.35Å; I678-Q681 PolarHBondContact O-NE2 3.23Å
679	Q	73.7	Confident	82.6	Confident	136 Å²	136	58.8 Å²	58.8	64%	0.636	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-37.4	179.8	-54.6	-172.1	22.6	0	0	114.1	D659 L677	D659-Q679 PolarHBondContact OD1-NE2 3.25Å; L677-Q679 PolarHBondContact O-N 2.83Å; L677-Q679 VanDerWaalsContact O-N 3.17Å
680	T	77.7	Confident	83.6	Confident	71 Å²	71	51.8 Å²	51.8	44%	0.436	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.3	-5.2	-172.5	69.6	0	0	0	0	113.9	L677 K682	L677-T680 HydrophobicContact CD2-CG2 4.12Å; L677-T680 PolarHBondContact O-N 3.36Å; L677-T680 VanDerWaalsContact O-N 3.15Å; T680-K682 PolarHBondContact O-N 2.89Å
681	Q	80.8	Confident	84	Confident	98 Å²	98	50 Å²	50	46%	0.458	26%	0.262	S	S	.	.			trans	57.4	7.5	-175.8	-62.1	-67.6	-56.1	0	0	115.4	K676 L677 I678	K676-Q681 WeakPolarHBondContact CE-O 3.45Å; K676-Q681 WeakPolarHBondContact CG-O 3.35Å; L677-Q681 WeakPolarHBondContact O-CA 3.2Å; L677-Q681 PolarHBondContact O-N 3.39Å; I678-Q681 PolarHBondContact O-NE2 3.23Å
682	K	80.3	Confident	84.1	Confident	149 Å²	149	51.6 Å²	51.6	65%	0.648	26%	0.26	S	S	*	.			trans	-70.8	138.8	173.8	-65.2	-177.6	179.3	-178.8	0	110.8	L653 K676 L677 T680	L653-K682 HydrophobicContact CD1-CB 4.06Å; L653-K682 VanDerWaalsContact CD1-O 3.3Å; L653-K682 WeakPolarHBondContact CD1-O 3.41Å; K676-K682 CarbonylContact C-O 3.55Å; K676-K682 WeakPolarHBondContact CA-O 3.22Å; L677-K682 PolarHBondContact N-O 3.03Å; T680-K682 PolarHBondContact O-N 2.89Å
683	S	87.3	Confident	84	Confident	69 Å²	69	52.6 Å²	52.6	48%	0.483	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	159.7	173.6	54.2	0	0	0	0	112.5	G675	G675-S683 WeakPolarHBondContact O-CA 3.38Å; G675-S683 WeakPolarHBondContact O-CB 3.34Å
684	G	86.5	Confident	83.3	Confident	2 Å²	2	54.3 Å²	54.3	2%	0.021	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	162.3	-172.6	176.1	0	0	0	0	0	112.7	G675	G675-G684 PolarHBondContact N-O 3.02Å; G675-G684 VanDerWaalsContact N-O 3.17Å; G675-G684 PolarHBondContact O-N 3.09Å; G675-G684 VanDerWaalsContact O-N 3.11Å
685	F	88.4	Confident	81.9	Confident	21 Å²	21	58.8 Å²	58.8	9%	0.092	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	142.9	-173.4	-73.4	-95.9	0	0	0	112.9	Y641 P647 K650 T651 P652 L653 W672 W673 E674	Y641-F685 WeakPolarHBondContact CE1-O 3.34Å; P647-F685 HydrophobicContact CB-CB 3.96Å; P647-F685 HydrophobicContact CG-CB 3.87Å; K650-F685 HydrophobicContact CB-CD2 3.7Å; K650-F685 HydrophobicContact CB-CE2 4.22Å; K650-F685 HydrophobicContact CB-CG 4.11Å; K650-F685 HydrophobicContact CD-CD1 3.81Å; K650-F685 HydrophobicContact CD-CD2 3.56Å; K650-F685 HydrophobicContact CD-CE1 3.66Å; K650-F685 HydrophobicContact CD-CE2 3.44Å; K650-F685 VanDerWaalsContact CD-CE2 3.44Å; K650-F685 HydrophobicContact CD-CG 3.76Å; K650-F685 HydrophobicContact CD-CZ 3.48Å; K650-F685 VanDerWaalsContact CD-CZ 3.48Å; K650-F685 HydrophobicContact CG-CD2 4.29Å; K650-F685 HydrophobicContact CG-CE2 4.41Å; T651-F685 PolarHBondContact O-N 3.12Å; P652-F685 WeakPolarHBondContact CA-O 3.35Å; L653-F685 PolarHBondContact N-O 3.48Å; W672-F685 HydrophobicContact CE3-CB 4.42Å; W673-F685 CarbonylContact O-C 3.54Å; W673-F685 VanDerWaalsContact O-CA 3.28Å; W673-F685 WeakPolarHBondContact O-CA 3.25Å; E674-F685 HydrophobicContact CB-CD1 4.1Å; E674-F685 HydrophobicContact CB-CE1 3.63Å; E674-F685 HydrophobicContact CB-CE2 4.22Å; E674-F685 HydrophobicContact CB-CZ 3.69Å; E674-F685 VanDerWaalsContact CD-CE2 3.48Å; E674-F685 HydrophobicContact CG-CD2 4.32Å; E674-F685 HydrophobicContact CG-CE1 4.11Å; E674-F685 HydrophobicContact CG-CE2 3.76Å; E674-F685 HydrophobicContact CG-CZ 3.66Å; E674-F685 WeakPolarHBondContact OE2-CZ 3.33Å
686	F	88.7	Confident	79.7	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	159.4	179.1	57.7	-94.7	0	0	0	112	Y641 L653 F655 I661 L663 W673 S688 V691	Y641-F686 HydrophobicContact CD1-CB 3.73Å; Y641-F686 HydrophobicContact CE1-CB 3.81Å; L653-F686 HydrophobicContact CB-CD1 4.3Å; L653-F686 HydrophobicContact CD2-CD1 4Å; L653-F686 HydrophobicContact CD2-CE1 4.23Å; F655-F686 HydrophobicContact CE1-CB 3.48Å; F655-F686 VanDerWaalsContact CE1-CB 3.48Å; F655-F686 AromaticContact CE1-CD1 3.95Å; F655-F686 HydrophobicContact CE1-CD1 3.95Å; F655-F686 HydrophobicContact CE1-CD2 4.12Å; F655-F686 AromaticContact CE1-CG 3.59Å; F655-F686 HydrophobicContact CE1-CG 3.59Å; F655-F686 HydrophobicContact CZ-CB 3.88Å; F655-F686 HydrophobicContact CZ-CD2 4.1Å; F655-F686 AromaticContact CZ-CG 4Å; F655-F686 HydrophobicContact CZ-CG 4Å; I661-F686 HydrophobicContact CG2-CE1 3.78Å; I661-F686 HydrophobicContact CG2-CZ 3.94Å; L663-F686 HydrophobicContact CD1-CZ 4.28Å; W673-F686 HydrophobicContact CB-CE2 3.96Å; W673-F686 HydrophobicContact CB-CZ 4.1Å; W673-F686 HydrophobicContact CE3-CE2 4.44Å; W673-F686 PolarHBondContact N-O 2.9Å; W673-F686 PolarHBondContact O-N 2.69Å; F686-S688 PolarHBondContact O-N 3.22Å; F686-V691 HydrophobicContact CD2-CG1 3.99Å; F686-V691 HydrophobicContact CE2-CB 4.37Å; F686-V691 HydrophobicContact CE2-CG1 3.65Å; F686-V691 HydrophobicContact CE2-CG2 3.73Å; F686-V691 HydrophobicContact CZ-CG1 4.36Å
687	P	86.5	Confident	77.3	Confident	17 Å²	17	65.6 Å²	65.6	11%	0.11	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	130.9	177.2	-17.5	31.5	0	0	0	111.1	Y641 P671 W672 S689 C690	Y641-P687 HydrophobicContact CD2-CG 4.06Å; Y641-P687 HydrophobicContact CE2-CG 3.89Å; P671-P687 CarbonylContact O-C 3.58Å; P671-P687 VanDerWaalsContact O-CA 3.26Å; P671-P687 WeakPolarHBondContact O-CA 3.39Å; W672-P687 HydrophobicContact CE3-CG 4.49Å; W672-P687 HydrophobicContact CH2-CG 3.86Å; W672-P687 HydrophobicContact CZ3-CG 3.81Å; P687-S689 PolarHBondContact O-N 2.96Å; P687-S689 VanDerWaalsContact O-N 3.15Å; P687-C690 WeakPolarHBondContact O-CB 3.29Å; P687-C690 PolarHBondContact O-N 3.22Å
688	S	84.6	Confident	74.8	Confident	28 Å²	28	73.5 Å²	73.5	20%	0.196	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-54.2	-36.8	178.7	57.1	0	0	0	0	112.5	P671 W673 F686 C690 V691	P671-S688 PolarHBondContact O-N 2.94Å; W673-S688 VanDerWaalsContact CD2-CB 3.41Å; F686-S688 PolarHBondContact O-N 3.22Å; S688-C690 PolarHBondContact O-N 2.82Å; S688-C690 VanDerWaalsContact O-N 3.07Å; S688-V691 WeakPolarHBondContact O-CG2 3.22Å; S688-V691 PolarHBondContact O-N 3.3Å
689	S	84.8	Confident	72.7	Confident	69 Å²	69	75.9 Å²	75.9	48%	0.483	40%	0.404	S	S	.	.	G	3₁₀ helix	trans	-64.3	-8.1	177	79.4	0	0	0	0	115.9	R639 P687	R639-S689 VanDerWaalsContact CZ-O 3.26Å; R639-S689 PolarHBondContact NH1-O 3.46Å; R639-S689 PolarHBondContact NH1-OG 3.32Å; R639-S689 VanDerWaalsContact NH1-OG 3.12Å; R639-S689 PolarHBondContact NH2-O 3.08Å; P687-S689 PolarHBondContact O-N 2.96Å; P687-S689 VanDerWaalsContact O-N 3.15Å
690	C	85.3	Confident	70.6	Confident	8 Å²	8	79.7 Å²	79.7	5%	0.054	42%	0.419	C	S	.	.	G	3₁₀ helix	trans	-92.7	-3.7	178.8	-66.5	0	0	0	0	113.5	A637 V638 R639 F655 P687 S688	A637-C690 WeakPolarHBondContact CA-O 3.23Å; V638-C690 WeakPolarHBondContact CG2-O 3.45Å; V638-C690 PolarHBondContact N-O 3.35Å; R639-C690 HydrophobicContact CB-CB 4.36Å; R639-C690 PolarHBondContact N-O 2.95Å; R639-C690 PolarHBondContact NH1-SG 2.91Å; R639-C690 VanDerWaalsContact NH1-SG 3.44Å; F655-C690 HydrophobicContact CE2-CB 4.09Å; F655-C690 HydrophobicContact CZ-CB 4.01Å; P687-C690 WeakPolarHBondContact O-CB 3.29Å; P687-C690 PolarHBondContact O-N 3.22Å; S688-C690 PolarHBondContact O-N 2.82Å; S688-C690 VanDerWaalsContact O-N 3.07Å
691	V	85.4	Confident	68.4	Low	13 Å²	13	85 Å²	85	8%	0.079	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	162.3	-179.6	-57.1	0	0	0	0	112.4	M635 V636 F655 I661 W673 F686 S688	M635-V691 HydrophobicContact CB-CB 4.14Å; M635-V691 HydrophobicContact CB-CG2 4.35Å; M635-V691 HydrophobicContact CE-CB 4.41Å; M635-V691 HydrophobicContact CE-CG2 3.67Å; V636-V691 CarbonylContact O-C 3.49Å; V636-V691 WeakPolarHBondContact O-CA 3.48Å; F655-V691 HydrophobicContact CE2-CG1 4.37Å; F655-V691 HydrophobicContact CZ-CG1 3.97Å; I661-V691 HydrophobicContact CD1-CG1 3.68Å; W673-V691 HydrophobicContact CE3-CG2 3.98Å; W673-V691 HydrophobicContact CZ3-CG2 3.94Å; F686-V691 HydrophobicContact CD2-CG1 3.99Å; F686-V691 HydrophobicContact CE2-CB 4.37Å; F686-V691 HydrophobicContact CE2-CG1 3.65Å; F686-V691 HydrophobicContact CE2-CG2 3.73Å; F686-V691 HydrophobicContact CZ-CG1 4.36Å; S688-V691 WeakPolarHBondContact O-CG2 3.22Å; S688-V691 PolarHBondContact O-N 3.3Å
692	K	82.9	Confident	65.8	Low	118 Å²	118	85.2 Å²	85.2	51%	0.513	45%	0.451	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	159.9	164.5	71.8	-179.8	173.8	-178.1	0	110.5	M635 V636 V638 Y694	M635-K692 CarbonylContact C-O 3.52Å; M635-K692 VanDerWaalsContact CA-O 3.26Å; M635-K692 WeakPolarHBondContact CA-O 3.27Å; V636-K692 HydrophobicContact CG1-CD 4.3Å; V636-K692 HydrophobicContact CG1-CG 3.63Å; V636-K692 PolarHBondContact N-O 3.35Å; V636-K692 PolarHBondContact O-N 2.97Å; V638-K692 HydrophobicContact CG1-CB 4.01Å; V638-K692 HydrophobicContact CG1-CD 3.6Å; V638-K692 HydrophobicContact CG1-CG 3.55Å; K692-Y694 PolarHBondContact O-N 3.44Å
693	P	80.4	Confident	63.3	Low	82 Å²	82	86.3 Å²	86.3	53%	0.532	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.7	135.5	171.4	-24.9	35.2	0	0	0	111.9	M635 L695	M635-P693 HydrophobicContact CE-CG 4.18Å; M635-P693 HydrophobicContact SD-CB 4.37Å; M635-P693 HydrophobicContact SD-CG 4.33Å; P693-L695 PolarHBondContact O-N 2.87Å
694	Y	72.9	Confident	60.5	Low	80 Å²	80	88.6 Å²	88.6	31%	0.314	48%	0.479	S	S	.	.			trans	-80.5	99.2	169.5	177.1	-99.9	0	0	0	109.1	K634 F660 K692 D696 P697	K634-Y694 WeakPolarHBondContact O-CB 3.47Å; K634-Y694 PolarHBondContact O-N 3.13Å; F660-Y694 HydrophobicContact CD1-CD2 4.15Å; F660-Y694 HydrophobicContact CD1-CG 4.42Å; F660-Y694 AromaticContact CE1-CD2 3.5Å; F660-Y694 HydrophobicContact CE1-CD2 3.5Å; F660-Y694 VanDerWaalsContact CE1-CD2 3.5Å; F660-Y694 AromaticContact CE1-CE2 3.71Å; F660-Y694 HydrophobicContact CE1-CE2 3.71Å; F660-Y694 HydrophobicContact CE1-CG 4.18Å; F660-Y694 HydrophobicContact CZ-CD2 4.44Å; F660-Y694 HydrophobicContact CZ-CE2 4.23Å; K692-Y694 PolarHBondContact O-N 3.44Å; Y694-D696 HydrophobicContact CE1-CB 3.84Å; Y694-D696 WeakPolarHBondContact CE1-OD1 3.41Å; Y694-D696 PolarHBondContact OH-OD1 3.28Å; Y694-P697 VanDerWaalsContact OH-CD 3.27Å; Y694-P697 WeakPolarHBondContact OH-CD 3.4Å
695	L	57.3	Low	57.7	Low	151 Å²	151	93.2 Å²	93.2	79%	0.791	51%	0.511	S	S	*	.			trans	-84.9	118.9	166.6	-62.3	175.1	0	0	0	108	P693 P697	P693-L695 PolarHBondContact O-N 2.87Å; L695-P697 WeakPolarHBondContact O-CD 3.42Å
696	D	39.6	Very low	55	Low	100 Å²	100	104.6 Å²	104.6	54%	0.535	55%	0.553	S	S	.	*			trans	-69.4	117.9	-175.2	-167.3	50.8	0	0	0	111	Y694 K698	Y694-D696 HydrophobicContact CE1-CB 3.84Å; Y694-D696 WeakPolarHBondContact CE1-OD1 3.41Å; Y694-D696 PolarHBondContact OH-OD1 3.28Å; D696-K698 VanDerWaalsContact C-N 3.29Å; D696-K698 PolarHBondContact O-N 3.22Å
697	P	37.1	Very low	52.1	Low	103 Å²	103	113.3 Å²	113.3	67%	0.669	59%	0.594	S	S	*	*			trans	-81.7	73.4	-172.6	34.1	-34.5	0	0	0	110.8	Y694 L695	Y694-P697 VanDerWaalsContact OH-CD 3.27Å; Y694-P697 WeakPolarHBondContact OH-CD 3.4Å; L695-P697 WeakPolarHBondContact O-CD 3.42Å
698	K	32.9	Very low	49.2	Very low	175 Å²	175	117.4 Å²	117.4	76%	0.761	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-64.4	132	167.9	-76.1	-168.3	174.8	-177.6	0	109.8	D696	D696-K698 VanDerWaalsContact C-N 3.29Å; D696-K698 PolarHBondContact O-N 3.22Å
699	P	34.3	Very low	47	Very low	104 Å²	104	120.2 Å²	120.2	68%	0.675	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-74.5	148.6	-167.5	29.4	-36.1	0	0	0	112.5	Q701	P699-Q701 PolarHBondContact O-N 3.49Å; P699-Q701 VanDerWaalsContact O-N 3.16Å
700	F	29	Very low	44.9	Very low	216 Å²	216	123 Å²	123	95%	0.947	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-48.9	117.2	147.3	-97.9	-118	0	0	0	108.6
701	Q	30.6	Very low	43	Very low	181 Å²	181	131.9 Å²	131.9	85%	0.846	68%	0.684	S	S	*	*	P	Polyproline II helix	trans	-93.3	120.5	157.3	-79	-167.2	-27.3	0	0	108.4	P699	P699-Q701 PolarHBondContact O-N 3.49Å; P699-Q701 VanDerWaalsContact O-N 3.16Å
702	S	26.9	Very low	41.6	Very low	104 Å²	104	134.1 Å²	134.1	73%	0.727	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-64.7	139.1	172.1	45.7	0	0	0	0	110.9	S704	S702-S704 PolarHBondContact O-N 3.48Å; S702-S704 VanDerWaalsContact O-N 3.09Å
703	L	28.4	Very low	40.8	Very low	171 Å²	171	134.4 Å²	134.4	90%	0.895	71%	0.711	S	S	*	*			trans	-59.3	110.2	164.5	-73.5	163.4	0	0	0	109.3
704	S	27.3	Very low	40.7	Very low	117 Å²	117	132.3 Å²	132.3	82%	0.818	69%	0.692	S	S	*	*			trans	-158.9	32.9	168.1	-84	0	0	0	0	114.3	S702	S702-S704 PolarHBondContact O-N 3.48Å; S702-S704 VanDerWaalsContact O-N 3.09Å
705	S	27.6	Very low	40.8	Very low	99 Å²	99	135.3 Å²	135.3	69%	0.692	70%	0.704	S	S	*	*	S	Bend	trans	-126.7	142	147.4	72.9	0	0	0	0	108.3	Q707	S705-Q707 PolarHBondContact O-N 3.05Å
706	R	33.3	Very low	41.6	Very low	261 Å²	261	131.6 Å²	131.6	99%	0.985	70%	0.702	S	S	*	*			trans	-79.9	83.6	-167	-70.1	-180	176.4	173.6	-2.2	111.8
707	Q	26.2	Very low	43.5	Very low	182 Å²	182	130.8 Å²	130.8	85%	0.85	69%	0.692	S	S	*	*			trans	-84.5	129.9	155.4	-71.8	-176.7	-29.1	0	0	109	S705	S705-Q707 PolarHBondContact O-N 3.05Å
708	S	26.6	Very low	45.8	Very low	103 Å²	103	128.5 Å²	128.5	72%	0.72	68%	0.678	S	S	*	*			trans	-71.3	131.4	178.6	49.4	0	0	0	0	111	R710	S708-R710 PolarHBondContact O-N 3.27Å
709	S	38.7	Very low	48.6	Very low	88 Å²	88	120.5 Å²	120.5	62%	0.615	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.2	56.5	-179	53.1	0	0	0	0	113.7
710	R	40.4	Very low	51.4	Low	127 Å²	127	115.7 Å²	115.7	48%	0.479	61%	0.611	S	S	.	*	T	Hydrogen-bonded Turn	trans	-119.4	-8.1	-175.3	-91.3	-170.9	164.8	-161.8	-4.9	116.6	S708 E749 R752	S708-R710 PolarHBondContact O-N 3.27Å; R710-E749 IonicContact CZ-OE1 3.3Å; R710-E749 IonicContact NH1-OE1 3.14Å; R710-E749 PolarHBondContact NH1-OE1 3.05Å; R710-E749 IonicContact NH2-OE1 2.68Å; R710-E749 PolarHBondContact NH2-OE1 3.39Å; R710-R752 PolarHBondContact O-NH1 2.86Å
711	E	45.7	Very low	54.2	Low	195 Å²	195	106.3 Å²	106.3	91%	0.911	57%	0.573	S	S	*	*			trans	-135	82.7	175.5	-67.3	-172	147	0	0	111.2
712	A	56.6	Low	56.9	Low	60 Å²	60	97.8 Å²	97.8	50%	0.496	53%	0.534	S	S	.	.			trans	-101.1	127.9	157.1	0	0	0	0	0	107.5	Y714	A712-Y714 HydrophobicContact CB-CE1 4.4Å; A712-Y714 HydrophobicContact CB-CE2 4Å; A712-Y714 VanDerWaalsContact O-CD2 3.28Å; A712-Y714 WeakPolarHBondContact O-CD2 3.34Å; A712-Y714 PolarHBondContact O-N 3.34Å
713	D	65.8	Low	59.7	Low	124 Å²	124	97.7 Å²	97.7	66%	0.663	53%	0.525	S	S	*	.			trans	-76.8	105.1	-178.1	-175.2	-0.6	0	0	0	111	Y715	D713-Y715 WeakPolarHBondContact OD1-CB 3.48Å; D713-Y715 WeakPolarHBondContact OD1-CD2 3.34Å; D713-Y715 PolarHBondContact OD1-N 3.02Å
714	Y	77.9	Confident	62.5	Low	38 Å²	38	91 Å²	91	15%	0.149	49%	0.489	C	S	.	.			trans	-92.4	-5.1	175.9	-60.8	-67.7	0	0	0	113.8	A712 G716 Y717 W719 F720 F753 L786	A712-Y714 HydrophobicContact CB-CE1 4.4Å; A712-Y714 HydrophobicContact CB-CE2 4Å; A712-Y714 VanDerWaalsContact O-CD2 3.28Å; A712-Y714 WeakPolarHBondContact O-CD2 3.34Å; A712-Y714 PolarHBondContact O-N 3.34Å; Y714-G716 PolarHBondContact O-N 3.21Å; Y714-Y717 HydrophobicContact CD1-CD2 4.32Å; Y714-Y717 HydrophobicContact CD1-CE2 4.36Å; Y714-Y717 PolarHBondContact O-N 2.82Å; Y714-W719 AromaticContact CD1-CH2 3.92Å; Y714-W719 HydrophobicContact CD1-CH2 3.92Å; Y714-F720 VanDerWaalsContact O-CB 3.22Å; Y714-F720 WeakPolarHBondContact O-CB 3.44Å; Y714-F720 WeakPolarHBondContact O-CD1 3.09Å; Y714-F753 HydrophobicContact CD2-CZ 4.3Å; Y714-F753 HydrophobicContact CE2-CZ 4.06Å; Y714-L786 HydrophobicContact CD2-CD2 4.31Å; Y714-L786 HydrophobicContact CE1-CB 4.21Å; Y714-L786 HydrophobicContact CE1-CD2 4.35Å; Y714-L786 HydrophobicContact CE2-CD2 4.1Å
715	Y	75.5	Confident	65.3	Low	143 Å²	143	91.3 Å²	91.3	56%	0.561	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-24.8	-174.1	-73.2	-83.2	0	0	0	113.6	D713 Y717 F720	D713-Y715 WeakPolarHBondContact OD1-CB 3.48Å; D713-Y715 WeakPolarHBondContact OD1-CD2 3.34Å; D713-Y715 PolarHBondContact OD1-N 3.02Å; Y715-Y717 VanDerWaalsContact C-N 3.25Å; Y715-Y717 PolarHBondContact O-N 3.49Å; Y715-F720 HydrophobicContact CD1-CD1 4.21Å; Y715-F720 HydrophobicContact CD1-CE1 4.2Å; Y715-F720 HydrophobicContact CD2-CE1 4.33Å; Y715-F720 HydrophobicContact CE1-CD1 4.45Å; Y715-F720 HydrophobicContact CE1-CE1 4.06Å; Y715-F720 HydrophobicContact CE2-CE1 4.19Å; Y715-F720 HydrophobicContact CG-CD1 4.35Å; Y715-F720 HydrophobicContact CG-CE1 4.34Å
716	G	72.9	Confident	68.2	Low	73 Å²	73	93.6 Å²	93.6	75%	0.753	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-15.4	172.6	0	0	0	0	0	115.4	Y714	Y714-G716 PolarHBondContact O-N 3.21Å
717	Y	80.5	Confident	70.8	Confident	83 Å²	83	87.8 Å²	87.8	33%	0.325	46%	0.456	S	S	.	.	S	Bend	trans	-87.1	137.2	-177	-69.8	-83.9	0	0	0	113	Y714 Y715 W719 F720 L787	Y714-Y717 HydrophobicContact CD1-CD2 4.32Å; Y714-Y717 HydrophobicContact CD1-CE2 4.36Å; Y714-Y717 PolarHBondContact O-N 2.82Å; Y715-Y717 VanDerWaalsContact C-N 3.25Å; Y715-Y717 PolarHBondContact O-N 3.49Å; Y717-W719 AromaticContact CD1-CE2 3.84Å; Y717-W719 AromaticContact CD1-CZ2 3.8Å; Y717-W719 HydrophobicContact CD1-CZ2 3.8Å; Y717-W719 AromaticContact CD1-NE1 3.63Å; Y717-W719 HydrophobicContact CD2-CH2 4.35Å; Y717-W719 AromaticContact CD2-CZ2 4Å; Y717-W719 HydrophobicContact CD2-CZ2 4Å; Y717-W719 HydrophobicContact CE1-CZ2 4.42Å; Y717-W719 AromaticContact CG-CE2 3.73Å; Y717-W719 HydrophobicContact CG-CH2 4.26Å; Y717-W719 AromaticContact CG-CZ2 3.56Å; Y717-W719 HydrophobicContact CG-CZ2 3.56Å; Y717-W719 AromaticContact CG-NE1 3.94Å; Y717-W719 PolarHBondContact O-N 3.12Å; Y717-W719 VanDerWaalsContact O-N 3.14Å; Y717-F720 PolarHBondContact O-N 2.87Å; Y717-F720 VanDerWaalsContact O-N 3.14Å; Y717-L787 HydrophobicContact CD1-CD1 4.32Å; Y717-L787 HydrophobicContact CE1-CD1 3.65Å
718	P	85.5	Confident	73.8	Confident	55 Å²	55	83.9 Å²	83.9	36%	0.357	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-6.6	-178.4	30.6	-36.7	0	0	0	114.1	P812 K814	P718-P812 HydrophobicContact CB-CB 4.02Å; P718-P812 HydrophobicContact CG-CB 4.1Å; P718-P812 HydrophobicContact CG-CG 4.36Å; P718-P812 WeakPolarHBondContact O-CB 3.36Å; P718-K814 HydrophobicContact CB-CB 4.01Å; P718-K814 VanDerWaalsContact O-CB 3.26Å; P718-K814 WeakPolarHBondContact O-CB 3.07Å; P718-K814 PolarHBondContact O-N 3.24Å; P718-K814 VanDerWaalsContact O-N 3.09Å
719	W	90.9	Very high	76.8	Confident	7 Å²	7	79 Å²	79	3%	0.027	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99	-14.8	173.5	48.1	-105.8	0	0	0	113.3	Y714 Y717 Y741 L742 I743 L786 L787 V790 P812	Y714-W719 AromaticContact CD1-CH2 3.92Å; Y714-W719 HydrophobicContact CD1-CH2 3.92Å; Y717-W719 AromaticContact CD1-CE2 3.84Å; Y717-W719 AromaticContact CD1-CZ2 3.8Å; Y717-W719 HydrophobicContact CD1-CZ2 3.8Å; Y717-W719 AromaticContact CD1-NE1 3.63Å; Y717-W719 HydrophobicContact CD2-CH2 4.35Å; Y717-W719 AromaticContact CD2-CZ2 4Å; Y717-W719 HydrophobicContact CD2-CZ2 4Å; Y717-W719 HydrophobicContact CE1-CZ2 4.42Å; Y717-W719 AromaticContact CG-CE2 3.73Å; Y717-W719 HydrophobicContact CG-CH2 4.26Å; Y717-W719 AromaticContact CG-CZ2 3.56Å; Y717-W719 HydrophobicContact CG-CZ2 3.56Å; Y717-W719 AromaticContact CG-NE1 3.94Å; Y717-W719 PolarHBondContact O-N 3.12Å; Y717-W719 VanDerWaalsContact O-N 3.14Å; W719-Y741 HydrophobicContact CB-CD2 4.24Å; W719-Y741 HydrophobicContact CB-CE2 3.42Å; W719-Y741 VanDerWaalsContact CB-CE2 3.42Å; W719-Y741 HydrophobicContact CG-CE2 4.01Å; W719-L742 CarbonylContact O-C 3.5Å; W719-L742 VanDerWaalsContact O-CA 3.3Å; W719-L742 WeakPolarHBondContact O-CA 3.34Å; W719-I743 HydrophobicContact CE3-CB 3.97Å; W719-I743 HydrophobicContact CE3-CD1 3.78Å; W719-I743 HydrophobicContact CE3-CG1 3.93Å; W719-I743 HydrophobicContact CZ3-CB 4.23Å; W719-I743 HydrophobicContact CZ3-CD1 3.95Å; W719-I743 HydrophobicContact CZ3-CG1 4.4Å; W719-I743 PolarHBondContact O-N 2.96Å; W719-L786 HydrophobicContact CH2-CD2 4.47Å; W719-L786 HydrophobicContact CH2-CG 4.47Å; W719-L786 HydrophobicContact CZ3-CD2 4.32Å; W719-L787 HydrophobicContact CZ2-CD1 4.01Å; W719-V790 HydrophobicContact CD2-CG1 4.23Å; W719-V790 HydrophobicContact CG-CG1 4.28Å; W719-V790 HydrophobicContact CH2-CG2 4.45Å; W719-V790 HydrophobicContact CZ2-CG1 4.48Å; W719-V790 HydrophobicContact CZ2-CG2 4.41Å; W719-V790 HydrophobicContact CZ3-CG2 4.5Å; W719-P812 HydrophobicContact CB-CB 4Å
720	F	92.9	Very high	79.2	Confident	3 Å²	3	76.7 Å²	76.7	1%	0.013	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	133.7	-177.1	-168.3	-112.3	0	0	0	111.6	Y714 Y715 Y717 I743 F753 Y813 K814	Y714-F720 VanDerWaalsContact O-CB 3.22Å; Y714-F720 WeakPolarHBondContact O-CB 3.44Å; Y714-F720 WeakPolarHBondContact O-CD1 3.09Å; Y715-F720 HydrophobicContact CD1-CD1 4.21Å; Y715-F720 HydrophobicContact CD1-CE1 4.2Å; Y715-F720 HydrophobicContact CD2-CE1 4.33Å; Y715-F720 HydrophobicContact CE1-CD1 4.45Å; Y715-F720 HydrophobicContact CE1-CE1 4.06Å; Y715-F720 HydrophobicContact CE2-CE1 4.19Å; Y715-F720 HydrophobicContact CG-CD1 4.35Å; Y715-F720 HydrophobicContact CG-CE1 4.34Å; Y717-F720 PolarHBondContact O-N 2.87Å; Y717-F720 VanDerWaalsContact O-N 3.14Å; F720-I743 HydrophobicContact CD2-CB 4.39Å; F720-I743 HydrophobicContact CD2-CG2 4.41Å; F720-F753 HydrophobicContact CE2-CD1 4.12Å; F720-F753 AromaticContact CE2-CE1 3.82Å; F720-F753 HydrophobicContact CE2-CE1 3.82Å; F720-F753 HydrophobicContact CZ-CE1 4.15Å; F720-Y813 PolarHBondContact O-OH 3.17Å; F720-K814 PolarHBondContact O-NZ 3.37Å
721	A	87.3	Confident	81.6	Confident	18 Å²	18	76.3 Å²	76.3	15%	0.149	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	-1.9	-174.6	0	0	0	0	0	114.4	M724 L742 I743 Y813	A721-M724 HydrophobicContact CB-CE 3.92Å; A721-M724 HydrophobicContact CB-SD 4.04Å; A721-L742 HydrophobicContact CB-CB 4.4Å; A721-L742 HydrophobicContact CB-CD1 4.06Å; A721-I743 WeakPolarHBondContact CB-O 3.41Å; A721-I743 PolarHBondContact N-O 3.13Å; A721-Y813 WeakPolarHBondContact CA-OH 3.46Å; A721-Y813 HydrophobicContact CB-CE1 3.94Å
722	G	87.1	Confident	83.7	Confident	2 Å²	2	70 Å²	70	2%	0.021	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	69	-157.7	-173.3	0	0	0	0	0	112.4	M724 R744 E745	G722-M724 PolarHBondContact O-N 2.81Å; G722-R744 CarbonylContact O-C 3.59Å; G722-R744 WeakPolarHBondContact O-CA 3.33Å; G722-E745 PolarHBondContact O-N 3.09Å
723	N	87.2	Confident	85.2	Confident	103 Å²	103	67.2 Å²	67.2	55%	0.551	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.1	113.5	173.8	-174	12.8	0	0	0	110
724	M	87.1	Confident	86.1	Confident	29 Å²	29	68.4 Å²	68.4	14%	0.143	34%	0.34	C	S	.	.			trans	-151.3	133.9	-176.6	174.1	-175.7	-72.5	0	0	110.8	A721 G722 Q728 A729 L732 L742 R744 E745	A721-M724 HydrophobicContact CB-CE 3.92Å; A721-M724 HydrophobicContact CB-SD 4.04Å; G722-M724 PolarHBondContact O-N 2.81Å; M724-Q728 HydrophobicContact CG-CB 3.71Å; M724-Q728 HydrophobicContact SD-CB 4.43Å; M724-A729 HydrophobicContact SD-CB 4.02Å; M724-L732 HydrophobicContact CE-CD2 4.07Å; M724-L732 HydrophobicContact SD-CD2 4.49Å; M724-L742 HydrophobicContact SD-CD1 4.12Å; M724-L742 HydrophobicContact SD-CD2 4.05Å; M724-R744 HydrophobicContact CB-CB 3.79Å; M724-R744 HydrophobicContact CG-CB 4.44Å; M724-R744 VanDerWaalsContact O-CD 3.26Å; M724-R744 WeakPolarHBondContact O-CD 3.24Å; M724-R744 PolarHBondContact O-NH1 3.31Å; M724-E745 PolarHBondContact N-O 2.94Å
725	E	86.4	Confident	86.3	Confident	125 Å²	125	71.5 Å²	71.5	58%	0.584	37%	0.367	S	S	*	.			trans	-76.6	170.6	-178.3	-65.5	-157	164.5	0	0	113.4	Q728 A729	E725-Q728 HydrophobicContact CB-CG 4.25Å; E725-A729 PolarHBondContact O-N 2.7Å
726	R	87.8	Confident	86.8	Confident	147 Å²	147	66.6 Å²	66.6	56%	0.555	35%	0.349	S	S	*	.	H	α-helix	trans	-61.5	-53.8	179.4	-168.1	-175	171.4	160	-1.7	111.6	Q728 A729 D730 H765	R726-Q728 VanDerWaalsContact C-N 3.29Å; R726-Q728 PolarHBondContact O-N 3.08Å; R726-A729 PolarHBondContact O-N 3.35Å; R726-A729 VanDerWaalsContact O-N 3.12Å; R726-D730 IonicContact NE-OD2 2.61Å; R726-D730 PolarHBondContact O-N 3.19Å; R726-D730 VanDerWaalsContact O-OD2 3.1Å; R726-H765 VanDerWaalsContact CZ-CD2 3.46Å; R726-H765 PolarHBondContact NE-CD2 3.3Å; R726-H765 PolarHBondContact NH2-CD2 2.85Å; R726-H765 PolarHBondContact O-NE2 3.47Å
727	Q	88.8	Confident	87.4	Confident	138 Å²	138	65.7 Å²	65.7	65%	0.645	33%	0.33	S	S	*	.	H	α-helix	trans	-64.4	-32.4	-176.3	-62.9	-179.8	-1.7	0	0	112.8	D730 N731	Q727-D730 PolarHBondContact O-N 3.06Å; Q727-N731 WeakPolarHBondContact O-CB 3.39Å; Q727-N731 PolarHBondContact O-N 3.13Å; Q727-N731 PolarHBondContact O-ND2 3.31Å
728	Q	87.8	Confident	87.7	Confident	100 Å²	100	64.2 Å²	64.2	47%	0.467	33%	0.332	S	S	.	.	H	α-helix	trans	-64.4	-45.7	174	-68.1	171.5	-17.8	0	0	111	M724 E725 R726 N731 L732	M724-Q728 HydrophobicContact CG-CB 3.71Å; M724-Q728 HydrophobicContact SD-CB 4.43Å; E725-Q728 HydrophobicContact CB-CG 4.25Å; R726-Q728 VanDerWaalsContact C-N 3.29Å; R726-Q728 PolarHBondContact O-N 3.08Å; Q728-N731 PolarHBondContact O-N 2.87Å; Q728-L732 VanDerWaalsContact O-CB 3.29Å; Q728-L732 WeakPolarHBondContact O-CB 3.4Å; Q728-L732 PolarHBondContact O-N 3.41Å
729	A	89.4	Confident	87.7	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-67.8	-35.9	175.6	0	0	0	0	0	113	M724 E725 R726 L733 L742	M724-A729 HydrophobicContact SD-CB 4.02Å; E725-A729 PolarHBondContact O-N 2.7Å; R726-A729 PolarHBondContact O-N 3.35Å; R726-A729 VanDerWaalsContact O-N 3.12Å; A729-L733 WeakPolarHBondContact O-CB 3.22Å; A729-L733 WeakPolarHBondContact O-CG 3.21Å; A729-L733 PolarHBondContact O-N 3.07Å; A729-L742 HydrophobicContact CB-CD1 4.02Å; A729-L742 HydrophobicContact CB-CD2 4.21Å
730	D	89.4	Confident	87.8	Confident	41 Å²	41	61.4 Å²	61.4	22%	0.219	32%	0.315	C	S	.	.	H	α-helix	trans	-58.8	-54.1	172.7	-72.2	-48.7	0	0	0	110.8	R726 Q727 L732 K734 V763 H765	R726-D730 IonicContact NE-OD2 2.61Å; R726-D730 PolarHBondContact O-N 3.19Å; R726-D730 VanDerWaalsContact O-OD2 3.1Å; Q727-D730 PolarHBondContact O-N 3.06Å; D730-L732 PolarHBondContact O-N 3.09Å; D730-K734 WeakPolarHBondContact O-CB 3.31Å; D730-K734 PolarHBondContact O-N 2.74Å; D730-V763 WeakPolarHBondContact OD1-CB 3.45Å; D730-H765 PolarHBondContact N-NE2 3.44Å; D730-H765 IonicContact OD1-NE2 3.35Å; D730-H765 PolarHBondContact OD1-NE2 3.07Å; D730-H765 IonicContact OD2-NE2 3.35Å
731	N	90.3	Very high	87.8	Confident	119 Å²	119	61.2 Å²	61.2	64%	0.636	31%	0.314	S	S	*	.	H	α-helix	trans	-62.2	-42.3	-179.7	-75.3	-23.4	0	0	0	112.4	Q727 Q728	Q727-N731 WeakPolarHBondContact O-CB 3.39Å; Q727-N731 PolarHBondContact O-N 3.13Å; Q727-N731 PolarHBondContact O-ND2 3.31Å; Q728-N731 PolarHBondContact O-N 2.87Å
732	L	89.6	Confident	88.2	Confident	63 Å²	63	60.4 Å²	60.4	33%	0.33	31%	0.307	S	S	.	.	H	α-helix	trans	-67	-43.7	-178.9	-175.9	60.9	0	0	0	112.3	M724 Q728 D730 S735 H736 L742 Y813	M724-L732 HydrophobicContact CE-CD2 4.07Å; M724-L732 HydrophobicContact SD-CD2 4.49Å; Q728-L732 VanDerWaalsContact O-CB 3.29Å; Q728-L732 WeakPolarHBondContact O-CB 3.4Å; Q728-L732 PolarHBondContact O-N 3.41Å; D730-L732 PolarHBondContact O-N 3.09Å; L732-S735 PolarHBondContact O-OG 2.9Å; L732-H736 PolarHBondContact O-CE1 2.96Å; L732-H736 PolarHBondContact O-ND1 3.28Å; L732-L742 HydrophobicContact CD2-CD2 3.95Å; L732-Y813 HydrophobicContact CD2-CD2 3.73Å; L732-Y813 HydrophobicContact CD2-CE2 3.71Å; L732-Y813 HydrophobicContact CG-CD2 4.45Å
733	L	89.2	Confident	88.5	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-78.3	-20.5	-179.1	-69.8	174.5	0	0	0	113.3	A729 S735 H736 T740 L742 S756 K758 V763	A729-L733 WeakPolarHBondContact O-CB 3.22Å; A729-L733 WeakPolarHBondContact O-CG 3.21Å; A729-L733 PolarHBondContact O-N 3.07Å; L733-S735 VanDerWaalsContact C-N 3.26Å; L733-S735 PolarHBondContact O-N 3.33Å; L733-S735 VanDerWaalsContact O-N 3.15Å; L733-H736 PolarHBondContact O-N 3.07Å; L733-T740 HydrophobicContact CD2-CG2 3.82Å; L733-L742 HydrophobicContact CD1-CD2 4.18Å; L733-L742 HydrophobicContact CD1-CG 4.19Å; L733-L742 HydrophobicContact CD2-CD2 4.25Å; L733-L742 HydrophobicContact CG-CD2 4.01Å; L733-S756 WeakPolarHBondContact CD1-O 3.35Å; L733-K758 HydrophobicContact CB-CB 4.42Å; L733-K758 WeakPolarHBondContact O-CD 3.4Å; L733-V763 HydrophobicContact CB-CG1 4.49Å; L733-V763 HydrophobicContact CB-CG2 3.76Å; L733-V763 HydrophobicContact CD1-CG1 3.92Å
734	K	83.8	Confident	88.8	Confident	150 Å²	150	55.9 Å²	55.9	65%	0.652	28%	0.282	S	S	*	.	H	α-helix	trans	-51.9	-39.2	-176.3	-172.9	171.2	178.1	177.4	0	114.1	D730 K758	D730-K734 WeakPolarHBondContact O-CB 3.31Å; D730-K734 PolarHBondContact O-N 2.74Å; K734-K758 PolarHBondContact O-NZ 3.07Å
735	S	82.1	Confident	88.8	Confident	102 Å²	102	56.3 Å²	56.3	71%	0.713	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-15.5	179.6	51.5	0	0	0	0	115.1	L732 L733	L732-S735 PolarHBondContact O-OG 2.9Å; L733-S735 VanDerWaalsContact C-N 3.26Å; L733-S735 PolarHBondContact O-N 3.33Å; L733-S735 VanDerWaalsContact O-N 3.15Å
736	H	86.6	Confident	88.1	Confident	41 Å²	41	53.7 Å²	53.7	19%	0.19	27%	0.268	C	S	.	.	S	Bend	trans	-85	167.7	-172.4	-69.3	79	0	0	0	113	L732 L733 T740 K758	L732-H736 PolarHBondContact O-CE1 2.96Å; L732-H736 PolarHBondContact O-ND1 3.28Å; L733-H736 PolarHBondContact O-N 3.07Å; H736-T740 HydrophobicContact CB-CG2 3.9Å; H736-K758 WeakPolarHBondContact O-CD 3.47Å; H736-K758 PolarHBondContact O-NZ 2.91Å
737	C	85.7	Confident	86.9	Confident	53 Å²	53	53 Å²	53	36%	0.358	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-72.3	155.1	173.1	64.6	0	0	0	0	113.5	T740 E817	C737-T740 VanDerWaalsContact O-CB 3.27Å; C737-T740 WeakPolarHBondContact O-CB 3.49Å; C737-T740 PolarHBondContact O-N 2.91Å; C737-T740 VanDerWaalsContact O-N 3.17Å; C737-T740 PolarHBondContact O-OG1 3.34Å; C737-T740 PolarHBondContact SG-OG1 3.24Å; C737-T740 VanDerWaalsContact SG-OG1 3.38Å; C737-E817 PolarHBondContact SG-OE1 2.86Å
738	S	87.6	Confident	85.4	Confident	52 Å²	52	48.8 Å²	48.8	36%	0.364	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	133.3	177.9	-171.3	0	0	0	0	111.5
739	G	84.4	Confident	83.9	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	95.2	-3.2	-169.4	0	0	0	0	0	114.4	K758 R810 H811	G739-K758 PolarHBondContact N-O 3.5Å; G739-R810 PolarHBondContact O-N 3.41Å; G739-H811 PolarHBondContact O-N 2.92Å
740	T	92.5	Very high	81.9	Confident	3 Å²	3	55 Å²	55	2%	0.018	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	131.5	172.3	-53.5	0	0	0	0	111.2	L733 H736 C737 I757 K758 H811	L733-T740 HydrophobicContact CD2-CG2 3.82Å; H736-T740 HydrophobicContact CB-CG2 3.9Å; C737-T740 VanDerWaalsContact O-CB 3.27Å; C737-T740 WeakPolarHBondContact O-CB 3.49Å; C737-T740 PolarHBondContact O-N 2.91Å; C737-T740 VanDerWaalsContact O-N 3.17Å; C737-T740 PolarHBondContact O-OG1 3.34Å; C737-T740 PolarHBondContact SG-OG1 3.24Å; C737-T740 VanDerWaalsContact SG-OG1 3.38Å; T740-I757 WeakPolarHBondContact O-CA 3.21Å; T740-K758 PolarHBondContact O-N 2.93Å; T740-H811 CarbonylContact C-O 3.58Å; T740-H811 VanDerWaalsContact CA-O 3.27Å; T740-H811 WeakPolarHBondContact CA-O 3.45Å
741	Y	94.6	Very high	80.7	Confident	0 Å²	0	56 Å²	56	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	155.8	-174.4	80.1	-75.8	0	0	0	114	W719 I755 S756 V790 Q794 L809 H811 P812 Y813	W719-Y741 HydrophobicContact CB-CD2 4.24Å; W719-Y741 HydrophobicContact CB-CE2 3.42Å; W719-Y741 VanDerWaalsContact CB-CE2 3.42Å; W719-Y741 HydrophobicContact CG-CE2 4.01Å; Y741-I755 HydrophobicContact CD2-CG2 4.41Å; Y741-S756 CarbonylContact C-O 3.57Å; Y741-S756 VanDerWaalsContact CA-O 3.23Å; Y741-S756 WeakPolarHBondContact CA-O 3.21Å; Y741-V790 HydrophobicContact CE2-CG1 4.14Å; Y741-V790 WeakPolarHBondContact OH-CG1 3.43Å; Y741-Q794 PolarHBondContact OH-NE2 3.2Å; Y741-L809 VanDerWaalsContact CD1-C 3.47Å; Y741-L809 HydrophobicContact CD1-CB 3.74Å; Y741-L809 HydrophobicContact CD2-CB 4.02Å; Y741-L809 HydrophobicContact CD2-CD1 4.22Å; Y741-L809 HydrophobicContact CD2-CD2 3.95Å; Y741-L809 HydrophobicContact CD2-CG 4.28Å; Y741-L809 HydrophobicContact CE1-CB 3.64Å; Y741-L809 WeakPolarHBondContact CE1-O 3.26Å; Y741-L809 HydrophobicContact CE2-CB 3.91Å; Y741-L809 HydrophobicContact CE2-CD1 4.02Å; Y741-L809 HydrophobicContact CE2-CG 4.37Å; Y741-L809 HydrophobicContact CG-CB 3.94Å; Y741-L809 HydrophobicContact CG-CD2 3.97Å; Y741-L809 HydrophobicContact CG-CG 4.45Å; Y741-H811 WeakPolarHBondContact CD1-O 3.44Å; Y741-H811 PolarHBondContact N-O 2.63Å; Y741-P812 HydrophobicContact CE1-CB 4.37Å; Y741-P812 HydrophobicContact CE1-CG 3.98Å; Y741-Y813 PolarHBondContact O-N 2.75Å
742	L	94.9	Very high	80	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	159.8	169.7	67	82.5	0	0	0	110.9	W719 A721 M724 A729 L732 L733 R744 S756 Y813	W719-L742 CarbonylContact O-C 3.5Å; W719-L742 VanDerWaalsContact O-CA 3.3Å; W719-L742 WeakPolarHBondContact O-CA 3.34Å; A721-L742 HydrophobicContact CB-CB 4.4Å; A721-L742 HydrophobicContact CB-CD1 4.06Å; M724-L742 HydrophobicContact SD-CD1 4.12Å; M724-L742 HydrophobicContact SD-CD2 4.05Å; A729-L742 HydrophobicContact CB-CD1 4.02Å; A729-L742 HydrophobicContact CB-CD2 4.21Å; L732-L742 HydrophobicContact CD2-CD2 3.95Å; L733-L742 HydrophobicContact CD1-CD2 4.18Å; L733-L742 HydrophobicContact CD1-CG 4.19Å; L733-L742 HydrophobicContact CD2-CD2 4.25Å; L733-L742 HydrophobicContact CG-CD2 4.01Å; L742-R744 HydrophobicContact CD1-CB 4Å; L742-R744 HydrophobicContact CD1-CG 4.21Å; L742-S756 PolarHBondContact N-O 3.36Å; L742-S756 PolarHBondContact O-N 3.28Å; L742-Y813 HydrophobicContact CB-CD1 3.35Å; L742-Y813 HydrophobicContact CB-CE1 3.84Å; L742-Y813 HydrophobicContact CB-CG 3.83Å; L742-Y813 HydrophobicContact CD2-CD1 4.48Å; L742-Y813 HydrophobicContact CD2-CD2 4.46Å; L742-Y813 HydrophobicContact CD2-CG 4.28Å
743	I	94.1	Very high	79.9	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	127.6	172	-55.4	-168.4	0	0	0	108.9	W719 F720 A721 F753 A754 I755 L786 V790	W719-I743 HydrophobicContact CE3-CB 3.97Å; W719-I743 HydrophobicContact CE3-CD1 3.78Å; W719-I743 HydrophobicContact CE3-CG1 3.93Å; W719-I743 HydrophobicContact CZ3-CB 4.23Å; W719-I743 HydrophobicContact CZ3-CD1 3.95Å; W719-I743 HydrophobicContact CZ3-CG1 4.4Å; W719-I743 PolarHBondContact O-N 2.96Å; F720-I743 HydrophobicContact CD2-CB 4.39Å; F720-I743 HydrophobicContact CD2-CG2 4.41Å; A721-I743 WeakPolarHBondContact CB-O 3.41Å; A721-I743 PolarHBondContact N-O 3.13Å; I743-F753 HydrophobicContact CG2-CB 4.32Å; I743-F753 HydrophobicContact CG2-CD1 4.48Å; I743-A754 WeakPolarHBondContact CA-O 3.35Å; I743-I755 HydrophobicContact CD1-CD1 4.5Å; I743-I755 HydrophobicContact CD1-CG1 3.95Å; I743-I755 HydrophobicContact CG1-CB 4.48Å; I743-I755 HydrophobicContact CG1-CG1 4.08Å; I743-I755 HydrophobicContact CG1-CG2 4.35Å; I743-L786 HydrophobicContact CD1-CD1 4.36Å; I743-L786 HydrophobicContact CG2-CD2 4.37Å; I743-V790 HydrophobicContact CD1-CG2 3.25Å
744	R	92	Very high	80.1	Confident	10 Å²	10	51.3 Å²	51.3	4%	0.038	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	144.1	-175.3	60.2	-166.9	-170.3	75.2	1.1	111.2	G722 M724 L742 A754 S756	G722-R744 CarbonylContact O-C 3.59Å; G722-R744 WeakPolarHBondContact O-CA 3.33Å; M724-R744 HydrophobicContact CB-CB 3.79Å; M724-R744 HydrophobicContact CG-CB 4.44Å; M724-R744 VanDerWaalsContact O-CD 3.26Å; M724-R744 WeakPolarHBondContact O-CD 3.24Å; M724-R744 PolarHBondContact O-NH1 3.31Å; L742-R744 HydrophobicContact CD1-CB 4Å; L742-R744 HydrophobicContact CD1-CG 4.21Å; R744-A754 HydrophobicContact CG-CB 4.41Å; R744-A754 PolarHBondContact N-O 3.12Å; R744-A754 PolarHBondContact O-N 3.33Å; R744-S756 PolarHBondContact NE-OG 2.95Å; R744-S756 VanDerWaalsContact NE-OG 3.15Å
745	E	87.3	Confident	80.5	Confident	39 Å²	39	44.1 Å²	44.1	18%	0.182	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	152.1	174.8	-163	163.4	131.1	0	0	110.9	G722 M724 R752 F753	G722-E745 PolarHBondContact O-N 3.09Å; M724-E745 PolarHBondContact N-O 2.94Å; E745-R752 CarbonylContact C-O 3.45Å; E745-R752 WeakPolarHBondContact CA-O 3.46Å; E745-R752 VanDerWaalsContact CD-NH2 3.27Å; E745-R752 HydrophobicContact CG-CG 3.75Å; E745-R752 WeakPolarHBondContact CG-O 3.36Å; E745-R752 IonicContact OE1-CZ 3.22Å; E745-R752 IonicContact OE1-NE 3.98Å; E745-R752 PolarHBondContact OE1-NE 3.34Å; E745-R752 VanDerWaalsContact OE1-NE 3.15Å; E745-R752 IonicContact OE1-NH2 2.72Å; E745-R752 PolarHBondContact OE1-NH2 3.16Å; E745-R752 IonicContact OE2-CZ 2.67Å; E745-R752 IonicContact OE2-NE 2.56Å; E745-R752 PolarHBondContact OE2-NE 3.41Å; E745-R752 IonicContact OE2-NH2 2.77Å; E745-R752 PolarHBondContact OE2-NH2 3.23Å; E745-F753 HydrophobicContact CB-CD1 4.42Å; E745-F753 HydrophobicContact CB-CE1 4.38Å; E745-F753 HydrophobicContact CG-CD1 4.41Å; E745-F753 HydrophobicContact CG-CE1 4.17Å; E745-F753 WeakPolarHBondContact OE2-CE1 3.37Å
746	R	72.6	Confident	81.2	Confident	69 Å²	69	39.3 Å²	39.3	26%	0.26	22%	0.22	S	C	.	.			trans	-124	143.6	174.2	-57.9	-175.6	-178	-171.4	-1	109.8	A748 E751 R752	R746-A748 PolarHBondContact O-N 2.89Å; R746-E751 WeakPolarHBondContact CD-O 3.5Å; R746-E751 IonicContact CZ-OE2 2.74Å; R746-E751 IonicContact NH1-OE2 3.64Å; R746-E751 PolarHBondContact NH1-OE2 2.74Å; R746-R752 PolarHBondContact N-O 3.29Å
747	T	62.8	Low	81.5	Confident	132 Å²	132	37.3 Å²	37.3	81%	0.81	21%	0.211	S	C	*	.	S	Bend	trans	-72.6	16.9	-179.8	48.2	0	0	0	0	115.4
748	A	57.4	Low	81.9	Confident	50 Å²	50	35.4 Å²	35.4	41%	0.413	20%	0.196	S	C	.	.	S	Bend	trans	-115.4	119.5	-178.7	0	0	0	0	0	111	R746 A750 E751	R746-A748 PolarHBondContact O-N 2.89Å; A748-A750 PolarHBondContact O-N 3.21Å; A748-E751 PolarHBondContact O-N 2.91Å
749	E	55	Low	82	Confident	149 Å²	149	34.1 Å²	34.1	70%	0.696	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-16.6	-166	-66.4	-158.2	85.2	0	0	116.6	R710	R710-E749 IonicContact CZ-OE1 3.3Å; R710-E749 IonicContact NH1-OE1 3.14Å; R710-E749 PolarHBondContact NH1-OE1 3.05Å; R710-E749 IonicContact NH2-OE1 2.68Å; R710-E749 PolarHBondContact NH2-OE1 3.39Å
750	A	48.6	Very low	82	Confident	81 Å²	81	39.8 Å²	39.8	67%	0.669	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.4	3.6	178.5	0	0	0	0	0	114	A748	A748-A750 PolarHBondContact O-N 3.21Å
751	E	64.1	Low	81.5	Confident	63 Å²	63	45.8 Å²	45.8	29%	0.294	25%	0.247	S	C	.	.			trans	-136.6	37	178.4	-52.4	-154	158.4	0	0	112.3	R746 A748 F753 K767	R746-E751 WeakPolarHBondContact CD-O 3.5Å; R746-E751 IonicContact CZ-OE2 2.74Å; R746-E751 IonicContact NH1-OE2 3.64Å; R746-E751 PolarHBondContact NH1-OE2 2.74Å; A748-E751 PolarHBondContact O-N 2.91Å; E751-F753 PolarHBondContact O-N 2.86Å; E751-K767 VanDerWaalsContact CD-NZ 3.3Å; E751-K767 HydrophobicContact CG-CD 4.42Å; E751-K767 VanDerWaalsContact OE1-CE 3.23Å; E751-K767 WeakPolarHBondContact OE1-CE 3.42Å; E751-K767 IonicContact OE1-NZ 2.66Å; E751-K767 PolarHBondContact OE1-NZ 3.3Å
752	R	75.1	Confident	81	Confident	72 Å²	72	51.4 Å²	51.4	27%	0.272	27%	0.273	S	S	.	.			trans	-49.5	-39.1	-164.8	-173.6	173	-179.8	157.4	8.8	114	R710 E745 R746	R710-R752 PolarHBondContact O-NH1 2.86Å; E745-R752 CarbonylContact C-O 3.45Å; E745-R752 WeakPolarHBondContact CA-O 3.46Å; E745-R752 VanDerWaalsContact CD-NH2 3.27Å; E745-R752 HydrophobicContact CG-CG 3.75Å; E745-R752 WeakPolarHBondContact CG-O 3.36Å; E745-R752 IonicContact OE1-CZ 3.22Å; E745-R752 IonicContact OE1-NE 3.98Å; E745-R752 PolarHBondContact OE1-NE 3.34Å; E745-R752 VanDerWaalsContact OE1-NE 3.15Å; E745-R752 IonicContact OE1-NH2 2.72Å; E745-R752 PolarHBondContact OE1-NH2 3.16Å; E745-R752 IonicContact OE2-CZ 2.67Å; E745-R752 IonicContact OE2-NE 2.56Å; E745-R752 PolarHBondContact OE2-NE 3.41Å; E745-R752 IonicContact OE2-NH2 2.77Å; E745-R752 PolarHBondContact OE2-NH2 3.23Å; R746-R752 PolarHBondContact N-O 3.29Å
753	F	88.8	Confident	80.9	Confident	11 Å²	11	52.6 Å²	52.6	5%	0.048	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	149.1	-175.7	-57.2	-68	0	0	0	114.5	Y714 F720 I743 E745 E751 V768 L786	Y714-F753 HydrophobicContact CD2-CZ 4.3Å; Y714-F753 HydrophobicContact CE2-CZ 4.06Å; F720-F753 HydrophobicContact CE2-CD1 4.12Å; F720-F753 AromaticContact CE2-CE1 3.82Å; F720-F753 HydrophobicContact CE2-CE1 3.82Å; F720-F753 HydrophobicContact CZ-CE1 4.15Å; I743-F753 HydrophobicContact CG2-CB 4.32Å; I743-F753 HydrophobicContact CG2-CD1 4.48Å; E745-F753 HydrophobicContact CB-CD1 4.42Å; E745-F753 HydrophobicContact CB-CE1 4.38Å; E745-F753 HydrophobicContact CG-CD1 4.41Å; E745-F753 HydrophobicContact CG-CE1 4.17Å; E745-F753 WeakPolarHBondContact OE2-CE1 3.37Å; E751-F753 PolarHBondContact O-N 2.86Å; F753-V768 HydrophobicContact CB-CB 4.01Å; F753-V768 HydrophobicContact CB-CG2 4.15Å; F753-V768 WeakPolarHBondContact O-CB 3.38Å; F753-V768 PolarHBondContact O-N 2.98Å; F753-L786 HydrophobicContact CB-CD1 4.48Å; F753-L786 HydrophobicContact CD1-CD2 3.99Å; F753-L786 HydrophobicContact CD2-CD2 3.92Å; F753-L786 HydrophobicContact CE1-CD2 4.08Å; F753-L786 HydrophobicContact CE2-CD2 4Å; F753-L786 HydrophobicContact CG-CD2 3.9Å; F753-L786 HydrophobicContact CZ-CD2 4.08Å
754	A	91.6	Very high	80.8	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	137.9	166.7	0	0	0	0	0	111.6	I743 R744 I766	I743-A754 WeakPolarHBondContact CA-O 3.35Å; R744-A754 HydrophobicContact CG-CB 4.41Å; R744-A754 PolarHBondContact N-O 3.12Å; R744-A754 PolarHBondContact O-N 3.33Å; A754-I766 CarbonylContact C-O 3.5Å; A754-I766 WeakPolarHBondContact CA-O 3.47Å
755	I	93.9	Very high	80.8	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	134.2	171.6	-49.1	174.4	0	0	0	107.5	Y741 I743 H765 I766 V768 I777 L789 L809	Y741-I755 HydrophobicContact CD2-CG2 4.41Å; I743-I755 HydrophobicContact CD1-CD1 4.5Å; I743-I755 HydrophobicContact CD1-CG1 3.95Å; I743-I755 HydrophobicContact CG1-CB 4.48Å; I743-I755 HydrophobicContact CG1-CG1 4.08Å; I743-I755 HydrophobicContact CG1-CG2 4.35Å; I755-H765 CarbonylContact O-C 3.45Å; I755-H765 VanDerWaalsContact O-CA 3.25Å; I755-H765 WeakPolarHBondContact O-CA 3.46Å; I755-I766 HydrophobicContact CB-CB 4.33Å; I755-I766 PolarHBondContact N-O 2.83Å; I755-I766 PolarHBondContact O-N 3.36Å; I755-V768 HydrophobicContact CD1-CG2 4.32Å; I755-V768 HydrophobicContact CG1-CG2 3.9Å; I755-I777 HydrophobicContact CD1-CG2 4.18Å; I755-L789 HydrophobicContact CD1-CD2 3.85Å; I755-L809 HydrophobicContact CD1-CD1 4.49Å; I755-L809 HydrophobicContact CG2-CD2 3.87Å
756	S	95.3	Very high	81	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	127.6	170.6	-49.5	0	0	0	0	108.2	L733 Y741 L742 R744 K764 H765	L733-S756 WeakPolarHBondContact CD1-O 3.35Å; Y741-S756 CarbonylContact C-O 3.57Å; Y741-S756 VanDerWaalsContact CA-O 3.23Å; Y741-S756 WeakPolarHBondContact CA-O 3.21Å; L742-S756 PolarHBondContact N-O 3.36Å; L742-S756 PolarHBondContact O-N 3.28Å; R744-S756 PolarHBondContact NE-OG 2.95Å; R744-S756 VanDerWaalsContact NE-OG 3.15Å; S756-K764 WeakPolarHBondContact CA-O 3.35Å; S756-H765 WeakPolarHBondContact CA-CE1 3.47Å; S756-H765 WeakPolarHBondContact CB-CE1 3.41Å; S756-H765 WeakPolarHBondContact CB-ND1 3.45Å; S756-H765 PolarHBondContact OG-CE1 3.21Å; S756-H765 PolarHBondContact OG-ND1 3.13Å
757	I	94.6	Very high	81.7	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	134.8	-174.8	179.7	163.5	0	0	0	110.4	T740 K764 L798 T807 T808 L809	T740-I757 WeakPolarHBondContact O-CA 3.21Å; I757-K764 HydrophobicContact CG2-CB 4.33Å; I757-K764 PolarHBondContact N-O 3.5Å; I757-K764 PolarHBondContact O-N 3.14Å; I757-L798 HydrophobicContact CD1-CD1 4.25Å; I757-T807 HydrophobicContact CD1-CG2 3.67Å; I757-T807 HydrophobicContact CG1-CG2 4.49Å; I757-T808 WeakPolarHBondContact CD1-O 3.48Å; I757-L809 HydrophobicContact CD1-CD2 4.01Å
758	K	93	Very high	83	Confident	13 Å²	13	50.7 Å²	50.7	6%	0.057	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	128.1	172.8	-173	170.1	170.5	-164	0	110.5	L733 K734 H736 G739 T740 D761 E762 V763	L733-K758 HydrophobicContact CB-CB 4.42Å; L733-K758 WeakPolarHBondContact O-CD 3.4Å; K734-K758 PolarHBondContact O-NZ 3.07Å; H736-K758 WeakPolarHBondContact O-CD 3.47Å; H736-K758 PolarHBondContact O-NZ 2.91Å; G739-K758 PolarHBondContact N-O 3.5Å; T740-K758 PolarHBondContact O-N 2.93Å; K758-D761 WeakPolarHBondContact CE-OD1 3.26Å; K758-D761 IonicContact NZ-OD1 2.95Å; K758-D761 PolarHBondContact NZ-OD1 3.4Å; K758-E762 CarbonylContact C-O 3.52Å; K758-E762 WeakPolarHBondContact CA-O 3.23Å; K758-V763 HydrophobicContact CB-CG2 4.36Å; K758-V763 HydrophobicContact CG-CG2 4.49Å
759	F	90.3	Very high	84.4	Confident	24 Å²	24	51 Å²	51	11%	0.105	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	124.9	179.2	179.4	-105.1	0	0	0	110.5	D761 E762 K764 L804 L805 D806 T807	F759-D761 VanDerWaalsContact C-N 3.35Å; F759-D761 PolarHBondContact O-N 2.98Å; F759-E762 PolarHBondContact N-O 2.9Å; F759-E762 PolarHBondContact O-N 3.45Å; F759-E762 VanDerWaalsContact O-O 3.09Å; F759-K764 HydrophobicContact CB-CG 4.49Å; F759-L804 WeakPolarHBondContact CE1-O 3.44Å; F759-L805 HydrophobicContact CB-CD1 3.58Å; F759-L805 HydrophobicContact CD1-CD1 3.46Å; F759-L805 VanDerWaalsContact CD1-CD1 3.46Å; F759-L805 HydrophobicContact CD2-CD1 4.08Å; F759-L805 HydrophobicContact CE1-CD1 4.1Å; F759-L805 HydrophobicContact CG-CD1 3.43Å; F759-L805 VanDerWaalsContact CG-CD1 3.43Å; F759-D806 WeakPolarHBondContact CE2-O 3.41Å; F759-T807 HydrophobicContact CB-CG2 4.46Å; F759-T807 HydrophobicContact CD2-CG2 3.7Å; F759-T807 HydrophobicContact CE2-CG2 4.26Å; F759-T807 HydrophobicContact CG-CG2 4.29Å
760	N	84.5	Confident	85.7	Confident	119 Å²	119	47.8 Å²	47.8	64%	0.636	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	51	52.3	-175.9	-62.2	-5.4	0	0	0	112.3	E762	N760-E762 PolarHBondContact O-N 2.95Å
761	D	80.7	Confident	87.2	Confident	130 Å²	130	50 Å²	50	70%	0.695	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.9	-4.2	-175.6	-75.2	-56.8	0	0	0	118.8	K758 F759	K758-D761 WeakPolarHBondContact CE-OD1 3.26Å; K758-D761 IonicContact NZ-OD1 2.95Å; K758-D761 PolarHBondContact NZ-OD1 3.4Å; F759-D761 VanDerWaalsContact C-N 3.35Å; F759-D761 PolarHBondContact O-N 2.98Å
762	E	85.8	Confident	87.8	Confident	118 Å²	118	52.4 Å²	52.4	55%	0.551	25%	0.252	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93	150.3	166.8	-67.8	-174.2	-168.7	0	0	112.3	K758 F759 N760 K764	K758-E762 CarbonylContact C-O 3.52Å; K758-E762 WeakPolarHBondContact CA-O 3.23Å; F759-E762 PolarHBondContact N-O 2.9Å; F759-E762 PolarHBondContact O-N 3.45Å; F759-E762 VanDerWaalsContact O-O 3.09Å; N760-E762 PolarHBondContact O-N 2.95Å; E762-K764 IonicContact OE2-NZ 2.71Å; E762-K764 PolarHBondContact OE2-NZ 3.2Å
763	V	91.1	Very high	87.9	Confident	24 Å²	24	55.3 Å²	55.3	15%	0.145	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	122.4	169.1	179.4	0	0	0	0	109	D730 L733 K758	D730-V763 WeakPolarHBondContact OD1-CB 3.45Å; L733-V763 HydrophobicContact CB-CG1 4.49Å; L733-V763 HydrophobicContact CB-CG2 3.76Å; L733-V763 HydrophobicContact CD1-CG1 3.92Å; K758-V763 HydrophobicContact CB-CG2 4.36Å; K758-V763 HydrophobicContact CG-CG2 4.49Å
764	K	92.1	Very high	87.5	Confident	76 Å²	76	59.7 Å²	59.7	33%	0.33	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	137.2	176.3	-53.8	-59.9	-178.7	178.7	0	108.7	S756 I757 F759 E762 L805	S756-K764 WeakPolarHBondContact CA-O 3.35Å; I757-K764 HydrophobicContact CG2-CB 4.33Å; I757-K764 PolarHBondContact N-O 3.5Å; I757-K764 PolarHBondContact O-N 3.14Å; F759-K764 HydrophobicContact CB-CG 4.49Å; E762-K764 IonicContact OE2-NZ 2.71Å; E762-K764 PolarHBondContact OE2-NZ 3.2Å; K764-L805 HydrophobicContact CB-CD2 4.47Å; K764-L805 HydrophobicContact CG-CD1 4.21Å
765	H	91.9	Very high	87.4	Confident	39 Å²	39	60.3 Å²	60.3	18%	0.181	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	130.7	172	-42.5	-93.6	0	0	0	110.7	R726 D730 I755 S756	R726-H765 VanDerWaalsContact CZ-CD2 3.46Å; R726-H765 PolarHBondContact NE-CD2 3.3Å; R726-H765 PolarHBondContact NH2-CD2 2.85Å; R726-H765 PolarHBondContact O-NE2 3.47Å; D730-H765 PolarHBondContact N-NE2 3.44Å; D730-H765 IonicContact OD1-NE2 3.35Å; D730-H765 PolarHBondContact OD1-NE2 3.07Å; D730-H765 IonicContact OD2-NE2 3.35Å; I755-H765 CarbonylContact O-C 3.45Å; I755-H765 VanDerWaalsContact O-CA 3.25Å; I755-H765 WeakPolarHBondContact O-CA 3.46Å; S756-H765 WeakPolarHBondContact CA-CE1 3.47Å; S756-H765 WeakPolarHBondContact CB-CE1 3.41Å; S756-H765 WeakPolarHBondContact CB-ND1 3.45Å; S756-H765 PolarHBondContact OG-CE1 3.21Å; S756-H765 PolarHBondContact OG-ND1 3.13Å
766	I	91.4	Very high	87.1	Confident	10 Å²	10	60.8 Å²	60.8	5%	0.051	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	126.6	176.5	-57	168.3	0	0	0	106.9	A754 I755 I777 L798 F802 L805	A754-I766 CarbonylContact C-O 3.5Å; A754-I766 WeakPolarHBondContact CA-O 3.47Å; I755-I766 HydrophobicContact CB-CB 4.33Å; I755-I766 PolarHBondContact N-O 2.83Å; I755-I766 PolarHBondContact O-N 3.36Å; I766-I777 HydrophobicContact CG2-CB 3.64Å; I766-I777 HydrophobicContact CG2-CD1 4.38Å; I766-I777 HydrophobicContact CG2-CG2 3.56Å; I766-L798 HydrophobicContact CD1-CD1 3.95Å; I766-L798 HydrophobicContact CD1-CD2 3.9Å; I766-F802 HydrophobicContact CD1-CD2 4.2Å; I766-F802 HydrophobicContact CD1-CE2 3.97Å; I766-F802 HydrophobicContact CG1-CE2 4.11Å; I766-F802 HydrophobicContact CG2-CE2 3.69Å; I766-F802 HydrophobicContact CG2-CZ 3.8Å; I766-L805 HydrophobicContact CD1-CD2 3.92Å; I766-L805 HydrophobicContact CG1-CD2 4.45Å
767	K	88.9	Confident	86.8	Confident	81 Å²	81	61.3 Å²	61.3	35%	0.352	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	132.3	170.7	176	-179.7	170.1	-179.8	0	108.5	E751 I769	E751-K767 VanDerWaalsContact CD-NZ 3.3Å; E751-K767 HydrophobicContact CG-CD 4.42Å; E751-K767 VanDerWaalsContact OE1-CE 3.23Å; E751-K767 WeakPolarHBondContact OE1-CE 3.42Å; E751-K767 IonicContact OE1-NZ 2.66Å; E751-K767 PolarHBondContact OE1-NZ 3.3Å; K767-I769 HydrophobicContact CD-CG1 4.37Å; K767-I769 HydrophobicContact CG-CG1 4.36Å
768	V	89.9	Confident	86.3	Confident	4 Å²	4	62.7 Å²	62.7	2%	0.024	31%	0.306	C	S	.	.			trans	-91.7	133.5	166.2	-174.8	0	0	0	0	107.6	F753 I755 I775 I777 L786 L789	F753-V768 HydrophobicContact CB-CB 4.01Å; F753-V768 HydrophobicContact CB-CG2 4.15Å; F753-V768 WeakPolarHBondContact O-CB 3.38Å; F753-V768 PolarHBondContact O-N 2.98Å; I755-V768 HydrophobicContact CD1-CG2 4.32Å; I755-V768 HydrophobicContact CG1-CG2 3.9Å; V768-I775 HydrophobicContact CG1-CG2 3.35Å; V768-I777 HydrophobicContact CG2-CG2 4.21Å; V768-L786 HydrophobicContact CG1-CD1 4.42Å; V768-L789 HydrophobicContact CG1-CD1 4.39Å
769	I	85.3	Confident	85.6	Confident	58 Å²	58	69.9 Å²	69.9	30%	0.297	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	120.8	177.8	-57	172.7	0	0	0	107.4	K767 K771 I775 H776	K767-I769 HydrophobicContact CD-CG1 4.37Å; K767-I769 HydrophobicContact CG-CG1 4.36Å; I769-K771 HydrophobicContact CG2-CB 4.35Å; I769-I775 WeakPolarHBondContact O-CA 3.37Å; I769-H776 VanDerWaalsContact CG2-CE1 3.4Å; I769-H776 WeakPolarHBondContact CG2-CE1 3.22Å; I769-H776 PolarHBondContact N-O 2.93Å; I769-H776 PolarHBondContact O-N 3.36Å; I769-H776 PolarHBondContact O-ND1 2.93Å; I769-H776 VanDerWaalsContact O-ND1 3.1Å
770	E	84.1	Confident	84.9	Confident	81 Å²	81	73.1 Å²	73.1	38%	0.379	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	114.8	172.3	-179.2	177.6	175.9	0	0	107.5	I775	E770-I775 HydrophobicContact CB-CG1 4.3Å; E770-I775 HydrophobicContact CG-CD1 4.49Å; E770-I775 HydrophobicContact CG-CG1 4.07Å
771	K	79.4	Confident	84.8	Confident	126 Å²	126	70.5 Å²	70.5	55%	0.548	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	138.6	-177.6	-161.5	-157.5	171	-129.8	0	110.8	I769 N773 W774	I769-K771 HydrophobicContact CG2-CB 4.35Å; K771-N773 PolarHBondContact O-N 3.34Å; K771-W774 PolarHBondContact N-O 2.78Å; K771-W774 PolarHBondContact O-N 2.9Å; K771-W774 VanDerWaalsContact O-O 3.12Å
772	D	76.8	Confident	85.2	Confident	115 Å²	115	69.7 Å²	69.7	62%	0.615	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.9	34.9	175.8	-47.2	-38.7	0	0	0	113	W774	D772-W774 PolarHBondContact O-N 3.5Å
773	N	76.8	Confident	85.3	Confident	133 Å²	133	64.5 Å²	64.5	71%	0.711	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.6	12.1	-169.8	-66.2	7.3	0	0	0	116.3	K771	K771-N773 PolarHBondContact O-N 3.34Å
774	W	80.8	Confident	84.9	Confident	102 Å²	102	70.4 Å²	70.4	39%	0.386	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	132	175.3	-66.5	93.6	0	0	0	112.2	K771 D772 K782 E784	K771-W774 PolarHBondContact N-O 2.78Å; K771-W774 PolarHBondContact O-N 2.9Å; K771-W774 VanDerWaalsContact O-O 3.12Å; D772-W774 PolarHBondContact O-N 3.5Å; W774-K782 HydrophobicContact CB-CB 4.19Å; W774-K782 HydrophobicContact CB-CD 4.26Å; W774-K782 HydrophobicContact CD2-CB 4.17Å; W774-K782 HydrophobicContact CE3-CB 3.75Å; W774-K782 HydrophobicContact CG-CB 4.35Å; W774-K782 HydrophobicContact CG-CD 4.33Å; W774-E784 HydrophobicContact CE3-CG 4.3Å; W774-E784 HydrophobicContact CH2-CG 3.68Å; W774-E784 HydrophobicContact CZ3-CG 3.49Å; W774-E784 VanDerWaalsContact CZ3-CG 3.49Å
775	I	88.7	Confident	84.6	Confident	13 Å²	13	68.7 Å²	68.7	7%	0.067	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	131.4	177	-61.2	-176.3	0	0	0	108.6	V768 I769 E770 F783 L786 L789	V768-I775 HydrophobicContact CG1-CG2 3.35Å; I769-I775 WeakPolarHBondContact O-CA 3.37Å; E770-I775 HydrophobicContact CB-CG1 4.3Å; E770-I775 HydrophobicContact CG-CD1 4.49Å; E770-I775 HydrophobicContact CG-CG1 4.07Å; I775-F783 PolarHBondContact N-O 3.09Å; I775-F783 WeakPolarHBondContact O-CD2 3.27Å; I775-F783 PolarHBondContact O-N 3.26Å; I775-L786 HydrophobicContact CD1-CB 4.31Å; I775-L789 HydrophobicContact CG2-CD1 3.82Å
776	H	87.3	Confident	84.4	Confident	11 Å²	11	66.9 Å²	66.9	5%	0.051	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	161.3	-175.8	58.8	-71.1	0	0	0	113.3	I769 K781 K782	I769-H776 VanDerWaalsContact CG2-CE1 3.4Å; I769-H776 WeakPolarHBondContact CG2-CE1 3.22Å; I769-H776 PolarHBondContact N-O 2.93Å; I769-H776 PolarHBondContact O-N 3.36Å; I769-H776 PolarHBondContact O-ND1 2.93Å; I769-H776 VanDerWaalsContact O-ND1 3.1Å; H776-K781 VanDerWaalsContact CB-O 3.22Å; H776-K781 WeakPolarHBondContact CB-O 3.22Å; H776-K782 HydrophobicContact CB-CG 4.28Å
777	I	88.8	Confident	84.3	Confident	10 Å²	10	68.3 Å²	68.3	5%	0.051	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	-17.8	170.1	60.9	-177.8	0	0	0	113.1	I755 I766 V768 L789 Y793 L798 F802	I755-I777 HydrophobicContact CD1-CG2 4.18Å; I766-I777 HydrophobicContact CG2-CB 3.64Å; I766-I777 HydrophobicContact CG2-CD1 4.38Å; I766-I777 HydrophobicContact CG2-CG2 3.56Å; V768-I777 HydrophobicContact CG2-CG2 4.21Å; I777-L789 HydrophobicContact CG2-CD1 4.2Å; I777-L789 HydrophobicContact CG2-CD2 4.28Å; I777-Y793 HydrophobicContact CD1-CD2 3.82Å; I777-Y793 HydrophobicContact CD1-CE1 4.22Å; I777-Y793 HydrophobicContact CD1-CE2 3.38Å; I777-Y793 HydrophobicContact CD1-CG 4.41Å; I777-Y793 HydrophobicContact CG1-CE2 3.87Å; I777-L798 HydrophobicContact CD1-CD2 3.65Å; I777-F802 HydrophobicContact CB-CE2 4.36Å; I777-F802 HydrophobicContact CD1-CE2 4.01Å; I777-F802 HydrophobicContact CG1-CE2 4.23Å
778	T	85.2	Confident	84.3	Confident	30 Å²	30	68.3 Å²	68.3	18%	0.184	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	152.6	169.1	59.5	0	0	0	0	108.4	A780 K781 S801 F802	T778-A780 PolarHBondContact O-N 2.98Å; T778-K781 PolarHBondContact O-N 3.07Å; T778-S801 VanDerWaalsContact CG2-CB 3.48Å; T778-S801 WeakPolarHBondContact CG2-OG 3.43Å; T778-S801 PolarHBondContact OG1-OG 2.8Å; T778-F802 HydrophobicContact CG2-CE1 4.14Å; T778-F802 HydrophobicContact CG2-CE2 4.32Å; T778-F802 HydrophobicContact CG2-CZ 3.85Å
779	E	79.1	Confident	84.4	Confident	163 Å²	163	68.1 Å²	68.1	76%	0.762	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-15	-177.5	-62	-168.6	149.2	0	0	113.8
780	A	75.2	Confident	84.7	Confident	92 Å²	92	65.4 Å²	65.4	76%	0.76	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-22.4	-178.1	0	0	0	0	0	114.6	T778	T778-A780 PolarHBondContact O-N 2.98Å
781	K	81.8	Confident	84.9	Confident	65 Å²	65	66.6 Å²	66.6	28%	0.283	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	125.9	176	-71.7	-172.1	176.7	178.2	0	111	H776 T778 F783 Y792 E800	H776-K781 VanDerWaalsContact CB-O 3.22Å; H776-K781 WeakPolarHBondContact CB-O 3.22Å; T778-K781 PolarHBondContact O-N 3.07Å; K781-F783 HydrophobicContact CB-CE2 4.03Å; K781-F783 HydrophobicContact CB-CZ 4Å; K781-Y792 HydrophobicContact CD-CE1 3.84Å; K781-Y792 PolarHBondContact NZ-OH 3.38Å; K781-E800 IonicContact NZ-OE2 3.29Å; K781-E800 PolarHBondContact NZ-OE2 3.21Å
782	K	88.3	Confident	85.4	Confident	112 Å²	112	63.3 Å²	63.3	49%	0.487	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	143.7	-175.3	-62	-178.8	-176.8	-178.5	0	109.6	W774 H776	W774-K782 HydrophobicContact CB-CB 4.19Å; W774-K782 HydrophobicContact CB-CD 4.26Å; W774-K782 HydrophobicContact CD2-CB 4.17Å; W774-K782 HydrophobicContact CE3-CB 3.75Å; W774-K782 HydrophobicContact CG-CB 4.35Å; W774-K782 HydrophobicContact CG-CD 4.33Å; H776-K782 HydrophobicContact CB-CG 4.28Å
783	F	88.6	Confident	86	Confident	10 Å²	10	57.8 Å²	57.8	4%	0.044	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	149	-174.3	-53.9	-84.1	0	0	0	109.5	I775 K781 S785 E788 L789 Y792 Y793	I775-F783 PolarHBondContact N-O 3.09Å; I775-F783 WeakPolarHBondContact O-CD2 3.27Å; I775-F783 PolarHBondContact O-N 3.26Å; K781-F783 HydrophobicContact CB-CE2 4.03Å; K781-F783 HydrophobicContact CB-CZ 4Å; F783-S785 VanDerWaalsContact C-N 3.31Å; F783-E788 WeakPolarHBondContact CA-OE2 3.3Å; F783-E788 HydrophobicContact CB-CB 4.37Å; F783-E788 HydrophobicContact CB-CG 4.39Å; F783-E788 WeakPolarHBondContact CB-OE2 3.49Å; F783-E788 HydrophobicContact CD1-CG 3.97Å; F783-L789 HydrophobicContact CB-CB 4.08Å; F783-L789 HydrophobicContact CD2-CB 3.74Å; F783-L789 HydrophobicContact CD2-CD1 3.7Å; F783-L789 HydrophobicContact CD2-CG 3.64Å; F783-L789 HydrophobicContact CE2-CB 4.34Å; F783-L789 HydrophobicContact CE2-CD1 4.19Å; F783-L789 HydrophobicContact CE2-CG 3.9Å; F783-L789 HydrophobicContact CG-CB 3.85Å; F783-L789 HydrophobicContact CG-CG 4.28Å; F783-Y792 AromaticContact CE1-CD1 3.9Å; F783-Y792 HydrophobicContact CE1-CD1 3.9Å; F783-Y792 AromaticContact CE1-CD2 3.96Å; F783-Y792 HydrophobicContact CE1-CD2 3.96Å; F783-Y792 AromaticContact CE1-CG 3.48Å; F783-Y792 HydrophobicContact CE1-CG 3.48Å; F783-Y792 VanDerWaalsContact CE1-CG 3.48Å; F783-Y792 AromaticContact CZ-CD1 3.65Å; F783-Y792 HydrophobicContact CZ-CD1 3.65Å; F783-Y792 HydrophobicContact CZ-CE1 4.38Å; F783-Y792 AromaticContact CZ-CG 3.75Å; F783-Y792 HydrophobicContact CZ-CG 3.75Å; F783-Y793 AromaticContact CE2-CE2 3.84Å; F783-Y793 HydrophobicContact CE2-CE2 3.84Å; F783-Y793 AromaticContact CZ-CE2 3.89Å; F783-Y793 HydrophobicContact CZ-CE2 3.89Å
784	E	83.1	Confident	86.6	Confident	147 Å²	147	55.2 Å²	55.2	69%	0.687	27%	0.273	S	S	*	.	S	Bend	trans	-78.4	-17.3	179.5	-63.1	-170.6	173.3	0	0	112	W774 E788	W774-E784 HydrophobicContact CE3-CG 4.3Å; W774-E784 HydrophobicContact CH2-CG 3.68Å; W774-E784 HydrophobicContact CZ3-CG 3.49Å; W774-E784 VanDerWaalsContact CZ3-CG 3.49Å; E784-E788 PolarHBondContact N-OE2 3.4Å
785	S	86.6	Confident	86.8	Confident	41 Å²	41	54.2 Å²	54.2	29%	0.287	28%	0.281	S	S	.	.	S	Bend	trans	-146.8	162.6	177.9	72.3	0	0	0	0	114.1	F783 L787 E788 L789	F783-S785 VanDerWaalsContact C-N 3.31Å; S785-L787 VanDerWaalsContact C-N 3.28Å; S785-L787 PolarHBondContact O-N 2.97Å; S785-E788 WeakPolarHBondContact OG-CB 3.42Å; S785-E788 PolarHBondContact OG-N 3.32Å; S785-E788 VanDerWaalsContact OG-N 3.1Å; S785-L789 PolarHBondContact O-N 2.7Å
786	L	87.4	Confident	86.6	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-64.9	-33.7	172.4	-177.9	64.3	0	0	0	111.6	Y714 W719 I743 F753 V768 I775 V790	Y714-L786 HydrophobicContact CD2-CD2 4.31Å; Y714-L786 HydrophobicContact CE1-CB 4.21Å; Y714-L786 HydrophobicContact CE1-CD2 4.35Å; Y714-L786 HydrophobicContact CE2-CD2 4.1Å; W719-L786 HydrophobicContact CH2-CD2 4.47Å; W719-L786 HydrophobicContact CH2-CG 4.47Å; W719-L786 HydrophobicContact CZ3-CD2 4.32Å; I743-L786 HydrophobicContact CD1-CD1 4.36Å; I743-L786 HydrophobicContact CG2-CD2 4.37Å; F753-L786 HydrophobicContact CB-CD1 4.48Å; F753-L786 HydrophobicContact CD1-CD2 3.99Å; F753-L786 HydrophobicContact CD2-CD2 3.92Å; F753-L786 HydrophobicContact CE1-CD2 4.08Å; F753-L786 HydrophobicContact CE2-CD2 4Å; F753-L786 HydrophobicContact CG-CD2 3.9Å; F753-L786 HydrophobicContact CZ-CD2 4.08Å; V768-L786 HydrophobicContact CG1-CD1 4.42Å; I775-L786 HydrophobicContact CD1-CB 4.31Å; L786-V790 WeakPolarHBondContact O-CG2 3.34Å; L786-V790 PolarHBondContact O-N 3.22Å
787	L	89.3	Confident	86.7	Confident	40 Å²	40	57.5 Å²	57.5	21%	0.209	30%	0.299	C	S	.	.	H	α-helix	trans	-64.1	-50.8	177.6	176.6	62.9	0	0	0	111.1	Y717 W719 S785 L789 V790 E791	Y717-L787 HydrophobicContact CD1-CD1 4.32Å; Y717-L787 HydrophobicContact CE1-CD1 3.65Å; W719-L787 HydrophobicContact CZ2-CD1 4.01Å; S785-L787 VanDerWaalsContact C-N 3.28Å; S785-L787 PolarHBondContact O-N 2.97Å; L787-L789 VanDerWaalsContact C-N 3.31Å; L787-L789 PolarHBondContact O-N 2.7Å; L787-V790 WeakPolarHBondContact O-CA 3.44Å; L787-V790 WeakPolarHBondContact O-CB 3.32Å; L787-V790 PolarHBondContact O-N 3.45Å; L787-E791 HydrophobicContact CD1-CG 4.19Å; L787-E791 HydrophobicContact CG-CG 4.47Å; L787-E791 WeakPolarHBondContact O-CG 3.32Å; L787-E791 PolarHBondContact O-N 3.43Å
788	E	87.8	Confident	86.8	Confident	82 Å²	82	57 Å²	57	38%	0.383	30%	0.297	S	S	.	.	H	α-helix	trans	-58.3	-43.1	179.2	-173.2	-165.4	-174.3	0	0	111.6	F783 E784 S785 V790 E791 Y792	F783-E788 WeakPolarHBondContact CA-OE2 3.3Å; F783-E788 HydrophobicContact CB-CB 4.37Å; F783-E788 HydrophobicContact CB-CG 4.39Å; F783-E788 WeakPolarHBondContact CB-OE2 3.49Å; F783-E788 HydrophobicContact CD1-CG 3.97Å; E784-E788 PolarHBondContact N-OE2 3.4Å; S785-E788 WeakPolarHBondContact OG-CB 3.42Å; S785-E788 PolarHBondContact OG-N 3.32Å; S785-E788 VanDerWaalsContact OG-N 3.1Å; E788-V790 VanDerWaalsContact C-N 3.26Å; E788-V790 PolarHBondContact O-N 3.46Å; E788-E791 PolarHBondContact O-N 3.07Å; E788-Y792 VanDerWaalsContact O-CB 3.31Å; E788-Y792 WeakPolarHBondContact O-CB 3.4Å; E788-Y792 PolarHBondContact O-N 3.41Å
789	L	92.3	Very high	86.9	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-57.4	-40.2	174.6	-171.8	155.5	0	0	0	111.7	I755 V768 I775 I777 F783 S785 L787 Y793	I755-L789 HydrophobicContact CD1-CD2 3.85Å; V768-L789 HydrophobicContact CG1-CD1 4.39Å; I775-L789 HydrophobicContact CG2-CD1 3.82Å; I777-L789 HydrophobicContact CG2-CD1 4.2Å; I777-L789 HydrophobicContact CG2-CD2 4.28Å; F783-L789 HydrophobicContact CB-CB 4.08Å; F783-L789 HydrophobicContact CD2-CB 3.74Å; F783-L789 HydrophobicContact CD2-CD1 3.7Å; F783-L789 HydrophobicContact CD2-CG 3.64Å; F783-L789 HydrophobicContact CE2-CB 4.34Å; F783-L789 HydrophobicContact CE2-CD1 4.19Å; F783-L789 HydrophobicContact CE2-CG 3.9Å; F783-L789 HydrophobicContact CG-CB 3.85Å; F783-L789 HydrophobicContact CG-CG 4.28Å; S785-L789 PolarHBondContact O-N 2.7Å; L787-L789 VanDerWaalsContact C-N 3.31Å; L787-L789 PolarHBondContact O-N 2.7Å; L789-Y793 HydrophobicContact CD2-CD2 4.02Å; L789-Y793 HydrophobicContact CG-CD2 4.25Å; L789-Y793 HydrophobicContact CG-CE2 4.42Å; L789-Y793 WeakPolarHBondContact O-CD2 3.5Å; L789-Y793 PolarHBondContact O-N 3.18Å; L789-Y793 VanDerWaalsContact O-N 3.12Å
790	V	91.6	Very high	87.1	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-70.8	-48.3	178.8	171.9	0	0	0	0	111.7	W719 Y741 I743 L786 L787 E788 Y792 Y793 Q794 L809	W719-V790 HydrophobicContact CD2-CG1 4.23Å; W719-V790 HydrophobicContact CG-CG1 4.28Å; W719-V790 HydrophobicContact CH2-CG2 4.45Å; W719-V790 HydrophobicContact CZ2-CG1 4.48Å; W719-V790 HydrophobicContact CZ2-CG2 4.41Å; W719-V790 HydrophobicContact CZ3-CG2 4.5Å; Y741-V790 HydrophobicContact CE2-CG1 4.14Å; Y741-V790 WeakPolarHBondContact OH-CG1 3.43Å; I743-V790 HydrophobicContact CD1-CG2 3.25Å; L786-V790 WeakPolarHBondContact O-CG2 3.34Å; L786-V790 PolarHBondContact O-N 3.22Å; L787-V790 WeakPolarHBondContact O-CA 3.44Å; L787-V790 WeakPolarHBondContact O-CB 3.32Å; L787-V790 PolarHBondContact O-N 3.45Å; E788-V790 VanDerWaalsContact C-N 3.26Å; E788-V790 PolarHBondContact O-N 3.46Å; V790-Y792 PolarHBondContact O-N 3.49Å; V790-Y793 PolarHBondContact O-N 2.92Å; V790-Q794 HydrophobicContact CG1-CG 4.28Å; V790-Q794 WeakPolarHBondContact O-CB 3.4Å; V790-Q794 VanDerWaalsContact O-CG 3.26Å; V790-Q794 WeakPolarHBondContact O-CG 3.31Å; V790-Q794 PolarHBondContact O-N 3.15Å; V790-L809 HydrophobicContact CG1-CD1 4.3Å; V790-L809 HydrophobicContact CG2-CD1 4.44Å
791	E	88.2	Confident	87.5	Confident	106 Å²	106	54.6 Å²	54.6	50%	0.495	27%	0.269	S	S	.	.	H	α-helix	trans	-60.3	-35.4	177.4	-67.5	178.9	161.3	0	0	111.4	L787 E788 S795	L787-E791 HydrophobicContact CD1-CG 4.19Å; L787-E791 HydrophobicContact CG-CG 4.47Å; L787-E791 WeakPolarHBondContact O-CG 3.32Å; L787-E791 PolarHBondContact O-N 3.43Å; E788-E791 PolarHBondContact O-N 3.07Å; E791-S795 PolarHBondContact O-OG 2.84Å; E791-S795 VanDerWaalsContact O-OG 3.09Å
792	Y	89.4	Confident	87.7	Confident	57 Å²	57	54.9 Å²	54.9	22%	0.224	27%	0.271	C	S	.	.	H	α-helix	trans	-63.1	-54	172.8	-165.5	-94.3	0	0	0	112.5	K781 F783 E788 V790 Q794 S795 H796	K781-Y792 HydrophobicContact CD-CE1 3.84Å; K781-Y792 PolarHBondContact NZ-OH 3.38Å; F783-Y792 AromaticContact CE1-CD1 3.9Å; F783-Y792 HydrophobicContact CE1-CD1 3.9Å; F783-Y792 AromaticContact CE1-CD2 3.96Å; F783-Y792 HydrophobicContact CE1-CD2 3.96Å; F783-Y792 AromaticContact CE1-CG 3.48Å; F783-Y792 HydrophobicContact CE1-CG 3.48Å; F783-Y792 VanDerWaalsContact CE1-CG 3.48Å; F783-Y792 AromaticContact CZ-CD1 3.65Å; F783-Y792 HydrophobicContact CZ-CD1 3.65Å; F783-Y792 HydrophobicContact CZ-CE1 4.38Å; F783-Y792 AromaticContact CZ-CG 3.75Å; F783-Y792 HydrophobicContact CZ-CG 3.75Å; E788-Y792 VanDerWaalsContact O-CB 3.31Å; E788-Y792 WeakPolarHBondContact O-CB 3.4Å; E788-Y792 PolarHBondContact O-N 3.41Å; V790-Y792 PolarHBondContact O-N 3.49Å; Y792-Q794 VanDerWaalsContact C-N 3.33Å; Y792-Q794 PolarHBondContact O-N 3.38Å; Y792-S795 PolarHBondContact O-N 3.31Å; Y792-S795 VanDerWaalsContact O-N 3.12Å; Y792-S795 PolarHBondContact O-OG 3.04Å; Y792-H796 HydrophobicContact CD1-CB 4.08Å; Y792-H796 AromaticContact CD2-CE1 3.92Å; Y792-H796 AromaticContact CD2-ND1 3.79Å; Y792-H796 HydrophobicContact CE1-CB 3.6Å; Y792-H796 AromaticContact CE1-CG 3.53Å; Y792-H796 AromaticContact CE1-ND1 3.78Å; Y792-H796 AromaticContact CE2-CE1 3.34Å; Y792-H796 WeakPolarHBondContact CE2-CE1 3.19Å; Y792-H796 AromaticContact CE2-CG 3.93Å; Y792-H796 AromaticContact CE2-ND1 3.48Å; Y792-H796 WeakPolarHBondContact CE2-ND1 3.26Å; Y792-H796 AromaticContact CE2-NE2 3.69Å; Y792-H796 AromaticContact CZ-CD2 3.47Å; Y792-H796 VanDerWaalsContact CZ-CD2 3.47Å; Y792-H796 AromaticContact CZ-CE1 3.57Å; Y792-H796 AromaticContact CZ-CG 3.38Å; Y792-H796 AromaticContact CZ-ND1 3.45Å; Y792-H796 AromaticContact CZ-NE2 3.57Å; Y792-H796 WeakPolarHBondContact O-CB 3.48Å; Y792-H796 PolarHBondContact O-N 3.43Å; Y792-H796 PolarHBondContact O-ND1 2.83Å; Y792-H796 PolarHBondContact OH-CD2 3.23Å; Y792-H796 PolarHBondContact OH-NE2 2.78Å
793	Y	90.2	Very high	87.4	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-81.7	-5.6	-177.6	-72.1	-69.2	0	0	0	114.6	I777 F783 L789 V790 S795 L798 S801 T808 L809	I777-Y793 HydrophobicContact CD1-CD2 3.82Å; I777-Y793 HydrophobicContact CD1-CE1 4.22Å; I777-Y793 HydrophobicContact CD1-CE2 3.38Å; I777-Y793 HydrophobicContact CD1-CG 4.41Å; I777-Y793 HydrophobicContact CG1-CE2 3.87Å; F783-Y793 AromaticContact CE2-CE2 3.84Å; F783-Y793 HydrophobicContact CE2-CE2 3.84Å; F783-Y793 AromaticContact CZ-CE2 3.89Å; F783-Y793 HydrophobicContact CZ-CE2 3.89Å; L789-Y793 HydrophobicContact CD2-CD2 4.02Å; L789-Y793 HydrophobicContact CG-CD2 4.25Å; L789-Y793 HydrophobicContact CG-CE2 4.42Å; L789-Y793 WeakPolarHBondContact O-CD2 3.5Å; L789-Y793 PolarHBondContact O-N 3.18Å; L789-Y793 VanDerWaalsContact O-N 3.12Å; V790-Y793 PolarHBondContact O-N 2.92Å; Y793-S795 VanDerWaalsContact C-N 3.3Å; Y793-L798 HydrophobicContact CD1-CD2 3.63Å; Y793-L798 HydrophobicContact CD1-CG 4.22Å; Y793-L798 HydrophobicContact CD2-CD2 4.48Å; Y793-L798 HydrophobicContact CE1-CD2 4.09Å; Y793-L798 HydrophobicContact CG-CD2 3.85Å; Y793-S801 PolarHBondContact OH-OG 2.84Å; Y793-T808 CarbonylContact O-C 3.53Å; Y793-T808 WeakPolarHBondContact O-CA 3.43Å; Y793-T808 WeakPolarHBondContact O-CB 3.39Å; Y793-L809 PolarHBondContact O-N 2.93Å
794	Q	89.4	Confident	86.9	Confident	78 Å²	78	66 Å²	66	36%	0.364	33%	0.325	S	S	.	.	H	α-helix	trans	-65.9	-35.1	160.2	-79.5	174.5	8.8	0	0	111.4	Y741 V790 Y792 T808 L809	Y741-Q794 PolarHBondContact OH-NE2 3.2Å; V790-Q794 HydrophobicContact CG1-CG 4.28Å; V790-Q794 WeakPolarHBondContact O-CB 3.4Å; V790-Q794 VanDerWaalsContact O-CG 3.26Å; V790-Q794 WeakPolarHBondContact O-CG 3.31Å; V790-Q794 PolarHBondContact O-N 3.15Å; Y792-Q794 VanDerWaalsContact C-N 3.33Å; Y792-Q794 PolarHBondContact O-N 3.38Å; Q794-T808 WeakPolarHBondContact O-CB 3.46Å; Q794-L809 HydrophobicContact CG-CB 4.11Å; Q794-L809 WeakPolarHBondContact CG-O 3.44Å
795	S	83.8	Confident	87.1	Confident	82 Å²	82	59.6 Å²	59.6	57%	0.573	30%	0.296	S	S	*	.	H	α-helix	trans	-100.2	-25.9	-176	51.5	0	0	0	0	114.4	E791 Y792 Y793	E791-S795 PolarHBondContact O-OG 2.84Å; E791-S795 VanDerWaalsContact O-OG 3.09Å; Y792-S795 PolarHBondContact O-N 3.31Å; Y792-S795 VanDerWaalsContact O-N 3.12Å; Y792-S795 PolarHBondContact O-OG 3.04Å; Y793-S795 VanDerWaalsContact C-N 3.3Å
796	H	86.2	Confident	87.2	Confident	65 Å²	65	61.5 Å²	61.5	30%	0.301	30%	0.303	S	S	.	.	S	Bend	trans	-114.8	140.8	-177.3	-60.7	77.1	0	0	0	112.3	Y792	Y792-H796 HydrophobicContact CD1-CB 4.08Å; Y792-H796 AromaticContact CD2-CE1 3.92Å; Y792-H796 AromaticContact CD2-ND1 3.79Å; Y792-H796 HydrophobicContact CE1-CB 3.6Å; Y792-H796 AromaticContact CE1-CG 3.53Å; Y792-H796 AromaticContact CE1-ND1 3.78Å; Y792-H796 AromaticContact CE2-CE1 3.34Å; Y792-H796 WeakPolarHBondContact CE2-CE1 3.19Å; Y792-H796 AromaticContact CE2-CG 3.93Å; Y792-H796 AromaticContact CE2-ND1 3.48Å; Y792-H796 WeakPolarHBondContact CE2-ND1 3.26Å; Y792-H796 AromaticContact CE2-NE2 3.69Å; Y792-H796 AromaticContact CZ-CD2 3.47Å; Y792-H796 VanDerWaalsContact CZ-CD2 3.47Å; Y792-H796 AromaticContact CZ-CE1 3.57Å; Y792-H796 AromaticContact CZ-CG 3.38Å; Y792-H796 AromaticContact CZ-ND1 3.45Å; Y792-H796 AromaticContact CZ-NE2 3.57Å; Y792-H796 WeakPolarHBondContact O-CB 3.48Å; Y792-H796 PolarHBondContact O-N 3.43Å; Y792-H796 PolarHBondContact O-ND1 2.83Å; Y792-H796 PolarHBondContact OH-CD2 3.23Å; Y792-H796 PolarHBondContact OH-NE2 2.78Å
797	S	89.1	Confident	87.3	Confident	27 Å²	27	62.1 Å²	62.1	19%	0.189	31%	0.307	C	S	.	.			trans	-69.9	134.3	-176.9	-177.6	0	0	0	0	111.7	K799 E800 D806 T807	S797-K799 PolarHBondContact O-N 2.77Å; S797-K799 WeakPolarHBondContact OG-CB 3.36Å; S797-K799 PolarHBondContact OG-N 3.48Å; S797-E800 PolarHBondContact O-N 2.7Å; S797-D806 PolarHBondContact OG-OD1 2.96Å; S797-T807 PolarHBondContact OG-N 3.44Å
798	L	89.7	Confident	87.4	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-59	-15.5	173.4	-72.2	166.1	0	0	0	112.9	I757 I766 I777 Y793 E800 S801 F802 L805 T807 L809	I757-L798 HydrophobicContact CD1-CD1 4.25Å; I766-L798 HydrophobicContact CD1-CD1 3.95Å; I766-L798 HydrophobicContact CD1-CD2 3.9Å; I777-L798 HydrophobicContact CD1-CD2 3.65Å; Y793-L798 HydrophobicContact CD1-CD2 3.63Å; Y793-L798 HydrophobicContact CD1-CG 4.22Å; Y793-L798 HydrophobicContact CD2-CD2 4.48Å; Y793-L798 HydrophobicContact CE1-CD2 4.09Å; Y793-L798 HydrophobicContact CG-CD2 3.85Å; L798-E800 PolarHBondContact O-N 3.08Å; L798-S801 CarbonylContact O-C 3.57Å; L798-S801 PolarHBondContact O-N 3.37Å; L798-F802 PolarHBondContact O-N 3.31Å; L798-L805 CarbonylContact C-O 3.46Å; L798-L805 HydrophobicContact CB-CD2 4.24Å; L798-L805 HydrophobicContact CB-CG 4.07Å; L798-L805 HydrophobicContact CD1-CD2 4.02Å; L798-L805 HydrophobicContact CD1-CG 4.24Å; L798-T807 WeakPolarHBondContact CB-O 3.23Å; L798-T807 HydrophobicContact CD1-CG2 4.29Å; L798-T807 PolarHBondContact N-O 2.66Å; L798-L809 HydrophobicContact CD1-CD2 4.04Å
799	K	87.3	Confident	87.5	Confident	100 Å²	100	57.7 Å²	57.7	44%	0.435	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-52.6	-31.5	173.1	-177.9	163.9	175.7	-175.9	0	114.5	S797 S801 F802 L805 D806	S797-K799 PolarHBondContact O-N 2.77Å; S797-K799 WeakPolarHBondContact OG-CB 3.36Å; S797-K799 PolarHBondContact OG-N 3.48Å; K799-S801 VanDerWaalsContact C-N 3.26Å; K799-S801 PolarHBondContact O-N 2.71Å; K799-F802 WeakPolarHBondContact CA-O 3.48Å; K799-F802 CarbonylContact O-C 3.59Å; K799-F802 PolarHBondContact O-N 3.47Å; K799-L805 PolarHBondContact N-O 2.76Å; K799-D806 HydrophobicContact CB-CB 4.36Å; K799-D806 HydrophobicContact CD-CB 3.84Å; K799-D806 WeakPolarHBondContact CD-OD1 3.32Å; K799-D806 WeakPolarHBondContact CD-OD2 3.47Å; K799-D806 WeakPolarHBondContact CE-OD2 3.39Å; K799-D806 IonicContact NZ-OD2 3.85Å; K799-D806 PolarHBondContact NZ-OD2 3.3Å
800	E	83.1	Confident	87.2	Confident	109 Å²	109	65.1 Å²	65.1	51%	0.509	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-63.3	-33.5	176.5	-62.6	179.2	-179.1	0	0	112.2	K781 S797 L798	K781-E800 IonicContact NZ-OE2 3.29Å; K781-E800 PolarHBondContact NZ-OE2 3.21Å; S797-E800 PolarHBondContact O-N 2.7Å; L798-E800 PolarHBondContact O-N 3.08Å
801	S	84.2	Confident	87	Confident	26 Å²	26	68.6 Å²	68.6	18%	0.182	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-35.5	173.7	-82.8	0	0	0	0	112.7	T778 Y793 L798 K799	T778-S801 VanDerWaalsContact CG2-CB 3.48Å; T778-S801 WeakPolarHBondContact CG2-OG 3.43Å; T778-S801 PolarHBondContact OG1-OG 2.8Å; Y793-S801 PolarHBondContact OH-OG 2.84Å; L798-S801 CarbonylContact O-C 3.57Å; L798-S801 PolarHBondContact O-N 3.37Å; K799-S801 VanDerWaalsContact C-N 3.26Å; K799-S801 PolarHBondContact O-N 2.71Å
802	F	86.3	Confident	87.1	Confident	71 Å²	71	64.7 Å²	64.7	31%	0.311	32%	0.315	S	S	.	.			trans	-137.4	93.2	-170.2	-58.2	-70.9	0	0	0	110.4	I766 I777 T778 L798 K799 L804 L805	I766-F802 HydrophobicContact CD1-CD2 4.2Å; I766-F802 HydrophobicContact CD1-CE2 3.97Å; I766-F802 HydrophobicContact CG1-CE2 4.11Å; I766-F802 HydrophobicContact CG2-CE2 3.69Å; I766-F802 HydrophobicContact CG2-CZ 3.8Å; I777-F802 HydrophobicContact CB-CE2 4.36Å; I777-F802 HydrophobicContact CD1-CE2 4.01Å; I777-F802 HydrophobicContact CG1-CE2 4.23Å; T778-F802 HydrophobicContact CG2-CE1 4.14Å; T778-F802 HydrophobicContact CG2-CE2 4.32Å; T778-F802 HydrophobicContact CG2-CZ 3.85Å; L798-F802 PolarHBondContact O-N 3.31Å; K799-F802 WeakPolarHBondContact CA-O 3.48Å; K799-F802 CarbonylContact O-C 3.59Å; K799-F802 PolarHBondContact O-N 3.47Å; F802-L804 PolarHBondContact O-N 3.27Å; F802-L805 HydrophobicContact CB-CB 4.01Å; F802-L805 PolarHBondContact O-N 3.29Å
803	K	81	Confident	87	Confident	190 Å²	190	63.8 Å²	63.8	83%	0.826	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50	-19.8	-170.9	-64.4	-178.2	179.2	178.9	0	116.9
804	L	79.8	Confident	86.7	Confident	164 Å²	164	68.7 Å²	68.7	86%	0.859	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.5	3	-179.3	-59.7	177.2	0	0	0	114.3	F759 F802	F759-L804 WeakPolarHBondContact CE1-O 3.44Å; F802-L804 PolarHBondContact O-N 3.27Å
805	L	85.7	Confident	86.1	Confident	13 Å²	13	67.3 Å²	67.3	7%	0.068	33%	0.332	C	S	.	.			trans	-121.8	71.6	-174.7	-175.7	54.1	0	0	0	110.5	F759 K764 I766 L798 K799 F802 T807	F759-L805 HydrophobicContact CB-CD1 3.58Å; F759-L805 HydrophobicContact CD1-CD1 3.46Å; F759-L805 VanDerWaalsContact CD1-CD1 3.46Å; F759-L805 HydrophobicContact CD2-CD1 4.08Å; F759-L805 HydrophobicContact CE1-CD1 4.1Å; F759-L805 HydrophobicContact CG-CD1 3.43Å; F759-L805 VanDerWaalsContact CG-CD1 3.43Å; K764-L805 HydrophobicContact CB-CD2 4.47Å; K764-L805 HydrophobicContact CG-CD1 4.21Å; I766-L805 HydrophobicContact CD1-CD2 3.92Å; I766-L805 HydrophobicContact CG1-CD2 4.45Å; L798-L805 CarbonylContact C-O 3.46Å; L798-L805 HydrophobicContact CB-CD2 4.24Å; L798-L805 HydrophobicContact CB-CG 4.07Å; L798-L805 HydrophobicContact CD1-CD2 4.02Å; L798-L805 HydrophobicContact CD1-CG 4.24Å; K799-L805 PolarHBondContact N-O 2.76Å; F802-L805 HydrophobicContact CB-CB 4.01Å; F802-L805 PolarHBondContact O-N 3.29Å; L805-T807 VanDerWaalsContact C-N 3.33Å; L805-T807 HydrophobicContact CD1-CG2 3.84Å; L805-T807 HydrophobicContact CG-CG2 4.27Å; L805-T807 PolarHBondContact O-N 3.11Å
806	D	89.8	Confident	84.4	Confident	81 Å²	81	72.8 Å²	72.8	43%	0.433	34%	0.34	S	S	.	.			trans	-83.8	72.5	-176.5	-154.4	1.3	0	0	0	112.5	F759 S797 K799	F759-D806 WeakPolarHBondContact CE2-O 3.41Å; S797-D806 PolarHBondContact OG-OD1 2.96Å; K799-D806 HydrophobicContact CB-CB 4.36Å; K799-D806 HydrophobicContact CD-CB 3.84Å; K799-D806 WeakPolarHBondContact CD-OD1 3.32Å; K799-D806 WeakPolarHBondContact CD-OD2 3.47Å; K799-D806 WeakPolarHBondContact CE-OD2 3.39Å; K799-D806 IonicContact NZ-OD2 3.85Å; K799-D806 PolarHBondContact NZ-OD2 3.3Å
807	T	89.1	Confident	82.2	Confident	13 Å²	13	74.7 Å²	74.7	8%	0.08	35%	0.349	C	S	.	.			trans	-151.8	157.1	176.9	-167.3	0	0	0	0	111.3	I757 F759 S797 L798 L805	I757-T807 HydrophobicContact CD1-CG2 3.67Å; I757-T807 HydrophobicContact CG1-CG2 4.49Å; F759-T807 HydrophobicContact CB-CG2 4.46Å; F759-T807 HydrophobicContact CD2-CG2 3.7Å; F759-T807 HydrophobicContact CE2-CG2 4.26Å; F759-T807 HydrophobicContact CG-CG2 4.29Å; S797-T807 PolarHBondContact OG-N 3.44Å; L798-T807 WeakPolarHBondContact CB-O 3.23Å; L798-T807 HydrophobicContact CD1-CG2 4.29Å; L798-T807 PolarHBondContact N-O 2.66Å; L805-T807 VanDerWaalsContact C-N 3.33Å; L805-T807 HydrophobicContact CD1-CG2 3.84Å; L805-T807 HydrophobicContact CG-CG2 4.27Å; L805-T807 PolarHBondContact O-N 3.11Å
808	T	91	Very high	79.5	Confident	28 Å²	28	84.8 Å²	84.8	17%	0.172	38%	0.383	C	S	.	.			trans	-93.8	168.8	166.7	58.4	0	0	0	0	110.3	I757 Y793 Q794 R810	I757-T808 WeakPolarHBondContact CD1-O 3.48Å; Y793-T808 CarbonylContact O-C 3.53Å; Y793-T808 WeakPolarHBondContact O-CA 3.43Å; Y793-T808 WeakPolarHBondContact O-CB 3.39Å; Q794-T808 WeakPolarHBondContact O-CB 3.46Å; T808-R810 PolarHBondContact O-N 3.19Å
809	L	90.9	Very high	76.6	Confident	1 Å²	1	89.9 Å²	89.9	1%	0.005	42%	0.418	C	S	.	.			trans	-71.1	67.3	166.4	-58	-176.3	0	0	0	109.7	Y741 I755 I757 V790 Y793 Q794 L798	Y741-L809 VanDerWaalsContact CD1-C 3.47Å; Y741-L809 HydrophobicContact CD1-CB 3.74Å; Y741-L809 HydrophobicContact CD2-CB 4.02Å; Y741-L809 HydrophobicContact CD2-CD1 4.22Å; Y741-L809 HydrophobicContact CD2-CD2 3.95Å; Y741-L809 HydrophobicContact CD2-CG 4.28Å; Y741-L809 HydrophobicContact CE1-CB 3.64Å; Y741-L809 WeakPolarHBondContact CE1-O 3.26Å; Y741-L809 HydrophobicContact CE2-CB 3.91Å; Y741-L809 HydrophobicContact CE2-CD1 4.02Å; Y741-L809 HydrophobicContact CE2-CG 4.37Å; Y741-L809 HydrophobicContact CG-CB 3.94Å; Y741-L809 HydrophobicContact CG-CD2 3.97Å; Y741-L809 HydrophobicContact CG-CG 4.45Å; I755-L809 HydrophobicContact CD1-CD1 4.49Å; I755-L809 HydrophobicContact CG2-CD2 3.87Å; I757-L809 HydrophobicContact CD1-CD2 4.01Å; V790-L809 HydrophobicContact CG1-CD1 4.3Å; V790-L809 HydrophobicContact CG2-CD1 4.44Å; Y793-L809 PolarHBondContact O-N 2.93Å; Q794-L809 HydrophobicContact CG-CB 4.11Å; Q794-L809 WeakPolarHBondContact CG-O 3.44Å; L798-L809 HydrophobicContact CD1-CD2 4.04Å
810	R	84.7	Confident	73.9	Confident	156 Å²	156	93.2 Å²	93.2	59%	0.589	44%	0.44	S	S	*	.			trans	-74.8	-41.2	-160.8	-170.8	-176.3	-77.1	-170.3	-5.5	114.2	G739 T808	G739-R810 PolarHBondContact O-N 3.41Å; T808-R810 PolarHBondContact O-N 3.19Å
811	H	89.2	Confident	71.3	Confident	74 Å²	74	94.6 Å²	94.6	34%	0.343	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	110.7	-174.5	-59.9	-52.4	0	0	0	111	G739 T740 Y741 Y813	G739-H811 PolarHBondContact O-N 2.92Å; T740-H811 CarbonylContact C-O 3.58Å; T740-H811 VanDerWaalsContact CA-O 3.27Å; T740-H811 WeakPolarHBondContact CA-O 3.45Å; Y741-H811 WeakPolarHBondContact CD1-O 3.44Å; Y741-H811 PolarHBondContact N-O 2.63Å; H811-Y813 PolarHBondContact O-N 2.88Å
812	P	89.8	Confident	68.7	Low	23 Å²	23	105.1 Å²	105.1	15%	0.149	49%	0.492	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	134.7	170.2	-23.4	33.9	0	0	0	110.5	P718 W719 Y741 K814 S815	P718-P812 HydrophobicContact CB-CB 4.02Å; P718-P812 HydrophobicContact CG-CB 4.1Å; P718-P812 HydrophobicContact CG-CG 4.36Å; P718-P812 WeakPolarHBondContact O-CB 3.36Å; W719-P812 HydrophobicContact CB-CB 4Å; Y741-P812 HydrophobicContact CE1-CB 4.37Å; Y741-P812 HydrophobicContact CE1-CG 3.98Å; P812-K814 VanDerWaalsContact C-N 3.25Å; P812-K814 PolarHBondContact O-N 3.26Å; P812-K814 VanDerWaalsContact O-N 3.15Å; P812-S815 VanDerWaalsContact O-CB 3.24Å; P812-S815 WeakPolarHBondContact O-CB 3.31Å; P812-S815 PolarHBondContact O-N 3.41Å; P812-S815 PolarHBondContact O-OG 3.37Å
813	Y	86.9	Confident	65.9	Low	39 Å²	39	106.5 Å²	106.5	15%	0.153	52%	0.517	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-24.2	-173.5	86.2	-74	0	0	0	115	F720 A721 L732 Y741 L742 H811 S815	F720-Y813 PolarHBondContact O-OH 3.17Å; A721-Y813 WeakPolarHBondContact CA-OH 3.46Å; A721-Y813 HydrophobicContact CB-CE1 3.94Å; L732-Y813 HydrophobicContact CD2-CD2 3.73Å; L732-Y813 HydrophobicContact CD2-CE2 3.71Å; L732-Y813 HydrophobicContact CG-CD2 4.45Å; Y741-Y813 PolarHBondContact O-N 2.75Å; L742-Y813 HydrophobicContact CB-CD1 3.35Å; L742-Y813 HydrophobicContact CB-CE1 3.84Å; L742-Y813 HydrophobicContact CB-CG 3.83Å; L742-Y813 HydrophobicContact CD2-CD1 4.48Å; L742-Y813 HydrophobicContact CD2-CD2 4.46Å; L742-Y813 HydrophobicContact CD2-CG 4.28Å; H811-Y813 PolarHBondContact O-N 2.88Å; Y813-S815 VanDerWaalsContact C-N 3.3Å
814	K	84.7	Confident	63.1	Low	102 Å²	102	102.7 Å²	102.7	44%	0.443	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-1.5	171.3	-63.9	159.8	161.2	165.2	0	113.4	P718 F720 P812	P718-K814 HydrophobicContact CB-CB 4.01Å; P718-K814 VanDerWaalsContact O-CB 3.26Å; P718-K814 WeakPolarHBondContact O-CB 3.07Å; P718-K814 PolarHBondContact O-N 3.24Å; P718-K814 VanDerWaalsContact O-N 3.09Å; F720-K814 PolarHBondContact O-NZ 3.37Å; P812-K814 VanDerWaalsContact C-N 3.25Å; P812-K814 PolarHBondContact O-N 3.26Å; P812-K814 VanDerWaalsContact O-N 3.15Å
815	S	75.6	Confident	60.5	Low	50 Å²	50	100.4 Å²	100.4	35%	0.35	51%	0.507	S	S	.	.	S	Bend	trans	-80.5	123.7	179.4	72.7	0	0	0	0	110.9	P812 Y813 E817	P812-S815 VanDerWaalsContact O-CB 3.24Å; P812-S815 WeakPolarHBondContact O-CB 3.31Å; P812-S815 PolarHBondContact O-N 3.41Å; P812-S815 PolarHBondContact O-OG 3.37Å; Y813-S815 VanDerWaalsContact C-N 3.3Å; S815-E817 PolarHBondContact O-N 2.98Å
816	R	48.9	Very low	57.7	Low	197 Å²	197	111.5 Å²	111.5	74%	0.743	55%	0.548	S	S	*	.			trans	-70.9	112.5	-174	-173	154.7	69.6	-164.5	7.5	110.7	R818	R816-R818 PolarHBondContact O-N 3.24Å
817	E	38.7	Very low	54.4	Low	105 Å²	105	113.1 Å²	113.1	49%	0.491	57%	0.565	S	S	.	*			trans	-53	129.1	-177.1	-69.7	-169.4	146.8	0	0	111.9	C737 S815	C737-E817 PolarHBondContact SG-OE1 2.86Å; S815-E817 PolarHBondContact O-N 2.98Å
818	R	32.3	Very low	51.7	Low	238 Å²	238	118.4 Å²	118.4	90%	0.898	60%	0.6	S	S	*	*			trans	-108.8	89.5	165.8	-68.3	-172.5	-173.3	-178.5	3.2	107.9	R816 L820	R816-R818 PolarHBondContact O-N 3.24Å; R818-L820 PolarHBondContact O-N 2.78Å
819	S	30.7	Very low	48.4	Very low	107 Å²	107	122.3 Å²	122.3	75%	0.748	64%	0.635	S	S	*	*			trans	-59.7	123.4	-174.5	-50.4	0	0	0	0	112
820	L	29	Very low	45.2	Very low	170 Å²	170	127 Å²	127	89%	0.89	67%	0.674	S	S	*	*			trans	-91.4	108.6	179.9	-77.6	165.3	0	0	0	111.1	R818	R818-L820 PolarHBondContact O-N 2.78Å
821	T	30	Very low	42.2	Very low	139 Å²	139	126.6 Å²	126.6	85%	0.853	69%	0.689	S	S	*	*			trans	-133.6	132.6	154.9	52.6	0	0	0	0	109.1
822	R	29.5	Very low	39	Very low	247 Å²	247	129.1 Å²	129.1	93%	0.932	71%	0.714	S	S	*	*			trans	-157.8	110.6	-173.2	-177.4	-173.1	177.4	-164.3	-0.8	113.3
823	A	26.4	Very low	35.8	Very low	100 Å²	100	132.1 Å²	132.1	83%	0.826	74%	0.74	S	S	*	*			trans	163.4	144.7	155.8	0	0	0	0	0	107.1
824	S	23.2	Very low	32.8	Very low	110 Å²	110	135.2 Å²	135.2	77%	0.769	77%	0.768	S	S	*	*			cis	-159.1	156.4	-16.2	-156	0	0	0	0	104.7
825	T	25	Very low	29.7	Very low	115 Å²	115	140.7 Å²	140.7	71%	0.706	79%	0.787	S	S	*	*			cis	-164	149.3	47.2	50.5	0	0	0	0	113.1
826	R	25.5	Very low	27.2	Very low	246 Å²	246	145.4 Å²	145.4	93%	0.928	81%	0.808	S	S	*	*			trans	63.7	145.6	151.7	-71.2	-179.9	170.3	174.7	-3.1	120.2
827	S	21.3	Very low	25.9	Very low	115 Å²	115	142.9 Å²	142.9	80%	0.804	80%	0.803	S	S	*	*			trans	-119.7	-170.1	-171.8	-21.9	0	0	0	0	110
828	P	32.3	Very low	25.1	Very low	125 Å²	125	143.6 Å²	143.6	81%	0.812	82%	0.819	S	S	*	*			cis	-134	157.1	-15	36.4	-19.4	0	0	0	115.3
829	A	21.1	Very low	24.7	Very low	109 Å²	109	141 Å²	141	90%	0.901	82%	0.815	S	S	*	*			trans	-154.8	158.3	153.2	0	0	0	0	0	109
830	A	23.8	Very low	24.3	Very low	100 Å²	100	143.8 Å²	143.8	83%	0.826	82%	0.82	S	S	*	*			trans	-122	123.8	-168.7	0	0	0	0	0	114.1
831	T	22.7	Very low	24	Very low	147 Å²	147	140.7 Å²	140.7	90%	0.902	81%	0.813	S	S	*	*			trans	-151.4	147.6	157	-3.2	0	0	0	0	109.2
832	C	22.3	Very low	23.7	Very low	128 Å²	128	140 Å²	140	87%	0.865	81%	0.811	S	S	*	*			trans	-87.2	140.3	175.2	54.4	0	0	0	0	111.1
833	A	21.5	Very low	23.4	Very low	85 Å²	85	137.6 Å²	137.6	70%	0.702	81%	0.81	S	S	*	*			trans	-147.5	148.7	173.1	0	0	0	0	0	111.7
834	S	23.3	Very low	23.3	Very low	104 Å²	104	136.2 Å²	136.2	73%	0.727	81%	0.806	S	S	*	*			trans	-8.9	136.3	164.9	40.9	0	0	0	0	119.9
835	Y	21.4	Very low	23.4	Very low	218 Å²	218	138.3 Å²	138.3	86%	0.855	81%	0.807	S	S	*	*			trans	-115.8	116.1	147.1	-85	-79	0	0	0	110.2
836	N	22.1	Very low	23.2	Very low	148 Å²	148	140.9 Å²	140.9	79%	0.791	82%	0.817	S	S	*	*			trans	-65.7	146.6	162.8	-71.5	-44.1	0	0	0	109.6
837	F	22.5	Very low	23	Very low	145 Å²	145	138.2 Å²	138.2	64%	0.636	81%	0.813	S	S	*	*			trans	-128	104.3	161.6	-108.6	-79.1	0	0	0	110.2
838	S	21.6	Very low	23	Very low	119 Å²	119	137.3 Å²	137.3	83%	0.832	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-65	129.5	163.7	-49.5	0	0	0	0	108.7
839	F	23.3	Very low	22.8	Very low	185 Å²	185	137.1 Å²	137.1	81%	0.811	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-102.5	129.3	174.2	-133.9	-88.1	0	0	0	109.9
840	L	22	Very low	22.9	Very low	164 Å²	164	139.1 Å²	139.1	86%	0.859	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-83.2	120.4	168.4	-75.4	163.1	0	0	0	108
841	S	23.3	Very low	22.9	Very low	105 Å²	105	139 Å²	139	73%	0.734	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-66.8	138.1	174.7	-54.2	0	0	0	0	110.9	Q843	S841-Q843 PolarHBondContact O-N 2.82Å
842	P	24.2	Very low	23.1	Very low	124 Å²	124	136.5 Å²	136.5	81%	0.805	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-65.8	117.9	162.4	-14.8	29.6	0	0	0	109.3
843	Q	22.8	Very low	23.3	Very low	197 Å²	197	133.7 Å²	133.7	92%	0.921	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-72.6	131.8	161.8	-68.9	175.6	-32.2	0	0	107.8	S841	S841-Q843 PolarHBondContact O-N 2.82Å
844	G	24.1	Very low	24.5	Very low	71 Å²	71	134 Å²	134	73%	0.732	76%	0.761	S	S	*	*			trans	-177.8	-20.7	-174.6	0	0	0	0	0	117.6
845	L	24.5	Very low	24.7	Very low	154 Å²	154	138.4 Å²	138.4	81%	0.806	77%	0.767	S	S	*	*			trans	-140.2	114.7	170.3	-71.7	176.6	0	0	0	110	F847	L845-F847 PolarHBondContact O-N 3.49Å
846	N	21.8	Very low	24.8	Very low	170 Å²	170	136.8 Å²	136.8	91%	0.909	76%	0.76	S	S	*	*			trans	-82.2	96.3	167.9	-90.5	-0.2	0	0	0	109
847	F	22	Very low	25	Very low	190 Å²	190	134.6 Å²	134.6	83%	0.833	76%	0.756	S	S	*	*			trans	-88.1	114.9	152.7	-97.3	-86.7	0	0	0	108.3	L845 S849	L845-F847 PolarHBondContact O-N 3.49Å; F847-S849 PolarHBondContact O-N 2.93Å
848	S	21.1	Very low	25.1	Very low	95 Å²	95	134.1 Å²	134.1	66%	0.664	77%	0.765	S	S	*	*			trans	-66.1	103.9	177	-62.5	0	0	0	0	110	Q850	S848-Q850 PolarHBondContact O-N 2.96Å
849	S	27.2	Very low	25.5	Very low	122 Å²	122	137.1 Å²	137.1	85%	0.853	76%	0.763	S	S	*	*			trans	-74.6	76.1	169.8	62.2	0	0	0	0	110.1	F847	F847-S849 PolarHBondContact O-N 2.93Å
850	Q	23.5	Very low	25.8	Very low	151 Å²	151	134.2 Å²	134.2	71%	0.706	76%	0.761	S	S	*	*			trans	-107.4	115.7	165.3	-66.8	175.7	-0.9	0	0	105.8	S848	S848-Q850 PolarHBondContact O-N 2.96Å
851	S	24.8	Very low	26.8	Very low	96 Å²	96	129.5 Å²	129.5	67%	0.671	74%	0.74	S	S	*	*				75.9	60.1	50.5	-170.6	0	0	0	0	113	A853	S851-A853 PolarHBondContact O-N 3.4Å
852	S	25.5	Very low	28	Very low	96 Å²	96	135.5 Å²	135.5	67%	0.671	75%	0.746	S	S	*	*			trans	-50.5	125.2	146.7	50.4	0	0	0	0	108.3
853	A	27.2	Very low	30.1	Very low	69 Å²	69	133 Å²	133	57%	0.57	73%	0.728	S	S	*	*			trans	-113.1	-172	-151.8	0	0	0	0	0	112.4	S851	S851-A853 PolarHBondContact O-N 3.4Å
854	P	46.8	Very low	32.6	Very low	91 Å²	91	127.9 Å²	127.9	59%	0.591	71%	0.71	S	S	*	*			trans	-122	164.1	-132.3	40.2	-25.6	0	0	0	116.1	W856	P854-W856 HydrophobicContact CG-CZ2 4.41Å
855	F	26.5	Very low	35.3	Very low	196 Å²	196	125.8 Å²	125.8	86%	0.86	69%	0.685	S	S	*	*			trans	-135.7	166.8	154.4	-136.2	-104.8	0	0	0	112.9
856	W	25.2	Very low	38.2	Very low	185 Å²	185	121 Å²	121	70%	0.701	66%	0.662	S	S	*	*			trans	-118.5	-177.6	-140.5	-39	79.4	0	0	0	114.3	P854	P854-W856 HydrophobicContact CG-CZ2 4.41Å
857	S	25.3	Very low	41.4	Very low	101 Å²	101	112.9 Å²	112.9	71%	0.706	62%	0.619	S	S	*	*			cis	-167.2	123.8	12	41.1	0	0	0	0	113.1
858	V	25.3	Very low	44.7	Very low	136 Å²	136	105.5 Å²	105.5	82%	0.824	59%	0.589	S	S	*	*	S	Bend	trans	-150.6	42.1	146.5	-154.2	0	0	0	0	113.9
859	F	28.5	Very low	48	Very low	182 Å²	182	101 Å²	101	80%	0.798	56%	0.558	S	S	*	*			trans	-141.4	112.3	165.5	-77.3	-67.4	0	0	0	112.3
860	T	31.1	Very low	50.6	Low	124 Å²	124	101.3 Å²	101.3	76%	0.761	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-73.3	138.1	161.1	41.6	0	0	0	0	109.2
861	P	41.7	Very low	53.4	Low	64 Å²	64	100.9 Å²	100.9	42%	0.416	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-63.9	142.1	171.5	-12	26	0	0	0	109.4	V863 Y892	P861-V863 PolarHBondContact O-N 2.8Å; P861-Y892 HydrophobicContact CB-CD1 3.64Å; P861-Y892 HydrophobicContact CB-CD2 4.3Å; P861-Y892 HydrophobicContact CB-CE1 3.84Å; P861-Y892 HydrophobicContact CB-CE2 4.46Å; P861-Y892 HydrophobicContact CB-CG 3.9Å; P861-Y892 HydrophobicContact CG-CD1 4.29Å; P861-Y892 HydrophobicContact CG-CD2 4.19Å; P861-Y892 HydrophobicContact CG-CE1 4.18Å; P861-Y892 HydrophobicContact CG-CE2 4.08Å; P861-Y892 HydrophobicContact CG-CG 4.3Å; P861-Y892 VanDerWaalsContact O-CE1 3.27Å; P861-Y892 WeakPolarHBondContact O-CE1 3.46Å
862	R	49	Very low	56.2	Low	232 Å²	232	101.2 Å²	101.2	88%	0.875	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-66.9	122.2	174.5	-71.3	-172.2	-179.3	-171.2	2.2	109.1	V864	R862-V864 PolarHBondContact O-N 3.46Å
863	V	69.4	Low	59.1	Low	70 Å²	70	97.8 Å²	97.8	42%	0.424	50%	0.5	S	S	.	.	P	Polyproline II helix	trans	-63.1	127	171.4	-178	0	0	0	0	108.5	P861 S865 K890 Y892	P861-V863 PolarHBondContact O-N 2.8Å; V863-S865 VanDerWaalsContact CG1-O 3.22Å; V863-S865 WeakPolarHBondContact CG1-O 3.41Å; V863-K890 HydrophobicContact CG1-CB 4.17Å; V863-K890 HydrophobicContact CG2-CB 4.13Å; V863-K890 HydrophobicContact CG2-CD 4.22Å; V863-K890 HydrophobicContact CG2-CG 4.46Å; V863-Y892 HydrophobicContact CB-CE1 4.48Å; V863-Y892 HydrophobicContact CG2-CD1 4.27Å; V863-Y892 HydrophobicContact CG2-CE1 3.63Å
864	V	75.4	Confident	61.7	Low	90 Å²	90	97.9 Å²	97.9	55%	0.545	50%	0.501	S	S	.	.			trans	-85.5	-38.9	178.3	178.8	0	0	0	0	110.5	R862 I891	R862-V864 PolarHBondContact O-N 3.46Å; V864-I891 PolarHBondContact N-O 3.04Å
865	S	80.3	Confident	63.4	Low	27 Å²	27	95.2 Å²	95.2	19%	0.189	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.2	172.7	178.8	51	0	0	0	0	110.7	V863 I891 K894 E920	V863-S865 VanDerWaalsContact CG1-O 3.22Å; V863-S865 WeakPolarHBondContact CG1-O 3.41Å; S865-I891 WeakPolarHBondContact O-CB 3.49Å; S865-I891 PolarHBondContact O-N 3.03Å; S865-I891 WeakPolarHBondContact OG-CD1 3.45Å; S865-K894 VanDerWaalsContact OG-CE 3.24Å; S865-K894 WeakPolarHBondContact OG-CE 3.18Å; S865-K894 PolarHBondContact OG-NZ 3.12Å; S865-E920 WeakPolarHBondContact CB-OE1 3.41Å; S865-E920 PolarHBondContact OG-OE1 3.44Å
866	T	85.9	Confident	65	Low	54 Å²	54	96.2 Å²	96.2	33%	0.331	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	142	175.5	-53.7	0	0	0	0	109.5	I888 E921	T866-I888 HydrophobicContact CG2-CG2 3.54Å; T866-E921 PolarHBondContact O-N 2.62Å; T866-E921 VanDerWaalsContact O-N 3.14Å
867	A	88.1	Confident	66.8	Low	0 Å²	0	91.5 Å²	91.5	0%	0	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	159.1	179.7	0	0	0	0	0	111.7	V889 I891 V918 D919 E920	A867-V889 PolarHBondContact N-O 2.84Å; A867-V889 PolarHBondContact O-N 2.64Å; A867-I891 HydrophobicContact CB-CD1 3.78Å; A867-V918 HydrophobicContact CB-CB 3.81Å; A867-V918 HydrophobicContact CB-CG2 3.62Å; A867-D919 CarbonylContact C-O 3Å; A867-D919 WeakPolarHBondContact CA-O 3.43Å; A867-D919 VanDerWaalsContact CB-O 3.27Å; A867-D919 WeakPolarHBondContact CB-O 3.25Å; A867-E920 HydrophobicContact CB-CG 4.22Å
868	V	90.5	Very high	68.4	Low	34 Å²	34	95 Å²	95	21%	0.206	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	128.2	175.5	-177.2	0	0	0	0	109.3	R870 D887 V918 D919 E921	V868-R870 PolarHBondContact O-N 2.69Å; V868-D887 WeakPolarHBondContact CA-O 3.44Å; V868-V918 CarbonylContact O-C 3.57Å; V868-V918 VanDerWaalsContact O-CA 3.32Å; V868-V918 WeakPolarHBondContact O-CA 3.37Å; V868-D919 PolarHBondContact N-O 3.15Å; V868-D919 PolarHBondContact O-N 2.92Å; V868-E921 HydrophobicContact CG2-CG 4.23Å
869	A	90.8	Very high	70.7	Confident	2 Å²	2	97 Å²	97	2%	0.017	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	125.9	178.8	0	0	0	0	0	111.8	L883 R884 G886 D887 V889 Y917 V918	A869-L883 HydrophobicContact CB-CB 4.14Å; A869-L883 HydrophobicContact CB-CD1 4.25Å; A869-R884 WeakPolarHBondContact CB-O 3.38Å; A869-G886 PolarHBondContact O-N 3.09Å; A869-D887 HydrophobicContact CB-CB 4.17Å; A869-D887 PolarHBondContact N-O 2.91Å; A869-V889 HydrophobicContact CB-CG2 4.49Å; A869-Y917 CarbonylContact C-O 3.55Å; A869-Y917 WeakPolarHBondContact CA-O 3.44Å; A869-V918 HydrophobicContact CB-CG1 4.29Å
870	R	82.6	Confident	73.3	Confident	128 Å²	128	90.1 Å²	90.1	48%	0.483	44%	0.444	S	S	.	.			trans	-92	-22	179.7	-72.8	-61.2	-163.3	-159.6	-5.3	113.8	V868 E885 Y917 D919	V868-R870 PolarHBondContact O-N 2.69Å; R870-E885 WeakPolarHBondContact O-CG 3.45Å; R870-Y917 PolarHBondContact N-O 3.47Å; R870-D919 HydrophobicContact CG-CB 4.28Å; R870-D919 IonicContact CZ-OD2 3.19Å; R870-D919 IonicContact NE-OD2 2.71Å; R870-D919 PolarHBondContact NE-OD2 2.97Å; R870-D919 IonicContact NH2-OD2 2.81Å; R870-D919 PolarHBondContact NH2-OD2 3.09Å
871	Y	81.4	Confident	75.9	Confident	141 Å²	141	84.5 Å²	84.5	55%	0.553	41%	0.409	S	S	*	.	S	Bend	trans	-142.7	148.8	-176.2	-56.9	-63	0	0	0	110.5	F873	Y871-F873 PolarHBondContact O-N 2.95Å
872	N	84.4	Confident	78.1	Confident	103 Å²	103	84.6 Å²	84.6	55%	0.551	41%	0.412	S	S	*	.			trans	-68.3	128.3	173.7	-58.9	-69.6	0	0	0	110.4	L883 R884 E885	N872-L883 CarbonylContact C-O 3.37Å; N872-L883 WeakPolarHBondContact CA-O 3.31Å; N872-R884 VanDerWaalsContact OD1-CA 3.28Å; N872-R884 WeakPolarHBondContact OD1-CA 3.35Å; N872-E885 PolarHBondContact OD1-N 3.32Å
873	F	85.2	Confident	79.9	Confident	24 Å²	24	73.7 Å²	73.7	11%	0.105	37%	0.371	C	S	.	.	B	Isolated β-bridge	trans	-124.6	137.6	174.1	176.4	-99.2	0	0	0	110	Y871 E880 L881 S882 L883 W901 F913 P914 Y917	Y871-F873 PolarHBondContact O-N 2.95Å; F873-E880 HydrophobicContact CE1-CB 4.36Å; F873-L881 VanDerWaalsContact CD1-O 3.27Å; F873-L881 WeakPolarHBondContact CD1-O 3.31Å; F873-S882 CarbonylContact O-C 3.53Å; F873-S882 VanDerWaalsContact O-CA 3.25Å; F873-S882 WeakPolarHBondContact O-CA 3.19Å; F873-S882 WeakPolarHBondContact O-CB 3.4Å; F873-L883 HydrophobicContact CB-CB 4.36Å; F873-L883 PolarHBondContact N-O 2.85Å; F873-L883 PolarHBondContact O-N 3.15Å; F873-L883 VanDerWaalsContact O-O 3.07Å; F873-W901 HydrophobicContact CE1-CH2 4.49Å; F873-W901 HydrophobicContact CE1-CZ3 4.3Å; F873-W901 HydrophobicContact CE2-CH2 4.03Å; F873-W901 AromaticContact CZ-CH2 3.59Å; F873-W901 HydrophobicContact CZ-CH2 3.59Å; F873-W901 AromaticContact CZ-CZ3 3.82Å; F873-W901 HydrophobicContact CZ-CZ3 3.82Å; F873-F913 HydrophobicContact CD1-CB 4.45Å; F873-P914 HydrophobicContact CD2-CG 3.86Å; F873-P914 HydrophobicContact CE2-CG 3.75Å; F873-P914 HydrophobicContact CG-CG 4.49Å; F873-P914 HydrophobicContact CZ-CG 4.3Å; F873-Y917 HydrophobicContact CB-CD1 3.73Å; F873-Y917 HydrophobicContact CB-CE1 4.11Å; F873-Y917 HydrophobicContact CB-CG 4.49Å; F873-Y917 HydrophobicContact CD2-CE1 4.36Å
874	A	83.5	Confident	80.8	Confident	72 Å²	72	79 Å²	79	60%	0.595	38%	0.383	S	S	*	.			trans	-119.1	117.1	-178.8	0	0	0	0	0	110.2
875	A	81.1	Confident	81.4	Confident	35 Å²	35	80.9 Å²	80.9	29%	0.289	39%	0.386	S	S	.	.			trans	-59.8	139.3	176.4	0	0	0	0	0	112.1	E880 S882	A875-E880 WeakPolarHBondContact CA-OE2 3.32Å; A875-E880 HydrophobicContact CB-CB 3.58Å; A875-S882 WeakPolarHBondContact CB-OG 3.32Å; A875-S882 PolarHBondContact N-OG 3.34Å
876	R	60.4	Low	81.4	Confident	216 Å²	216	82.1 Å²	82.1	82%	0.815	40%	0.403	S	S	*	.	S	Bend	trans	-98.7	-24.9	-179.9	-61.5	171.8	177.7	-178.1	0.2	112.9	E880	R876-E880 WeakPolarHBondContact CB-OE2 3.36Å; R876-E880 PolarHBondContact N-OE2 2.93Å
877	D	63.6	Low	81.5	Confident	87 Å²	87	80.7 Å²	80.7	47%	0.465	39%	0.393	S	S	.	.	S	Bend	trans	-140.8	-176.7	177.2	71.7	31	0	0	0	111.9	R879 E880	D877-R879 VanDerWaalsContact C-N 3.26Å; D877-R879 PolarHBondContact O-N 3.19Å; D877-R879 WeakPolarHBondContact OD1-CA 3.47Å; D877-R879 VanDerWaalsContact OD1-CB 3.28Å; D877-R879 WeakPolarHBondContact OD1-CB 3.26Å; D877-R879 PolarHBondContact OD1-N 3.27Å; D877-E880 PolarHBondContact OD1-N 3.46Å; D877-E880 VanDerWaalsContact OD1-N 3.15Å
878	M	59.3	Low	81.5	Confident	173 Å²	173	86 Å²	86	85%	0.852	42%	0.42	S	S	*	.	S	Bend	trans	-76.8	-2.9	-177.8	-69.5	-67.7	-67.8	0	0	114.9
879	R	72.4	Confident	81.5	Confident	178 Å²	178	84.4 Å²	84.4	67%	0.672	41%	0.411	S	S	*	.	S	Bend	trans	-99.4	-25.9	179.2	-56.2	174.6	176	177	-1.2	111.1	D877 G911 W912	D877-R879 VanDerWaalsContact C-N 3.26Å; D877-R879 PolarHBondContact O-N 3.19Å; D877-R879 WeakPolarHBondContact OD1-CA 3.47Å; D877-R879 VanDerWaalsContact OD1-CB 3.28Å; D877-R879 WeakPolarHBondContact OD1-CB 3.26Å; D877-R879 PolarHBondContact OD1-N 3.27Å; R879-G911 WeakPolarHBondContact O-CA 3.4Å; R879-W912 PolarHBondContact O-N 2.74Å
880	E	83.3	Confident	81.4	Confident	38 Å²	38	88.5 Å²	88.5	18%	0.178	43%	0.428	C	S	.	.	B	Isolated β-bridge	trans	-80.1	152.2	174.7	-66.3	-175.4	171.2	0	0	113.3	F873 A875 R876 D877 W901 W912	F873-E880 HydrophobicContact CE1-CB 4.36Å; A875-E880 WeakPolarHBondContact CA-OE2 3.32Å; A875-E880 HydrophobicContact CB-CB 3.58Å; R876-E880 WeakPolarHBondContact CB-OE2 3.36Å; R876-E880 PolarHBondContact N-OE2 2.93Å; D877-E880 PolarHBondContact OD1-N 3.46Å; D877-E880 VanDerWaalsContact OD1-N 3.15Å; E880-W901 HydrophobicContact CG-CH2 4.28Å; E880-W901 HydrophobicContact CG-CZ3 3.9Å; E880-W901 VanDerWaalsContact OE1-CH2 3.28Å; E880-W901 WeakPolarHBondContact OE1-CH2 3.32Å; E880-W912 CarbonylContact C-O 3.49Å; E880-W912 VanDerWaalsContact CA-O 3.23Å; E880-W912 WeakPolarHBondContact CA-O 3.28Å
881	L	85.6	Confident	81.6	Confident	7 Å²	7	82.4 Å²	82.4	4%	0.037	41%	0.405	C	S	.	.			trans	-114	113.5	177.2	174.9	62.4	0	0	0	110.6	F873 L883 A906 R909 W912 F913	F873-L881 VanDerWaalsContact CD1-O 3.27Å; F873-L881 WeakPolarHBondContact CD1-O 3.31Å; L881-L883 HydrophobicContact CD2-CD2 4.01Å; L881-L883 HydrophobicContact CG-CD2 4.03Å; L881-A906 HydrophobicContact CD2-CB 4.09Å; L881-R909 HydrophobicContact CD1-CB 3.8Å; L881-W912 PolarHBondContact N-O 3.12Å; L881-F913 HydrophobicContact CD2-CD1 4.11Å
882	S	86.9	Confident	81.6	Confident	66 Å²	66	77.4 Å²	77.4	46%	0.462	39%	0.385	S	S	.	.			trans	-64.4	135.6	170.4	-59.9	0	0	0	0	111.4	F873 A875	F873-S882 CarbonylContact O-C 3.53Å; F873-S882 VanDerWaalsContact O-CA 3.25Å; F873-S882 WeakPolarHBondContact O-CA 3.19Å; F873-S882 WeakPolarHBondContact O-CB 3.4Å; A875-S882 WeakPolarHBondContact CB-OG 3.32Å; A875-S882 PolarHBondContact N-OG 3.34Å
883	L	88.6	Confident	81.3	Confident	3 Å²	3	74.1 Å²	74.1	2%	0.016	37%	0.37	C	S	.	.	B	Isolated β-bridge	trans	-123.8	148.3	177	-60.7	-179.8	0	0	0	110.4	A869 N872 F873 L881 V889 A906 F913 V918	A869-L883 HydrophobicContact CB-CB 4.14Å; A869-L883 HydrophobicContact CB-CD1 4.25Å; N872-L883 CarbonylContact C-O 3.37Å; N872-L883 WeakPolarHBondContact CA-O 3.31Å; F873-L883 HydrophobicContact CB-CB 4.36Å; F873-L883 PolarHBondContact N-O 2.85Å; F873-L883 PolarHBondContact O-N 3.15Å; F873-L883 VanDerWaalsContact O-O 3.07Å; L881-L883 HydrophobicContact CD2-CD2 4.01Å; L881-L883 HydrophobicContact CG-CD2 4.03Å; L883-V889 HydrophobicContact CD1-CG2 4.19Å; L883-V889 HydrophobicContact CD2-CG1 4.44Å; L883-V889 HydrophobicContact CD2-CG2 3.66Å; L883-A906 HydrophobicContact CD2-CB 3.67Å; L883-F913 HydrophobicContact CD1-CB 3.9Å; L883-F913 HydrophobicContact CD1-CD1 4.37Å; L883-F913 HydrophobicContact CD1-CD2 3.7Å; L883-F913 HydrophobicContact CD1-CE2 4.34Å; L883-F913 HydrophobicContact CD1-CG 3.72Å; L883-F913 HydrophobicContact CG-CB 4.35Å; L883-F913 HydrophobicContact CG-CG 4.47Å; L883-V918 HydrophobicContact CD1-CG1 3.71Å
884	R	87.2	Confident	80.9	Confident	181 Å²	181	76.5 Å²	76.5	68%	0.683	38%	0.381	S	S	*	.			trans	-110.2	148.8	167.6	-64.2	178.8	176.9	-120.8	-3.2	110.3	A869 N872 G886 D887	A869-R884 WeakPolarHBondContact CB-O 3.38Å; N872-R884 VanDerWaalsContact OD1-CA 3.28Å; N872-R884 WeakPolarHBondContact OD1-CA 3.35Å; R884-G886 PolarHBondContact O-N 2.99Å; R884-D887 WeakPolarHBondContact CB-OD2 3.48Å; R884-D887 PolarHBondContact N-OD2 2.86Å; R884-D887 VanDerWaalsContact O-CB 3.31Å; R884-D887 WeakPolarHBondContact O-CB 3.49Å; R884-D887 PolarHBondContact O-N 3.08Å
885	E	88.1	Confident	79.6	Confident	130 Å²	130	80.6 Å²	80.6	61%	0.607	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	123	171.9	-177	176	170.6	0	0	110.2	R870 N872	R870-E885 WeakPolarHBondContact O-CG 3.45Å; N872-E885 PolarHBondContact OD1-N 3.32Å
886	G	80	Confident	78.2	Confident	52 Å²	52	81 Å²	81	54%	0.536	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.6	-7.7	-172.2	0	0	0	0	0	116.2	A869 R884 I888	A869-G886 PolarHBondContact O-N 3.09Å; R884-G886 PolarHBondContact O-N 2.99Å; G886-I888 PolarHBondContact O-N 3.13Å
887	D	88	Confident	77.6	Confident	25 Å²	25	72.4 Å²	72.4	13%	0.134	38%	0.377	C	S	.	.			trans	-64.3	133.8	174.2	-83.5	-26.5	0	0	0	111.1	V868 A869 R884 N907	V868-D887 WeakPolarHBondContact CA-O 3.44Å; A869-D887 HydrophobicContact CB-CB 4.17Å; A869-D887 PolarHBondContact N-O 2.91Å; R884-D887 WeakPolarHBondContact CB-OD2 3.48Å; R884-D887 PolarHBondContact N-OD2 2.86Å; R884-D887 VanDerWaalsContact O-CB 3.31Å; R884-D887 WeakPolarHBondContact O-CB 3.49Å; R884-D887 PolarHBondContact O-N 3.08Å; D887-N907 PolarHBondContact OD1-ND2 3Å; D887-N907 PolarHBondContact OD2-ND2 3.35Å; D887-N907 VanDerWaalsContact OD2-ND2 3.15Å
888	I	88.5	Confident	76.8	Confident	112 Å²	112	76.7 Å²	76.7	57%	0.574	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.5	123.1	170.8	-58.1	176.3	0	0	0	108.7	T866 G886	T866-I888 HydrophobicContact CG2-CG2 3.54Å; G886-I888 PolarHBondContact O-N 3.13Å
889	V	90.1	Very high	76.5	Confident	0 Å²	0	76.9 Å²	76.9	0%	0	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	122.3	-174.2	-165.4	0	0	0	0	110.2	A867 A869 L883 E905 A906 F913 V918	A867-V889 PolarHBondContact N-O 2.84Å; A867-V889 PolarHBondContact O-N 2.64Å; A869-V889 HydrophobicContact CB-CG2 4.49Å; L883-V889 HydrophobicContact CD1-CG2 4.19Å; L883-V889 HydrophobicContact CD2-CG1 4.44Å; L883-V889 HydrophobicContact CD2-CG2 3.66Å; V889-E905 WeakPolarHBondContact CA-O 3.24Å; V889-A906 HydrophobicContact CG1-CB 4.46Å; V889-A906 HydrophobicContact CG2-CB 4.22Å; V889-F913 HydrophobicContact CG1-CD1 4.43Å; V889-F913 HydrophobicContact CG1-CE1 3.58Å; V889-F913 HydrophobicContact CG1-CZ 3.69Å; V889-V918 HydrophobicContact CG2-CG1 4.22Å
890	K	88.5	Confident	76.4	Confident	88 Å²	88	70 Å²	70	38%	0.383	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	121	171.3	-57.5	171.2	-165.9	156.2	0	108.8	V863 G904 E905	V863-K890 HydrophobicContact CG1-CB 4.17Å; V863-K890 HydrophobicContact CG2-CB 4.13Å; V863-K890 HydrophobicContact CG2-CD 4.22Å; V863-K890 HydrophobicContact CG2-CG 4.46Å; K890-G904 CarbonylContact O-C 3.39Å; K890-G904 WeakPolarHBondContact O-CA 3.49Å; K890-E905 HydrophobicContact CB-CB 4.39Å; K890-E905 PolarHBondContact N-O 2.94Å; K890-E905 IonicContact NZ-OE1 3.08Å; K890-E905 PolarHBondContact NZ-OE1 2.8Å; K890-E905 PolarHBondContact O-N 2.88Å
891	I	87.4	Confident	76.4	Confident	0 Å²	0	71.5 Å²	71.5	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	128.6	-179.2	-64	162.3	0	0	0	109.4	V864 S865 A867 K894 W902 F913 E920	V864-I891 PolarHBondContact N-O 3.04Å; S865-I891 WeakPolarHBondContact O-CB 3.49Å; S865-I891 PolarHBondContact O-N 3.03Å; S865-I891 WeakPolarHBondContact OG-CD1 3.45Å; A867-I891 HydrophobicContact CB-CD1 3.78Å; I891-K894 HydrophobicContact CG2-CG 3.85Å; I891-W902 HydrophobicContact CD1-CE3 3.51Å; I891-W902 HydrophobicContact CD1-CZ3 3.58Å; I891-W902 HydrophobicContact CG1-CE3 4.23Å; I891-F913 HydrophobicContact CG1-CZ 4.33Å; I891-E920 HydrophobicContact CD1-CG 4.31Å; I891-E920 WeakPolarHBondContact CD1-OE1 3.48Å
892	Y	81.4	Confident	76.6	Confident	35 Å²	35	73.2 Å²	73.2	14%	0.137	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	-24.5	178.5	-68.1	-43.6	0	0	0	113.3	P861 V863 K903 E905 I910	P861-Y892 HydrophobicContact CB-CD1 3.64Å; P861-Y892 HydrophobicContact CB-CD2 4.3Å; P861-Y892 HydrophobicContact CB-CE1 3.84Å; P861-Y892 HydrophobicContact CB-CE2 4.46Å; P861-Y892 HydrophobicContact CB-CG 3.9Å; P861-Y892 HydrophobicContact CG-CD1 4.29Å; P861-Y892 HydrophobicContact CG-CD2 4.19Å; P861-Y892 HydrophobicContact CG-CE1 4.18Å; P861-Y892 HydrophobicContact CG-CE2 4.08Å; P861-Y892 HydrophobicContact CG-CG 4.3Å; P861-Y892 VanDerWaalsContact O-CE1 3.27Å; P861-Y892 WeakPolarHBondContact O-CE1 3.46Å; V863-Y892 HydrophobicContact CB-CE1 4.48Å; V863-Y892 HydrophobicContact CG2-CD1 4.27Å; V863-Y892 HydrophobicContact CG2-CE1 3.63Å; Y892-K903 PolarHBondContact N-O 2.95Å; Y892-E905 HydrophobicContact CD2-CB 4.36Å; Y892-E905 HydrophobicContact CE2-CB 3.63Å; Y892-E905 HydrophobicContact CE2-CG 4.49Å; Y892-E905 WeakPolarHBondContact CE2-OE2 3.42Å; Y892-E905 PolarHBondContact OH-OE2 2.66Å; Y892-I910 HydrophobicContact CD2-CD1 4.46Å; Y892-I910 HydrophobicContact CD2-CG2 4.24Å; Y892-I910 HydrophobicContact CE2-CD1 3.89Å; Y892-I910 HydrophobicContact CE2-CG1 4.16Å
893	S	78.8	Confident	76.6	Confident	34 Å²	34	73.9 Å²	73.9	24%	0.238	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	139.1	168.1	-175.7	0	0	0	0	112.4	I895 K903	S893-I895 PolarHBondContact OG-N 3.01Å; S893-K903 PolarHBondContact N-O 3.24Å; S893-K903 PolarHBondContact O-N 2.89Å
894	K	76.7	Confident	76.5	Confident	74 Å²	74	73.8 Å²	73.8	32%	0.322	39%	0.387	S	S	.	.	S	Bend	trans	-105.4	1.4	168.4	-58.2	-178.5	-177.8	176.2	0	112.6	S865 I891 W902 E920	S865-K894 VanDerWaalsContact OG-CE 3.24Å; S865-K894 WeakPolarHBondContact OG-CE 3.18Å; S865-K894 PolarHBondContact OG-NZ 3.12Å; I891-K894 HydrophobicContact CG2-CG 3.85Å; K894-W902 HydrophobicContact CD-CZ2 4.16Å; K894-W902 HydrophobicContact CG-CD2 4.16Å; K894-W902 HydrophobicContact CG-CG 4.24Å; K894-W902 HydrophobicContact CG-CZ2 4.49Å; K894-E920 WeakPolarHBondContact CE-OE1 3.19Å; K894-E920 IonicContact NZ-OE1 3.3Å; K894-E920 PolarHBondContact NZ-OE1 2.93Å; K894-E920 IonicContact NZ-OE2 3.88Å; K894-E920 PolarHBondContact NZ-OE2 2.69Å
895	I	55.5	Low	76.6	Confident	159 Å²	159	66.9 Å²	66.9	82%	0.815	36%	0.363	S	S	*	.	S	Bend	trans	-119	70	-164.5	-47.6	173.2	0	0	0	108.5	S893	S893-I895 PolarHBondContact OG-N 3.01Å
896	G	52.5	Low	76.5	Confident	44 Å²	44	60.9 Å²	60.9	45%	0.454	34%	0.335	S	S	.	.	S	Bend	trans	177.4	49.5	-175.8	0	0	0	0	0	115.1	W912	G896-W912 VanDerWaalsContact O-CH2 3.25Å; G896-W912 WeakPolarHBondContact O-CH2 3.38Å; G896-W912 VanDerWaalsContact O-CZ3 3.22Å; G896-W912 WeakPolarHBondContact O-CZ3 3.27Å
897	G	46.1	Very low	76.3	Confident	35 Å²	35	64.6 Å²	64.6	36%	0.361	34%	0.343	S	S	.	.			trans	177.6	105.3	174.2	0	0	0	0	0	112	Q899 G900	G897-Q899 PolarHBondContact O-N 3.09Å; G897-G900 PolarHBondContact O-N 3.42Å
898	D	47	Very low	75.5	Confident	177 Å²	177	66.6 Å²	66.6	95%	0.947	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	11.8	-175.1	-58.2	-44.7	0	0	0	114.6
899	Q	54.5	Low	74.8	Confident	177 Å²	177	70.3 Å²	70.3	83%	0.827	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-136.4	25.2	179.6	-59.8	-170.4	5.2	0	0	113	G897	G897-Q899 PolarHBondContact O-N 3.09Å
900	G	70.2	Confident	74.5	Confident	33 Å²	33	74.4 Å²	74.4	34%	0.34	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.9	50.7	170.7	0	0	0	0	0	114.6	G897 S915	G897-G900 PolarHBondContact O-N 3.42Å; G900-S915 PolarHBondContact O-N 3.36Å; G900-S915 PolarHBondContact O-OG 2.99Å; G900-S915 VanDerWaalsContact O-OG 3.13Å
901	W	83.4	Confident	74.3	Confident	69 Å²	69	70.4 Å²	70.4	26%	0.261	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	141.7	173.6	-73.1	65.2	0	0	0	110.6	F873 E880 W912 F913 P914	F873-W901 HydrophobicContact CE1-CH2 4.49Å; F873-W901 HydrophobicContact CE1-CZ3 4.3Å; F873-W901 HydrophobicContact CE2-CH2 4.03Å; F873-W901 AromaticContact CZ-CH2 3.59Å; F873-W901 HydrophobicContact CZ-CH2 3.59Å; F873-W901 AromaticContact CZ-CZ3 3.82Å; F873-W901 HydrophobicContact CZ-CZ3 3.82Å; E880-W901 HydrophobicContact CG-CH2 4.28Å; E880-W901 HydrophobicContact CG-CZ3 3.9Å; E880-W901 VanDerWaalsContact OE1-CH2 3.28Å; E880-W901 WeakPolarHBondContact OE1-CH2 3.32Å; W901-W912 HydrophobicContact CB-CE3 4.49Å; W901-W912 HydrophobicContact CE3-CB 4.12Å; W901-F913 CarbonylContact C-O 3.55Å; W901-F913 WeakPolarHBondContact CA-O 3.46Å; W901-P914 HydrophobicContact CD2-CB 4.49Å; W901-P914 HydrophobicContact CD2-CG 4.27Å; W901-P914 HydrophobicContact CE3-CG 4.3Å; W901-P914 HydrophobicContact CH2-CG 3.94Å; W901-P914 HydrophobicContact CZ2-CG 3.86Å; W901-P914 HydrophobicContact CZ3-CG 4.13Å
902	W	88.3	Confident	74.3	Confident	44 Å²	44	73.7 Å²	73.7	17%	0.167	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	151.3	179.5	-68.3	-11.1	0	0	0	110.7	I891 K894 W912 F913 S915 V918 E920	I891-W902 HydrophobicContact CD1-CE3 3.51Å; I891-W902 HydrophobicContact CD1-CZ3 3.58Å; I891-W902 HydrophobicContact CG1-CE3 4.23Å; K894-W902 HydrophobicContact CD-CZ2 4.16Å; K894-W902 HydrophobicContact CG-CD2 4.16Å; K894-W902 HydrophobicContact CG-CG 4.24Å; K894-W902 HydrophobicContact CG-CZ2 4.49Å; W902-W912 WeakPolarHBondContact O-CA 3.37Å; W902-F913 HydrophobicContact CB-CE1 4.45Å; W902-F913 HydrophobicContact CB-CE2 4.06Å; W902-F913 HydrophobicContact CB-CZ 3.92Å; W902-F913 HydrophobicContact CE3-CE2 4.28Å; W902-F913 PolarHBondContact N-O 2.92Å; W902-F913 WeakPolarHBondContact O-CD1 3.45Å; W902-F913 PolarHBondContact O-N 3.42Å; W902-S915 VanDerWaalsContact CD2-CB 3.45Å; W902-V918 HydrophobicContact CE3-CG2 3.86Å; W902-V918 HydrophobicContact CZ3-CG2 3.66Å; W902-E920 HydrophobicContact CH2-CG 3.84Å; W902-E920 HydrophobicContact CZ3-CG 3.8Å
903	K	87.3	Confident	74.6	Confident	80 Å²	80	72 Å²	72	35%	0.348	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	131.5	172.9	-166.1	177.1	-176.2	177.6	0	109.6	Y892 S893 I910 G911 W912	Y892-K903 PolarHBondContact N-O 2.95Å; S893-K903 PolarHBondContact N-O 3.24Å; S893-K903 PolarHBondContact O-N 2.89Å; K903-I910 HydrophobicContact CG-CG2 4.43Å; K903-G911 WeakPolarHBondContact CA-O 3.47Å; K903-W912 HydrophobicContact CB-CD2 3.87Å; K903-W912 HydrophobicContact CB-CE3 3.71Å; K903-W912 HydrophobicContact CB-CH2 3.79Å; K903-W912 HydrophobicContact CB-CZ2 3.97Å; K903-W912 HydrophobicContact CB-CZ3 3.66Å; K903-W912 HydrophobicContact CD-CH2 4.5Å; K903-W912 HydrophobicContact CD-CZ2 3.94Å; K903-W912 HydrophobicContact CG-CD2 4.25Å; K903-W912 HydrophobicContact CG-CZ2 4.35Å
904	G	87.5	Confident	75	Confident	0 Å²	0	71 Å²	71	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	-168.9	178.3	0	0	0	0	0	113.3	K890 I910 G911	K890-G904 CarbonylContact O-C 3.39Å; K890-G904 WeakPolarHBondContact O-CA 3.49Å; G904-I910 VanDerWaalsContact O-CA 3.3Å; G904-I910 WeakPolarHBondContact O-CA 3.45Å; G904-G911 PolarHBondContact N-O 3.24Å; G904-G911 PolarHBondContact O-N 2.89Å
905	E	89.8	Confident	75.4	Confident	36 Å²	36	68.7 Å²	68.7	17%	0.168	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	128.6	-177	-176.3	-167.9	114.5	0	0	111.1	V889 K890 Y892 R909 I910	V889-E905 WeakPolarHBondContact CA-O 3.24Å; K890-E905 HydrophobicContact CB-CB 4.39Å; K890-E905 PolarHBondContact N-O 2.94Å; K890-E905 IonicContact NZ-OE1 3.08Å; K890-E905 PolarHBondContact NZ-OE1 2.8Å; K890-E905 PolarHBondContact O-N 2.88Å; Y892-E905 HydrophobicContact CD2-CB 4.36Å; Y892-E905 HydrophobicContact CE2-CB 3.63Å; Y892-E905 HydrophobicContact CE2-CG 4.49Å; Y892-E905 WeakPolarHBondContact CE2-OE2 3.42Å; Y892-E905 PolarHBondContact OH-OE2 2.66Å; E905-R909 VanDerWaalsContact CA-O 3.25Å; E905-R909 WeakPolarHBondContact CA-O 3.47Å; E905-I910 HydrophobicContact CB-CG1 4.09Å; E905-I910 HydrophobicContact CG-CG1 4.06Å
906	A	84.1	Confident	76.8	Confident	4 Å²	4	66.2 Å²	66.2	3%	0.033	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	143.5	169	0	0	0	0	0	108.8	L881 L883 V889 G908 R909	L881-A906 HydrophobicContact CD2-CB 4.09Å; L883-A906 HydrophobicContact CD2-CB 3.67Å; V889-A906 HydrophobicContact CG1-CB 4.46Å; V889-A906 HydrophobicContact CG2-CB 4.22Å; A906-G908 PolarHBondContact O-N 3.47Å; A906-R909 PolarHBondContact N-O 3.02Å; A906-R909 VanDerWaalsContact N-O 3.11Å; A906-R909 PolarHBondContact O-N 3.43Å
907	N	77.1	Confident	78.2	Confident	130 Å²	130	68 Å²	68	70%	0.695	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	49	34.8	176.5	-66	-55.5	0	0	0	114.8	D887 R909	D887-N907 PolarHBondContact OD1-ND2 3Å; D887-N907 PolarHBondContact OD2-ND2 3.35Å; D887-N907 VanDerWaalsContact OD2-ND2 3.15Å; N907-R909 VanDerWaalsContact C-N 3.33Å; N907-R909 PolarHBondContact O-N 2.92Å
908	G	70.3	Confident	80.2	Confident	68 Å²	68	66.8 Å²	66.8	70%	0.701	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.4	9.3	179.1	0	0	0	0	0	115.8	A906	A906-G908 PolarHBondContact O-N 3.47Å
909	R	74.7	Confident	82	Confident	190 Å²	190	62.1 Å²	62.1	72%	0.717	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.1	142.8	173.5	-67.9	-173	176.1	-155.9	-2	110.9	L881 E905 A906 N907	L881-R909 HydrophobicContact CD1-CB 3.8Å; E905-R909 VanDerWaalsContact CA-O 3.25Å; E905-R909 WeakPolarHBondContact CA-O 3.47Å; A906-R909 PolarHBondContact N-O 3.02Å; A906-R909 VanDerWaalsContact N-O 3.11Å; A906-R909 PolarHBondContact O-N 3.43Å; N907-R909 VanDerWaalsContact C-N 3.33Å; N907-R909 PolarHBondContact O-N 2.92Å
910	I	83.4	Confident	83.3	Confident	85 Å²	85	56.5 Å²	56.5	44%	0.436	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	133.1	177.6	-55.8	178.4	0	0	0	109.1	Y892 K903 G904 E905	Y892-I910 HydrophobicContact CD2-CD1 4.46Å; Y892-I910 HydrophobicContact CD2-CG2 4.24Å; Y892-I910 HydrophobicContact CE2-CD1 3.89Å; Y892-I910 HydrophobicContact CE2-CG1 4.16Å; K903-I910 HydrophobicContact CG-CG2 4.43Å; G904-I910 VanDerWaalsContact O-CA 3.3Å; G904-I910 WeakPolarHBondContact O-CA 3.45Å; E905-I910 HydrophobicContact CB-CG1 4.09Å; E905-I910 HydrophobicContact CG-CG1 4.06Å
911	G	84.3	Confident	83.1	Confident	4 Å²	4	62 Å²	62	4%	0.041	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.4	-172.4	176.3	0	0	0	0	0	113	R879 K903 G904	R879-G911 WeakPolarHBondContact O-CA 3.4Å; K903-G911 WeakPolarHBondContact CA-O 3.47Å; G904-G911 PolarHBondContact N-O 3.24Å; G904-G911 PolarHBondContact O-N 2.89Å
912	W	87.2	Confident	81.8	Confident	70 Å²	70	62.2 Å²	62.2	27%	0.265	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	138.8	180	-65.4	99	0	0	0	112.3	R879 E880 L881 G896 W901 W902 K903	R879-W912 PolarHBondContact O-N 2.74Å; E880-W912 CarbonylContact C-O 3.49Å; E880-W912 VanDerWaalsContact CA-O 3.23Å; E880-W912 WeakPolarHBondContact CA-O 3.28Å; L881-W912 PolarHBondContact N-O 3.12Å; G896-W912 VanDerWaalsContact O-CH2 3.25Å; G896-W912 WeakPolarHBondContact O-CH2 3.38Å; G896-W912 VanDerWaalsContact O-CZ3 3.22Å; G896-W912 WeakPolarHBondContact O-CZ3 3.27Å; W901-W912 HydrophobicContact CB-CE3 4.49Å; W901-W912 HydrophobicContact CE3-CB 4.12Å; W902-W912 WeakPolarHBondContact O-CA 3.37Å; K903-W912 HydrophobicContact CB-CD2 3.87Å; K903-W912 HydrophobicContact CB-CE3 3.71Å; K903-W912 HydrophobicContact CB-CH2 3.79Å; K903-W912 HydrophobicContact CB-CZ2 3.97Å; K903-W912 HydrophobicContact CB-CZ3 3.66Å; K903-W912 HydrophobicContact CD-CH2 4.5Å; K903-W912 HydrophobicContact CD-CZ2 3.94Å; K903-W912 HydrophobicContact CG-CD2 4.25Å; K903-W912 HydrophobicContact CG-CZ2 4.35Å
913	F	87.4	Confident	79.3	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	157.4	175.5	59.9	-89.9	0	0	0	110.8	F873 L881 L883 V889 I891 W901 W902 S915 V918	F873-F913 HydrophobicContact CD1-CB 4.45Å; L881-F913 HydrophobicContact CD2-CD1 4.11Å; L883-F913 HydrophobicContact CD1-CB 3.9Å; L883-F913 HydrophobicContact CD1-CD1 4.37Å; L883-F913 HydrophobicContact CD1-CD2 3.7Å; L883-F913 HydrophobicContact CD1-CE2 4.34Å; L883-F913 HydrophobicContact CD1-CG 3.72Å; L883-F913 HydrophobicContact CG-CB 4.35Å; L883-F913 HydrophobicContact CG-CG 4.47Å; V889-F913 HydrophobicContact CG1-CD1 4.43Å; V889-F913 HydrophobicContact CG1-CE1 3.58Å; V889-F913 HydrophobicContact CG1-CZ 3.69Å; I891-F913 HydrophobicContact CG1-CZ 4.33Å; W901-F913 CarbonylContact C-O 3.55Å; W901-F913 WeakPolarHBondContact CA-O 3.46Å; W902-F913 HydrophobicContact CB-CE1 4.45Å; W902-F913 HydrophobicContact CB-CE2 4.06Å; W902-F913 HydrophobicContact CB-CZ 3.92Å; W902-F913 HydrophobicContact CE3-CE2 4.28Å; W902-F913 PolarHBondContact N-O 2.92Å; W902-F913 WeakPolarHBondContact O-CD1 3.45Å; W902-F913 PolarHBondContact O-N 3.42Å; F913-S915 PolarHBondContact O-N 3.21Å; F913-V918 HydrophobicContact CD2-CG1 3.96Å; F913-V918 HydrophobicContact CE2-CB 4.39Å; F913-V918 HydrophobicContact CE2-CG1 3.57Å; F913-V918 HydrophobicContact CE2-CG2 3.79Å; F913-V918 HydrophobicContact CZ-CG1 4.4Å
914	P	87	Confident	76.6	Confident	13 Å²	13	75.5 Å²	75.5	8%	0.084	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	131.4	178.3	-14.6	28.3	0	0	0	110.9	F873 W901 T916 Y917	F873-P914 HydrophobicContact CD2-CG 3.86Å; F873-P914 HydrophobicContact CE2-CG 3.75Å; F873-P914 HydrophobicContact CG-CG 4.49Å; F873-P914 HydrophobicContact CZ-CG 4.3Å; W901-P914 HydrophobicContact CD2-CB 4.49Å; W901-P914 HydrophobicContact CD2-CG 4.27Å; W901-P914 HydrophobicContact CE3-CG 4.3Å; W901-P914 HydrophobicContact CH2-CG 3.94Å; W901-P914 HydrophobicContact CZ2-CG 3.86Å; W901-P914 HydrophobicContact CZ3-CG 4.13Å; P914-T916 PolarHBondContact O-N 3.06Å; P914-Y917 HydrophobicContact CB-CD2 3.79Å; P914-Y917 HydrophobicContact CB-CE2 4.3Å; P914-Y917 HydrophobicContact CB-CG 4.49Å; P914-Y917 HydrophobicContact CG-CD2 4.09Å; P914-Y917 HydrophobicContact CG-CE2 4.37Å; P914-Y917 PolarHBondContact O-N 3.41Å; P914-Y917 VanDerWaalsContact O-N 3.11Å
915	S	85.9	Confident	76	Confident	24 Å²	24	79.3 Å²	79.3	17%	0.168	43%	0.428	C	S	.	.	G	3₁₀ helix	trans	-64.7	-24.9	-176.4	64.8	0	0	0	0	113.3	G900 W902 F913 Y917 V918	G900-S915 PolarHBondContact O-N 3.36Å; G900-S915 PolarHBondContact O-OG 2.99Å; G900-S915 VanDerWaalsContact O-OG 3.13Å; W902-S915 VanDerWaalsContact CD2-CB 3.45Å; F913-S915 PolarHBondContact O-N 3.21Å; S915-Y917 PolarHBondContact O-N 3.1Å; S915-V918 PolarHBondContact O-N 3.38Å
916	T	84.4	Confident	75.3	Confident	108 Å²	108	81.5 Å²	81.5	66%	0.663	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-72.3	-2.3	176.8	53.4	0	0	0	0	114.4	P914	P914-T916 PolarHBondContact O-N 3.06Å
917	Y	82.9	Confident	74.8	Confident	82 Å²	82	85.8 Å²	85.8	32%	0.322	46%	0.464	S	S	.	.	G	3₁₀ helix	trans	-99.1	0.3	178.4	-80.1	-119.5	0	0	0	113	A869 R870 F873 P914 S915	A869-Y917 CarbonylContact C-O 3.55Å; A869-Y917 WeakPolarHBondContact CA-O 3.44Å; R870-Y917 PolarHBondContact N-O 3.47Å; F873-Y917 HydrophobicContact CB-CD1 3.73Å; F873-Y917 HydrophobicContact CB-CE1 4.11Å; F873-Y917 HydrophobicContact CB-CG 4.49Å; F873-Y917 HydrophobicContact CD2-CE1 4.36Å; P914-Y917 HydrophobicContact CB-CD2 3.79Å; P914-Y917 HydrophobicContact CB-CE2 4.3Å; P914-Y917 HydrophobicContact CB-CG 4.49Å; P914-Y917 HydrophobicContact CG-CD2 4.09Å; P914-Y917 HydrophobicContact CG-CE2 4.37Å; P914-Y917 PolarHBondContact O-N 3.41Å; P914-Y917 VanDerWaalsContact O-N 3.11Å; S915-Y917 PolarHBondContact O-N 3.1Å
918	V	87.8	Confident	74.7	Confident	8 Å²	8	83.2 Å²	83.2	5%	0.048	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	147.1	178.1	-49.4	0	0	0	0	111.7	A867 V868 A869 L883 V889 W902 F913 S915	A867-V918 HydrophobicContact CB-CB 3.81Å; A867-V918 HydrophobicContact CB-CG2 3.62Å; V868-V918 CarbonylContact O-C 3.57Å; V868-V918 VanDerWaalsContact O-CA 3.32Å; V868-V918 WeakPolarHBondContact O-CA 3.37Å; A869-V918 HydrophobicContact CB-CG1 4.29Å; L883-V918 HydrophobicContact CD1-CG1 3.71Å; V889-V918 HydrophobicContact CG2-CG1 4.22Å; W902-V918 HydrophobicContact CE3-CG2 3.86Å; W902-V918 HydrophobicContact CZ3-CG2 3.66Å; F913-V918 HydrophobicContact CD2-CG1 3.96Å; F913-V918 HydrophobicContact CE2-CB 4.39Å; F913-V918 HydrophobicContact CE2-CG1 3.57Å; F913-V918 HydrophobicContact CE2-CG2 3.79Å; F913-V918 HydrophobicContact CZ-CG1 4.4Å; S915-V918 PolarHBondContact O-N 3.38Å
919	D	84.9	Confident	74.9	Confident	79 Å²	79	84.2 Å²	84.2	42%	0.422	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	134.1	167	-83.7	-3.8	0	0	0	109.7	A867 V868 R870	A867-D919 CarbonylContact C-O 3Å; A867-D919 WeakPolarHBondContact CA-O 3.43Å; A867-D919 VanDerWaalsContact CB-O 3.27Å; A867-D919 WeakPolarHBondContact CB-O 3.25Å; V868-D919 PolarHBondContact N-O 3.15Å; V868-D919 PolarHBondContact O-N 2.92Å; R870-D919 HydrophobicContact CG-CB 4.28Å; R870-D919 IonicContact CZ-OD2 3.19Å; R870-D919 IonicContact NE-OD2 2.71Å; R870-D919 PolarHBondContact NE-OD2 2.97Å; R870-D919 IonicContact NH2-OD2 2.81Å; R870-D919 PolarHBondContact NH2-OD2 3.09Å
920	E	80.9	Confident	74.9	Confident	59 Å²	59	77.1 Å²	77.1	28%	0.276	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	134.3	176.3	-56.9	-157.8	91.2	0	0	112.3	S865 A867 I891 K894 W902 G922	S865-E920 WeakPolarHBondContact CB-OE1 3.41Å; S865-E920 PolarHBondContact OG-OE1 3.44Å; A867-E920 HydrophobicContact CB-CG 4.22Å; I891-E920 HydrophobicContact CD1-CG 4.31Å; I891-E920 WeakPolarHBondContact CD1-OE1 3.48Å; K894-E920 WeakPolarHBondContact CE-OE1 3.19Å; K894-E920 IonicContact NZ-OE1 3.3Å; K894-E920 PolarHBondContact NZ-OE1 2.93Å; K894-E920 IonicContact NZ-OE2 3.88Å; K894-E920 PolarHBondContact NZ-OE2 2.69Å; W902-E920 HydrophobicContact CH2-CG 3.84Å; W902-E920 HydrophobicContact CZ3-CG 3.8Å; E920-G922 PolarHBondContact O-N 3.03Å
921	E	66.7	Low	74.3	Confident	149 Å²	149	76.6 Å²	76.6	70%	0.696	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	87.9	172.2	-68.9	-166.3	133.3	0	0	110.1	T866 V868	T866-E921 PolarHBondContact O-N 2.62Å; T866-E921 VanDerWaalsContact O-N 3.14Å; V868-E921 HydrophobicContact CG2-CG 4.23Å
922	G	54.9	Low	73.6	Confident	73 Å²	73	82.2 Å²	82.2	75%	0.753	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	166.6	14.4	176	0	0	0	0	0	118.8	E920	E920-G922 PolarHBondContact O-N 3.03Å
923	V	37.2	Very low	72.4	Confident	134 Å²	134	83.2 Å²	83.2	81%	0.812	46%	0.458	S	S	*	.			trans	-118.6	108.4	178.5	-174.8	0	0	0	0	111.5
924	Q	29.2	Very low	71.1	Confident	269 Å²	269	90.7 Å²	90.7	100%	1.257	50%	0.5	S	S	*	.			trans	-139.1	0	159.4	-123	-174.2	12.6	0	0	108.7

Retrieved 924 of 924 residues in 755.3 ms (Link to these results)

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