A0A060X2B1_ONCMY Loading...

Dynein regulatory complex subunit 7

AlphaFold DB , UniProt , Accession A0A060X2B1, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene ccdc135, Length 853 aa.

						>A0A060X2B1_ONCMY|A0A060X2B1|ccdc135
MEVLPKVESDKEVAIDEAEEDRQDEVNEDLLKLEETLCNIQITPTPCSLPERAQEVDLSQYPTSYKENSPQEKLLLAIADNFCCQYVHLYPDRKPLLLSPLNECGVQKFVSTTLRPTLLSYPELYSWEGCASFVSEFLSLKPLDPPIDPPRHLYSPTWLMQTQRGSCFDFSTLLCSLLLGAGYNAYCVSGYAVKEMCLLNQSLQECPLLVTHVKGKATEQKRQVKKYSVKPPRDLRSGFEQRQEERRQADAQAILLKKQQEAERLQEERERLPPDPLLGLRVHCWVLILSGNREVPENFFINPLTGKSLSTTNKCFLGIESIWNHQNYWVNMQDCRFGCAEMNFDLGDAVKWEYLLYGTTGQSLLLIPDMKKQQEAEDDEEEEVDEPKVFEMPPSWVNQINISQQDMETRCPGGMKVIQYRKAKLEKFAPYLLPDGLVTRLTSYSDLDCTQPSTVKEWYQHRHDHLEERELKKTSNVTIEHFRPGRSYALKSHRYITMTPETERQMDFYSHARADGLARRVEMPFEMTETFEDRPDFMYHRHVVFGKRIKVFGPSNTEVPDQGQRPLQKVVERFNRDRSKPAGEDVAERIFLVSEDRIQVTYHREDDRIIPAWRNFIKPRDSGDSQNPHSFTPQMASTFQVDPFEKPSKNLFLYEMLVHMMKEEERVALRVKESEKEVRAILGVREQEESSIELHISIYNTARNERARCHREALERTAKEERLRQEEKELDFLAPLLAQLGDPENLTRQAALQLRNDCLADLKQRLIDKANLIQARFERETQELQQKQQWYQKNQLTMTKEDEDEYLAYCSDAMFRIHILKLRLSRHKDKAPQKYLALDERLRRDPRLANHLW
					

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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	33.7	Very low	38.3	Very low	239 Å²	239	158.7 Å²	158.7	100%	1.177	82%	0.821	S	S	*	*				0	132.3	0	-76.8	173.2	174.8	0	0	107.9
2	E	39.4	Very low	38.3	Very low	177 Å²	177	160.3 Å²	160.3	83%	0.827	82%	0.822	S	S	*	*			cis	178.3	141.5	-28.3	-128.3	-175.7	172.1	0	0	104.5
3	V	34.4	Very low	38.4	Very low	139 Å²	139	157.2 Å²	157.2	84%	0.842	82%	0.815	S	S	*	*			trans	77.9	120.9	161.7	-168	0	0	0	0	120
4	L	32.7	Very low	38.6	Very low	157 Å²	157	153.1 Å²	153.1	82%	0.822	82%	0.815	S	S	*	*			trans	-62.7	-168	170.8	-76	160	0	0	0	115.4
5	P	69.8	Low	38.6	Very low	106 Å²	106	151.3 Å²	151.3	69%	0.688	80%	0.804	S	S	*	*				-147.7	178.4	-51.8	42.1	-25	0	0	0	115.6
6	K	33.9	Very low	38.6	Very low	193 Å²	193	148.9 Å²	148.9	84%	0.839	79%	0.791	S	S	*	*			trans	166.1	119.8	134.5	-97.7	179.6	174	179.8	0	111.3
7	V	36.7	Very low	38.6	Very low	115 Å²	115	149 Å²	149	70%	0.697	79%	0.786	S	S	*	*				96.9	121.9	80.4	168.4	0	0	0	0	113.3
8	E	34.5	Very low	38.6	Very low	182 Å²	182	143.6 Å²	143.6	85%	0.85	77%	0.766	S	S	*	*			trans	28.6	152.1	146.7	-60.6	171.3	163.3	0	0	120.5
9	S	30.6	Very low	38.6	Very low	93 Å²	93	142.1 Å²	142.1	65%	0.65	75%	0.754	S	S	*	*			cis	-158.3	162.7	16.7	52.7	0	0	0	0	106
10	D	32.8	Very low	38.6	Very low	137 Å²	137	141.4 Å²	141.4	73%	0.733	75%	0.746	S	S	*	*				-170.7	143	60.2	-89.9	-52	0	0	0	110.6
11	K	43.3	Very low	38.6	Very low	208 Å²	208	140.1 Å²	140.1	90%	0.904	74%	0.74	S	S	*	*			trans	-91.7	101.1	163.9	-78.8	173.6	169.4	178.8	0	107.1
12	E	37.7	Very low	39	Very low	177 Å²	177	137.2 Å²	137.2	83%	0.827	72%	0.716	S	S	*	*			trans	-165.3	65.1	172.9	-118.9	176.5	-150.7	0	0	110.6
13	V	39.3	Very low	39.1	Very low	121 Å²	121	134.5 Å²	134.5	73%	0.733	70%	0.703	S	S	*	*	S	Bend	trans	-146.9	-13.4	169.6	-168.4	0	0	0	0	114
14	A	41.1	Very low	39.4	Very low	99 Å²	99	132.6 Å²	132.6	82%	0.818	69%	0.688	S	S	*	*	S	Bend	trans	-99.8	20.9	-168.7	0	0	0	0	0	115.8
15	I	39.4	Very low	39.8	Very low	126 Å²	126	131.8 Å²	131.8	65%	0.646	68%	0.68	S	S	*	*	S	Bend	trans	-117.3	-22.7	178.7	-60.9	178.4	0	0	0	112.3
16	D	38.3	Very low	38.5	Very low	113 Å²	113	130.7 Å²	130.7	60%	0.604	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.6	-33.2	-175.7	-70.1	-18.2	0	0	0	113.5	A18 E19 E20	D16-A18 VanDerWaalsContact C-N 3.26Å; D16-A18 PolarHBondContact O-N 3.43Å; D16-E19 PolarHBondContact O-N 2.94Å; D16-E20 PolarHBondContact O-N 3.21Å; D16-E20 VanDerWaalsContact O-N 3.12Å
17	E	38.2	Very low	39.1	Very low	151 Å²	151	125.8 Å²	125.8	71%	0.706	65%	0.654	S	S	*	*	H	α-helix	trans	-72	-15.6	-179	-68.9	-177.9	166.9	0	0	113.7
18	A	39.6	Very low	39.4	Very low	51 Å²	51	125.7 Å²	125.7	42%	0.421	65%	0.647	S	S	.	*	H	α-helix	trans	-100.8	-8.1	177.9	0	0	0	0	0	114	D16 R22	D16-A18 VanDerWaalsContact C-N 3.26Å; D16-A18 PolarHBondContact O-N 3.43Å; A18-R22 PolarHBondContact O-NE 3.06Å; A18-R22 VanDerWaalsContact O-NE 3.12Å
19	E	39	Very low	40	Very low	116 Å²	116	122 Å²	122	54%	0.542	63%	0.632	S	S	.	*	H	α-helix	trans	-94.3	-34.1	169	-77.4	-167.2	160.4	0	0	111.4	D16 R22 Q23	D16-E19 PolarHBondContact O-N 2.94Å; E19-R22 PolarHBondContact O-N 3.09Å; E19-Q23 WeakPolarHBondContact O-CB 3.39Å; E19-Q23 PolarHBondContact O-N 3.11Å; E19-Q23 PolarHBondContact O-OE1 2.93Å
20	E	38.7	Very low	40.6	Very low	127 Å²	127	121.4 Å²	121.4	59%	0.593	62%	0.622	S	S	*	*	H	α-helix	trans	-64.4	-46.5	173.2	-86.5	-175.8	153.6	0	0	112.4	D16 R22 Q23 D24	D16-E20 PolarHBondContact O-N 3.21Å; D16-E20 VanDerWaalsContact O-N 3.12Å; E20-R22 VanDerWaalsContact C-N 3.26Å; E20-R22 PolarHBondContact O-N 3.26Å; E20-Q23 PolarHBondContact O-N 3.19Å; E20-Q23 VanDerWaalsContact O-N 3.11Å; E20-D24 PolarHBondContact O-N 3.43Å
21	D	38.3	Very low	41.2	Very low	116 Å²	116	119.7 Å²	119.7	62%	0.62	61%	0.612	S	S	*	*	H	α-helix	trans	-64.5	-27.5	178.5	-82.8	-15.7	0	0	0	113.1	E25	D21-E25 PolarHBondContact O-N 3.24Å
22	R	42	Very low	41.4	Very low	178 Å²	178	114.5 Å²	114.5	67%	0.672	59%	0.59	S	S	*	*	H	α-helix	trans	-82.6	-28.8	174.4	-72.2	-173.3	-131.4	-130.4	-1.2	112.9	A18 E19 E20 V26	A18-R22 PolarHBondContact O-NE 3.06Å; A18-R22 VanDerWaalsContact O-NE 3.12Å; E19-R22 PolarHBondContact O-N 3.09Å; E20-R22 VanDerWaalsContact C-N 3.26Å; E20-R22 PolarHBondContact O-N 3.26Å; R22-V26 VanDerWaalsContact O-CB 3.28Å; R22-V26 WeakPolarHBondContact O-CB 3.36Å; R22-V26 WeakPolarHBondContact O-CG2 3.3Å; R22-V26 PolarHBondContact O-N 3.26Å; R22-V26 VanDerWaalsContact O-N 3.1Å
23	Q	40	Very low	41.7	Very low	120 Å²	120	110.8 Å²	110.8	56%	0.561	58%	0.575	S	S	*	*	H	α-helix	trans	-75.3	-30.6	174	-89.1	161.5	-23.3	0	0	111.7	E19 E20 N27	E19-Q23 WeakPolarHBondContact O-CB 3.39Å; E19-Q23 PolarHBondContact O-N 3.11Å; E19-Q23 PolarHBondContact O-OE1 2.93Å; E20-Q23 PolarHBondContact O-N 3.19Å; E20-Q23 VanDerWaalsContact O-N 3.11Å; Q23-N27 WeakPolarHBondContact O-CB 3.39Å; Q23-N27 PolarHBondContact O-N 2.88Å
24	D	42.1	Very low	42	Very low	99 Å²	99	110.4 Å²	110.4	53%	0.529	57%	0.565	S	S	.	*	H	α-helix	trans	-76.5	-37.1	174.3	-76	-18.9	0	0	0	112.7	E20 N27 E28	E20-D24 PolarHBondContact O-N 3.43Å; D24-N27 PolarHBondContact O-N 3Å; D24-E28 WeakPolarHBondContact O-CB 3.31Å; D24-E28 PolarHBondContact O-N 3.49Å
25	E	40.6	Very low	42.1	Very low	139 Å²	139	111.9 Å²	111.9	65%	0.65	56%	0.555	S	S	*	*	H	α-helix	trans	-67	-38.9	170.1	-81.1	-174	160.2	0	0	112.3	D21 E28 D29	D21-E25 PolarHBondContact O-N 3.24Å; E25-E28 PolarHBondContact O-N 3.02Å; E25-D29 WeakPolarHBondContact O-CB 3.4Å; E25-D29 PolarHBondContact O-N 3.11Å
26	V	42.9	Very low	42.3	Very low	84 Å²	84	109.5 Å²	109.5	51%	0.509	55%	0.546	S	S	.	.	H	α-helix	trans	-70.8	-34	176	170.6	0	0	0	0	111.6	R22 L30	R22-V26 VanDerWaalsContact O-CB 3.28Å; R22-V26 WeakPolarHBondContact O-CB 3.36Å; R22-V26 WeakPolarHBondContact O-CG2 3.3Å; R22-V26 PolarHBondContact O-N 3.26Å; R22-V26 VanDerWaalsContact O-N 3.1Å; V26-L30 HydrophobicContact CG1-CD1 3.9Å; V26-L30 VanDerWaalsContact O-CB 3.26Å; V26-L30 WeakPolarHBondContact O-CB 3.26Å; V26-L30 WeakPolarHBondContact O-CD1 3.45Å; V26-L30 PolarHBondContact O-N 3.47Å
27	N	46.9	Very low	42.4	Very low	89 Å²	89	108.9 Å²	108.9	48%	0.476	54%	0.543	S	S	.	.	H	α-helix	trans	-71.1	-38.8	172.2	-92.4	-22.2	0	0	0	112.2	Q23 D24 D29 L30 L31	Q23-N27 WeakPolarHBondContact O-CB 3.39Å; Q23-N27 PolarHBondContact O-N 2.88Å; D24-N27 PolarHBondContact O-N 3Å; N27-D29 VanDerWaalsContact C-N 3.34Å; N27-L30 PolarHBondContact O-N 3.48Å; N27-L31 VanDerWaalsContact O-CB 3.23Å; N27-L31 WeakPolarHBondContact O-CB 3.31Å; N27-L31 WeakPolarHBondContact O-CD1 3.23Å; N27-L31 WeakPolarHBondContact O-CG 3.34Å; N27-L31 PolarHBondContact O-N 3.39Å
28	E	42.9	Very low	42.5	Very low	114 Å²	114	106.5 Å²	106.5	53%	0.533	54%	0.542	S	S	.	.	H	α-helix	trans	-64.9	-39	172.6	-93.1	-146.9	176.7	0	0	111.8	D24 E25 L31 K32	D24-E28 WeakPolarHBondContact O-CB 3.31Å; D24-E28 PolarHBondContact O-N 3.49Å; E25-E28 PolarHBondContact O-N 3.02Å; E28-L31 PolarHBondContact O-N 3.3Å; E28-K32 VanDerWaalsContact O-CB 3.29Å; E28-K32 WeakPolarHBondContact O-CB 3.36Å; E28-K32 VanDerWaalsContact O-CG 3.25Å; E28-K32 WeakPolarHBondContact O-CG 3.28Å; E28-K32 PolarHBondContact O-N 3.21Å; E28-K32 IonicContact OE2-NZ 3.37Å; E28-K32 PolarHBondContact OE2-NZ 2.84Å
29	D	45.8	Very low	42.3	Very low	103 Å²	103	110.3 Å²	110.3	55%	0.551	56%	0.555	S	S	*	*	H	α-helix	trans	-72.1	-34.3	176.1	-79.3	-13.7	0	0	0	112	E25 N27 L33	E25-D29 WeakPolarHBondContact O-CB 3.4Å; E25-D29 PolarHBondContact O-N 3.11Å; N27-D29 VanDerWaalsContact C-N 3.34Å; D29-L33 WeakPolarHBondContact O-CB 3.22Å; D29-L33 PolarHBondContact O-N 3.31Å
30	L	44	Very low	42.1	Very low	81 Å²	81	109.5 Å²	109.5	42%	0.424	55%	0.553	S	S	.	*	H	α-helix	trans	-67.8	-38.7	170.3	-99	146.9	0	0	0	112.3	V26 N27 L33 E34	V26-L30 HydrophobicContact CG1-CD1 3.9Å; V26-L30 VanDerWaalsContact O-CB 3.26Å; V26-L30 WeakPolarHBondContact O-CB 3.26Å; V26-L30 WeakPolarHBondContact O-CD1 3.45Å; V26-L30 PolarHBondContact O-N 3.47Å; N27-L30 PolarHBondContact O-N 3.48Å; L30-L33 CarbonylContact O-C 3.53Å; L30-L33 PolarHBondContact O-N 2.82Å; L30-E34 WeakPolarHBondContact O-CB 3.49Å; L30-E34 WeakPolarHBondContact O-CG 3.5Å; L30-E34 PolarHBondContact O-N 3.36Å
31	L	46.2	Very low	41.4	Very low	102 Å²	102	110.7 Å²	110.7	53%	0.534	56%	0.559	S	S	.	*	H	α-helix	trans	-71.2	-37.4	175.4	-77.5	163.3	0	0	0	111.4	N27 E28 L33 E34 E35	N27-L31 VanDerWaalsContact O-CB 3.23Å; N27-L31 WeakPolarHBondContact O-CB 3.31Å; N27-L31 WeakPolarHBondContact O-CD1 3.23Å; N27-L31 WeakPolarHBondContact O-CG 3.34Å; N27-L31 PolarHBondContact O-N 3.39Å; E28-L31 PolarHBondContact O-N 3.3Å; L31-L33 VanDerWaalsContact C-N 3.34Å; L31-E34 PolarHBondContact O-N 2.84Å; L31-E35 WeakPolarHBondContact O-CB 3.31Å; L31-E35 PolarHBondContact O-N 3.2Å
32	K	47.3	Very low	41.1	Very low	99 Å²	99	112 Å²	112	43%	0.43	56%	0.564	S	S	.	*	H	α-helix	trans	-68.1	-33.7	169.7	-76.7	167.6	-169.8	143.8	0	111.4	E28 T36	E28-K32 VanDerWaalsContact O-CB 3.29Å; E28-K32 WeakPolarHBondContact O-CB 3.36Å; E28-K32 VanDerWaalsContact O-CG 3.25Å; E28-K32 WeakPolarHBondContact O-CG 3.28Å; E28-K32 PolarHBondContact O-N 3.21Å; E28-K32 IonicContact OE2-NZ 3.37Å; E28-K32 PolarHBondContact OE2-NZ 2.84Å; K32-T36 VanDerWaalsContact O-CB 3.27Å; K32-T36 WeakPolarHBondContact O-CB 3.43Å; K32-T36 VanDerWaalsContact O-CG2 3.25Å; K32-T36 WeakPolarHBondContact O-CG2 3.33Å; K32-T36 PolarHBondContact O-N 2.83Å; K32-T36 PolarHBondContact O-OG1 3.34Å
33	L	43.6	Very low	40.3	Very low	99 Å²	99	107.7 Å²	107.7	52%	0.518	56%	0.558	S	S	.	*	H	α-helix	trans	-69.5	-42	172.8	-156.6	82.3	0	0	0	110.9	D29 L30 L31 T36 L37	D29-L33 WeakPolarHBondContact O-CB 3.22Å; D29-L33 PolarHBondContact O-N 3.31Å; L30-L33 CarbonylContact O-C 3.53Å; L30-L33 PolarHBondContact O-N 2.82Å; L31-L33 VanDerWaalsContact C-N 3.34Å; L33-T36 VanDerWaalsContact CA-OG1 3.24Å; L33-T36 WeakPolarHBondContact CA-OG1 3.44Å; L33-T36 PolarHBondContact O-N 2.71Å; L33-T36 PolarHBondContact O-OG1 2.88Å; L33-L37 HydrophobicContact CD2-CD1 4.23Å; L33-L37 HydrophobicContact CG-CD1 4.04Å; L33-L37 WeakPolarHBondContact O-CB 3.49Å; L33-L37 WeakPolarHBondContact O-CD1 3.25Å; L33-L37 WeakPolarHBondContact O-CG 3.5Å; L33-L37 PolarHBondContact O-N 2.96Å
34	E	45.8	Very low	39.7	Very low	113 Å²	113	106.9 Å²	106.9	53%	0.528	56%	0.563	S	S	.	*	H	α-helix	trans	-69	-37.8	175.1	-79.9	-175.2	162.4	0	0	112.1	L30 L31 L37 C38	L30-E34 WeakPolarHBondContact O-CB 3.49Å; L30-E34 WeakPolarHBondContact O-CG 3.5Å; L30-E34 PolarHBondContact O-N 3.36Å; L31-E34 PolarHBondContact O-N 2.84Å; E34-L37 PolarHBondContact O-N 3.4Å; E34-C38 WeakPolarHBondContact O-CB 3.38Å; E34-C38 PolarHBondContact O-N 2.83Å; E34-C38 PolarHBondContact O-SG 3.32Å
35	E	42.4	Very low	38.8	Very low	129 Å²	129	107.9 Å²	107.9	60%	0.603	57%	0.573	S	S	*	*	H	α-helix	trans	-68.7	-39.4	171.7	-95.4	-170.2	149.7	0	0	111.7	L31 N39	L31-E35 WeakPolarHBondContact O-CB 3.31Å; L31-E35 PolarHBondContact O-N 3.2Å; E35-N39 WeakPolarHBondContact O-CB 3.39Å; E35-N39 PolarHBondContact O-N 3.33Å; E35-N39 PolarHBondContact O-ND2 3.38Å; E35-N39 VanDerWaalsContact O-ND2 3.09Å
36	T	44.3	Very low	38.3	Very low	76 Å²	76	105.6 Å²	105.6	47%	0.466	57%	0.57	S	S	.	*	H	α-helix	trans	-69.2	-36	173.9	47.8	0	0	0	0	111.4	K32 L33 I40	K32-T36 VanDerWaalsContact O-CB 3.27Å; K32-T36 WeakPolarHBondContact O-CB 3.43Å; K32-T36 VanDerWaalsContact O-CG2 3.25Å; K32-T36 WeakPolarHBondContact O-CG2 3.33Å; K32-T36 PolarHBondContact O-N 2.83Å; K32-T36 PolarHBondContact O-OG1 3.34Å; L33-T36 VanDerWaalsContact CA-OG1 3.24Å; L33-T36 WeakPolarHBondContact CA-OG1 3.44Å; L33-T36 PolarHBondContact O-N 2.71Å; L33-T36 PolarHBondContact O-OG1 2.88Å; T36-I40 WeakPolarHBondContact O-CD1 3.37Å; T36-I40 WeakPolarHBondContact O-CG1 3.34Å; T36-I40 PolarHBondContact O-N 2.86Å
37	L	40.7	Very low	37.7	Very low	101 Å²	101	106.2 Å²	106.2	53%	0.529	58%	0.577	S	S	.	*	H	α-helix	trans	-71.7	-34.2	173.6	-71.8	165.8	0	0	0	113.1	L33 E34 I40	L33-L37 HydrophobicContact CD2-CD1 4.23Å; L33-L37 HydrophobicContact CG-CD1 4.04Å; L33-L37 WeakPolarHBondContact O-CB 3.49Å; L33-L37 WeakPolarHBondContact O-CD1 3.25Å; L33-L37 WeakPolarHBondContact O-CG 3.5Å; L33-L37 PolarHBondContact O-N 2.96Å; E34-L37 PolarHBondContact O-N 3.4Å; L37-I40 HydrophobicContact CD2-CD1 4.29Å
38	C	38.8	Very low	36.9	Very low	101 Å²	101	106.1 Å²	106.1	68%	0.682	58%	0.583	S	S	*	*	H	α-helix	trans	-75.8	-29.8	173.9	-71.6	0	0	0	0	112.5	E34	E34-C38 WeakPolarHBondContact O-CB 3.38Å; E34-C38 PolarHBondContact O-N 2.83Å; E34-C38 PolarHBondContact O-SG 3.32Å
39	N	36.6	Very low	36.4	Very low	131 Å²	131	105.6 Å²	105.6	70%	0.701	58%	0.584	S	S	*	*	H	α-helix	trans	-83.1	-15.8	172.3	-72.8	-33.2	0	0	0	113	E35 Q41	E35-N39 WeakPolarHBondContact O-CB 3.39Å; E35-N39 PolarHBondContact O-N 3.33Å; E35-N39 PolarHBondContact O-ND2 3.38Å; E35-N39 VanDerWaalsContact O-ND2 3.09Å; N39-Q41 PolarHBondContact O-N 3.38Å
40	I	33.7	Very low	35.7	Very low	99 Å²	99	105.4 Å²	105.4	51%	0.508	59%	0.588	S	S	.	*			trans	-71.6	79.6	159.8	-66.3	156.9	0	0	0	106.8	T36 L37 I42	T36-I40 WeakPolarHBondContact O-CD1 3.37Å; T36-I40 WeakPolarHBondContact O-CG1 3.34Å; T36-I40 PolarHBondContact O-N 2.86Å; L37-I40 HydrophobicContact CD2-CD1 4.29Å; I40-I42 HydrophobicContact CG2-CG1 3.96Å; I40-I42 PolarHBondContact O-N 2.98Å
41	Q	25.7	Very low	35.5	Very low	151 Å²	151	108.3 Å²	108.3	71%	0.706	60%	0.599	S	S	*	*			trans	-61.8	98.7	153	-75.5	-176.5	-7.8	0	0	106.2	N39 T43	N39-Q41 PolarHBondContact O-N 3.38Å; Q41-T43 PolarHBondContact O-N 3.01Å; Q41-T43 PolarHBondContact O-OG1 2.87Å
42	I	31.9	Very low	35.2	Very low	145 Å²	145	113.2 Å²	113.2	74%	0.744	61%	0.611	S	S	*	*			trans	-66.3	70.9	143.3	-47.1	176.3	0	0	0	104.6	I40 P44	I40-I42 HydrophobicContact CG2-CG1 3.96Å; I40-I42 PolarHBondContact O-N 2.98Å; I42-P44 WeakPolarHBondContact O-CD 3.48Å; I42-P44 VanDerWaalsContact O-N 3.13Å
43	T	24	Very low	35	Very low	86 Å²	86	112.3 Å²	112.3	53%	0.528	62%	0.622	S	S	.	*			trans	-45.7	123.4	138.9	29.1	0	0	0	0	103	Q41 T45	Q41-T43 PolarHBondContact O-N 3.01Å; Q41-T43 PolarHBondContact O-OG1 2.87Å; T43-T45 PolarHBondContact O-N 3.41Å
44	P	27.1	Very low	35.5	Very low	104 Å²	104	113.5 Å²	113.5	68%	0.675	63%	0.625	S	S	*	*			trans	-52.2	106.8	160.7	23.1	-27.2	0	0	0	101.5	I42 P46	I42-P44 WeakPolarHBondContact O-CD 3.48Å; I42-P44 VanDerWaalsContact O-N 3.13Å; P44-P46 WeakPolarHBondContact O-CD 3.31Å
45	T	24.7	Very low	36.1	Very low	120 Å²	120	117.2 Å²	117.2	74%	0.736	64%	0.642	S	S	*	*			trans	-52.5	112.3	158.3	-35.3	0	0	0	0	98.5	T43 C47	T43-T45 PolarHBondContact O-N 3.41Å; T45-C47 VanDerWaalsContact C-N 3.29Å; T45-C47 PolarHBondContact O-N 3.41Å
46	P	29.7	Very low	37.7	Very low	90 Å²	90	112.5 Å²	112.5	58%	0.584	62%	0.622	S	S	*	*			trans	-50.4	124.7	158.4	-10.9	27.3	0	0	0	99.7	P44 S48	P44-P46 WeakPolarHBondContact O-CD 3.31Å; P46-S48 PolarHBondContact O-N 2.86Å
47	C	29.1	Very low	39.4	Very low	97 Å²	97	112.6 Å²	112.6	66%	0.655	62%	0.62	S	S	*	*			trans	-64.5	69.7	149.4	-135.9	0	0	0	0	103.5	T45 L49	T45-C47 VanDerWaalsContact C-N 3.29Å; T45-C47 PolarHBondContact O-N 3.41Å; C47-L49 PolarHBondContact O-N 2.99Å
48	S	31.4	Very low	41.4	Very low	87 Å²	87	111 Å²	111	61%	0.608	61%	0.611	S	S	*	*			trans	-67.9	64.1	145.8	58.6	0	0	0	0	103.5	P46	P46-S48 PolarHBondContact O-N 2.86Å
49	L	32.8	Very low	43.4	Very low	104 Å²	104	110 Å²	110	55%	0.545	61%	0.606	S	S	.	*				-39.5	120.2	126	-68.6	172.7	0	0	0	103.5	C47 E51	C47-L49 PolarHBondContact O-N 2.99Å; L49-E51 PolarHBondContact O-N 3.2Å
50	P	30.1	Very low	45.7	Very low	98 Å²	98	111.2 Å²	111.2	64%	0.636	61%	0.607	S	S	*	*			trans	-45.8	123.3	-178.6	17.8	-29.5	0	0	0	105.7	R52	P50-R52 PolarHBondContact O-N 2.91Å
51	E	40.2	Very low	48.2	Very low	143 Å²	143	107.2 Å²	107.2	67%	0.668	59%	0.586	S	S	*	*			trans	-57.9	87.4	160.4	-75.8	-161.8	152.9	0	0	103.4	L49 A53 R164	L49-E51 PolarHBondContact O-N 3.2Å; E51-A53 PolarHBondContact O-N 3.24Å; E51-R164 IonicContact OE1-CZ 3.71Å; E51-R164 IonicContact OE1-NH1 2.91Å; E51-R164 IonicContact OE1-NH2 3.59Å; E51-R164 PolarHBondContact OE1-NH2 3.39Å; E51-R164 IonicContact OE2-CZ 2.85Å; E51-R164 IonicContact OE2-NH1 3.65Å; E51-R164 PolarHBondContact OE2-NH1 2.99Å; E51-R164 IonicContact OE2-NH2 3.24Å; E51-R164 PolarHBondContact OE2-NH2 3.46Å
52	R	38.7	Very low	51.4	Low	205 Å²	205	102.3 Å²	102.3	77%	0.774	57%	0.566	S	S	*	*			trans	-66.8	86.2	164.1	-91.9	-177.6	169.5	177.1	-2.9	101.9	P50 Q54	P50-R52 PolarHBondContact O-N 2.91Å; R52-Q54 HydrophobicContact CB-CG 4.33Å; R52-Q54 PolarHBondContact O-N 3.18Å
53	A	43.2	Very low	54.3	Low	80 Å²	80	100.3 Å²	100.3	66%	0.661	56%	0.561	S	S	*	*			trans	-54.7	88.6	144.7	0	0	0	0	0	103.8	E51 E55	E51-A53 PolarHBondContact O-N 3.24Å; A53-E55 VanDerWaalsContact C-N 3.29Å; A53-E55 PolarHBondContact O-N 3.45Å
54	Q	53.8	Low	57.6	Low	124 Å²	124	98 Å²	98	58%	0.579	55%	0.549	S	S	*	.			trans	-61.4	106.6	166.8	-73.1	-176	3.2	0	0	103.4	R52 V56	R52-Q54 HydrophobicContact CB-CG 4.33Å; R52-Q54 PolarHBondContact O-N 3.18Å; Q54-V56 VanDerWaalsContact C-N 3.31Å; Q54-V56 PolarHBondContact O-N 2.87Å
55	E	59.7	Low	60.8	Low	191 Å²	191	93 Å²	93	89%	0.893	52%	0.517	S	S	*	.			trans	-59.2	105.5	167.7	-75.8	-175.8	166.1	0	0	105.9	A53 D57	A53-E55 VanDerWaalsContact C-N 3.29Å; A53-E55 PolarHBondContact O-N 3.45Å; E55-D57 PolarHBondContact O-N 3.02Å
56	V	75.4	Confident	64.2	Low	29 Å²	29	91.4 Å²	91.4	18%	0.176	50%	0.499	C	S	.	.			trans	-68.2	119.9	178.9	172.6	0	0	0	0	107	Q54 L58 Y61 Q161 T162	Q54-V56 VanDerWaalsContact C-N 3.31Å; Q54-V56 PolarHBondContact O-N 2.87Å; V56-L58 HydrophobicContact CG1-CD2 4.16Å; V56-L58 PolarHBondContact O-N 2.87Å; V56-Y61 HydrophobicContact CG1-CE2 3.6Å; V56-Q161 HydrophobicContact CG2-CB 4.3Å; V56-T162 HydrophobicContact CG2-CG2 3.55Å
57	D	80.5	Confident	67.3	Low	79 Å²	79	93.3 Å²	93.3	42%	0.422	50%	0.5	S	S	.	.			trans	-71.6	93.3	175.5	-178	7.8	0	0	0	110.2	E55 S59 Q60	E55-D57 PolarHBondContact O-N 3.02Å; D57-S59 PolarHBondContact O-N 3.29Å; D57-S59 VanDerWaalsContact O-N 3.14Å; D57-S59 WeakPolarHBondContact OD1-CB 3.37Å; D57-S59 PolarHBondContact OD1-N 3.49Å; D57-S59 PolarHBondContact OD1-OG 3.26Å; D57-S59 PolarHBondContact OD2-OG 2.97Å; D57-S59 VanDerWaalsContact OD2-OG 3.12Å; D57-Q60 HydrophobicContact CB-CG 4.43Å; D57-Q60 PolarHBondContact O-N 3.46Å; D57-Q60 WeakPolarHBondContact OD2-CG 3.26Å; D57-Q60 PolarHBondContact OD2-NE2 2.9Å
58	L	82.9	Confident	70.5	Confident	66 Å²	66	90.2 Å²	90.2	35%	0.346	48%	0.477	S	S	.	.	G	3₁₀ helix	trans	-63.6	-15.5	179	-61.1	176.3	0	0	0	112.7	V56 Q60 Y61 K66 E103	V56-L58 HydrophobicContact CG1-CD2 4.16Å; V56-L58 PolarHBondContact O-N 2.87Å; L58-Q60 PolarHBondContact O-N 3.35Å; L58-Y61 HydrophobicContact CD2-CD2 4.33Å; L58-Y61 HydrophobicContact CD2-CE2 4.15Å; L58-Y61 PolarHBondContact O-N 3.48Å; L58-K66 WeakPolarHBondContact O-CE 3.46Å; L58-K66 PolarHBondContact O-NZ 2.97Å; L58-E103 HydrophobicContact CD2-CB 4.23Å; L58-E103 HydrophobicContact CD2-CG 4.17Å
59	S	80.7	Confident	73.5	Confident	82 Å²	82	88.3 Å²	88.3	57%	0.573	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-66.1	-29.6	179.1	77.6	0	0	0	0	112.2	D57 Y61 K66	D57-S59 PolarHBondContact O-N 3.29Å; D57-S59 VanDerWaalsContact O-N 3.14Å; D57-S59 WeakPolarHBondContact OD1-CB 3.37Å; D57-S59 PolarHBondContact OD1-N 3.49Å; D57-S59 PolarHBondContact OD1-OG 3.26Å; D57-S59 PolarHBondContact OD2-OG 2.97Å; D57-S59 VanDerWaalsContact OD2-OG 3.12Å; S59-Y61 VanDerWaalsContact C-N 3.27Å; S59-Y61 PolarHBondContact O-N 3.38Å; S59-K66 PolarHBondContact O-NZ 3.19Å
60	Q	84.6	Confident	76.4	Confident	155 Å²	155	88.8 Å²	88.8	72%	0.724	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-76.3	-11.9	-178	-61.7	178.2	26.6	0	0	113.7	D57 L58	D57-Q60 HydrophobicContact CB-CG 4.43Å; D57-Q60 PolarHBondContact O-N 3.46Å; D57-Q60 WeakPolarHBondContact OD2-CG 3.26Å; D57-Q60 PolarHBondContact OD2-NE2 2.9Å; L58-Q60 PolarHBondContact O-N 3.35Å
61	Y	86.6	Confident	79.4	Confident	16 Å²	16	87.8 Å²	87.8	6%	0.063	46%	0.46	C	S	.	.	S	Bend	trans	-71.6	143	-179	-78.2	-102	0	0	0	112.1	V56 L58 S59 Y65 K66 T157 Q161	V56-Y61 HydrophobicContact CG1-CE2 3.6Å; L58-Y61 HydrophobicContact CD2-CD2 4.33Å; L58-Y61 HydrophobicContact CD2-CE2 4.15Å; L58-Y61 PolarHBondContact O-N 3.48Å; S59-Y61 VanDerWaalsContact C-N 3.27Å; S59-Y61 PolarHBondContact O-N 3.38Å; Y61-Y65 AromaticContact CD1-CD1 3.33Å; Y61-Y65 HydrophobicContact CD1-CD1 3.33Å; Y61-Y65 HydrophobicContact CD1-CD2 4.21Å; Y61-Y65 AromaticContact CD1-CE1 3.41Å; Y61-Y65 HydrophobicContact CD1-CE1 3.41Å; Y61-Y65 VanDerWaalsContact CD1-CE1 3.41Å; Y61-Y65 HydrophobicContact CD1-CE2 4.28Å; Y61-Y65 AromaticContact CD1-CG 3.78Å; Y61-Y65 HydrophobicContact CD1-CG 3.78Å; Y61-Y65 AromaticContact CD1-CZ 3.91Å; Y61-Y65 AromaticContact CE1-CD1 3.9Å; Y61-Y65 HydrophobicContact CE1-CD1 3.9Å; Y61-Y65 AromaticContact CE1-CE1 3.62Å; Y61-Y65 HydrophobicContact CE1-CE1 3.62Å; Y61-Y65 HydrophobicContact CG-CD1 4.25Å; Y61-Y65 HydrophobicContact CG-CG 4.42Å; Y61-K66 WeakPolarHBondContact O-CE 3.29Å; Y61-K66 PolarHBondContact O-NZ 2.88Å; Y61-T157 HydrophobicContact CE1-CG2 4.15Å; Y61-Q161 PolarHBondContact OH-OE1 3.26Å
62	P	91.9	Very high	82	Confident	47 Å²	47	81.7 Å²	81.7	31%	0.305	43%	0.431	S	S	.	.			trans	-58.8	162.8	177	-17.6	26.8	0	0	0	112.9	S64 Y65 N398	P62-S64 PolarHBondContact O-N 2.88Å; P62-Y65 HydrophobicContact CB-CD2 4.32Å; P62-Y65 HydrophobicContact CG-CD2 4.14Å; P62-Y65 HydrophobicContact CG-CE2 4.14Å; P62-Y65 PolarHBondContact O-N 2.98Å; P62-Y65 VanDerWaalsContact O-N 3.12Å; P62-N398 WeakPolarHBondContact CG-ND2 3.23Å
63	T	92.6	Very high	84.7	Confident	103 Å²	103	78.3 Å²	78.3	63%	0.632	42%	0.422	S	S	*	.	H	α-helix	trans	-59.9	-27	176.6	51.1	0	0	0	0	113.1	Y65 K66 E67	T63-Y65 PolarHBondContact O-N 3.21Å; T63-Y65 VanDerWaalsContact O-N 3.13Å; T63-K66 PolarHBondContact O-N 3.15Å; T63-E67 PolarHBondContact O-N 3.28Å
64	S	93.9	Very high	87.1	Confident	38 Å²	38	78.9 Å²	78.9	27%	0.266	41%	0.414	S	S	.	.	H	α-helix	trans	-58.3	-25.8	176.1	60.5	0	0	0	0	113.8	P62 K108 W396	P62-S64 PolarHBondContact O-N 2.88Å; S64-K108 WeakPolarHBondContact O-CE 3.41Å; S64-K108 PolarHBondContact O-NZ 2.9Å; S64-W396 PolarHBondContact OG-O 3.45Å
65	Y	95.1	Very high	89.1	Confident	0 Å²	0	73 Å²	73	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-82.9	-27.1	176.8	-72.1	-113.9	0	0	0	112.2	Y61 P62 T63 N102 E103 C104 V106 T157 W396 V397 N398	Y61-Y65 AromaticContact CD1-CD1 3.33Å; Y61-Y65 HydrophobicContact CD1-CD1 3.33Å; Y61-Y65 HydrophobicContact CD1-CD2 4.21Å; Y61-Y65 AromaticContact CD1-CE1 3.41Å; Y61-Y65 HydrophobicContact CD1-CE1 3.41Å; Y61-Y65 VanDerWaalsContact CD1-CE1 3.41Å; Y61-Y65 HydrophobicContact CD1-CE2 4.28Å; Y61-Y65 AromaticContact CD1-CG 3.78Å; Y61-Y65 HydrophobicContact CD1-CG 3.78Å; Y61-Y65 AromaticContact CD1-CZ 3.91Å; Y61-Y65 AromaticContact CE1-CD1 3.9Å; Y61-Y65 HydrophobicContact CE1-CD1 3.9Å; Y61-Y65 AromaticContact CE1-CE1 3.62Å; Y61-Y65 HydrophobicContact CE1-CE1 3.62Å; Y61-Y65 HydrophobicContact CG-CD1 4.25Å; Y61-Y65 HydrophobicContact CG-CG 4.42Å; P62-Y65 HydrophobicContact CB-CD2 4.32Å; P62-Y65 HydrophobicContact CG-CD2 4.14Å; P62-Y65 HydrophobicContact CG-CE2 4.14Å; P62-Y65 PolarHBondContact O-N 2.98Å; P62-Y65 VanDerWaalsContact O-N 3.12Å; T63-Y65 PolarHBondContact O-N 3.21Å; T63-Y65 VanDerWaalsContact O-N 3.13Å; Y65-N102 PolarHBondContact O-ND2 3.06Å; Y65-E103 WeakPolarHBondContact CD1-OE1 3.45Å; Y65-E103 WeakPolarHBondContact CE1-OE1 3.42Å; Y65-C104 WeakPolarHBondContact O-CB 3.26Å; Y65-V106 WeakPolarHBondContact O-CG2 3.5Å; Y65-T157 PolarHBondContact OH-OG1 2.94Å; Y65-W396 AromaticContact CD1-CE3 3.77Å; Y65-W396 HydrophobicContact CD1-CE3 3.77Å; Y65-W396 AromaticContact CD1-CZ3 3.33Å; Y65-W396 HydrophobicContact CD1-CZ3 3.33Å; Y65-W396 HydrophobicContact CD2-CE3 4.19Å; Y65-W396 AromaticContact CE1-CE3 3.89Å; Y65-W396 HydrophobicContact CE1-CE3 3.89Å; Y65-W396 AromaticContact CE1-CZ3 3.45Å; Y65-W396 HydrophobicContact CE1-CZ3 3.45Å; Y65-W396 VanDerWaalsContact CE1-CZ3 3.45Å; Y65-W396 HydrophobicContact CE2-CE3 4.3Å; Y65-W396 WeakPolarHBondContact CE2-O 3.43Å; Y65-W396 AromaticContact CG-CE3 3.9Å; Y65-W396 HydrophobicContact CG-CE3 3.9Å; Y65-W396 AromaticContact CG-CZ3 3.93Å; Y65-W396 HydrophobicContact CG-CZ3 3.93Å; Y65-V397 WeakPolarHBondContact OH-CA 3.4Å; Y65-V397 WeakPolarHBondContact OH-CG1 3.4Å; Y65-N398 PolarHBondContact OH-N 2.86Å
66	K	94.7	Very high	90.8	Very high	85 Å²	85	64.6 Å²	64.6	37%	0.37	35%	0.348	S	S	.	.	H	α-helix	trans	-101.3	-17.8	-170.5	-62.1	174.4	-176.3	160.1	0	112.9	L58 S59 Y61 T63 C104 V106	L58-K66 WeakPolarHBondContact O-CE 3.46Å; L58-K66 PolarHBondContact O-NZ 2.97Å; S59-K66 PolarHBondContact O-NZ 3.19Å; Y61-K66 WeakPolarHBondContact O-CE 3.29Å; Y61-K66 PolarHBondContact O-NZ 2.88Å; T63-K66 PolarHBondContact O-N 3.15Å; K66-C104 HydrophobicContact CG-CB 4.39Å; K66-V106 VanDerWaalsContact O-CG2 3.24Å; K66-V106 WeakPolarHBondContact O-CG2 3.46Å
67	E	94.9	Very high	91.7	Very high	131 Å²	131	65.8 Å²	65.8	61%	0.612	36%	0.36	S	S	*	.	S	Bend	trans	-139.1	156.7	-176	-62.1	179.6	-170.5	0	0	111.4	T63 K108	T63-E67 PolarHBondContact O-N 3.28Å; E67-K108 PolarHBondContact O-NZ 3.36Å
68	N	95.8	Very high	92.3	Very high	32 Å²	32	64.5 Å²	64.5	17%	0.171	35%	0.353	C	S	.	.			trans	-101.8	128.6	172.9	-70.2	-30.9	0	0	0	110.1	E72 K73 L76 Q107 K108	N68-E72 HydrophobicContact CB-CB 4.13Å; N68-K73 HydrophobicContact CB-CG 3.82Å; N68-K73 VanDerWaalsContact O-CE 3.24Å; N68-K73 WeakPolarHBondContact O-CE 3.38Å; N68-L76 WeakPolarHBondContact ND2-CD1 3.33Å; N68-Q107 PolarHBondContact ND2-O 3.01Å; N68-Q107 VanDerWaalsContact ND2-O 3.12Å; N68-Q107 PolarHBondContact OD1-O 2.88Å; N68-K108 WeakPolarHBondContact OD1-CD 3.43Å; N68-K108 WeakPolarHBondContact OD1-CE 3.38Å; N68-K108 PolarHBondContact OD1-NZ 2.82Å
69	S	94.7	Very high	92.8	Very high	46 Å²	46	61.4 Å²	61.4	32%	0.322	34%	0.337	S	S	.	.			trans	-62.2	162	168.7	65.9	0	0	0	0	111.5	Q71 E72 K73	S69-Q71 PolarHBondContact O-N 3.38Å; S69-E72 VanDerWaalsContact CB-OE2 3.3Å; S69-E72 WeakPolarHBondContact CB-OE2 3.3Å; S69-E72 PolarHBondContact N-OE2 2.79Å; S69-E72 PolarHBondContact O-N 3.17Å; S69-E72 WeakPolarHBondContact OG-CB 3.46Å; S69-E72 VanDerWaalsContact OG-CG 3.25Å; S69-E72 WeakPolarHBondContact OG-CG 3.19Å; S69-E72 PolarHBondContact OG-N 2.85Å; S69-E72 PolarHBondContact OG-OE2 3.48Å; S69-K73 WeakPolarHBondContact O-CG 3.3Å; S69-K73 PolarHBondContact O-N 2.76Å
70	P	94.2	Very high	93.5	Very high	114 Å²	114	61.1 Å²	61.1	74%	0.74	33%	0.329	S	S	*	.	H	α-helix	trans	-56.2	-37.9	177.1	-25.8	35.1	0	0	0	113.3	K73 L74	P70-K73 PolarHBondContact O-N 3.36Å; P70-L74 PolarHBondContact O-N 2.82Å; P70-L74 VanDerWaalsContact O-N 3.11Å
71	Q	92.7	Very high	93.9	Very high	77 Å²	77	58.2 Å²	58.2	36%	0.36	32%	0.318	S	S	.	.	H	α-helix	trans	-70.4	-41.4	178.4	-158.1	-173.1	-11.1	0	0	111.6	S69 K73 L74 L75 F390 E391 P393	S69-Q71 PolarHBondContact O-N 3.38Å; Q71-K73 VanDerWaalsContact C-N 3.35Å; Q71-K73 PolarHBondContact O-N 2.93Å; Q71-L74 PolarHBondContact O-N 3.47Å; Q71-L75 PolarHBondContact O-N 2.87Å; Q71-F390 HydrophobicContact CG-CE2 3.92Å; Q71-F390 HydrophobicContact CG-CZ 3.92Å; Q71-E391 PolarHBondContact NE2-O 3.48Å; Q71-P393 HydrophobicContact CB-CG 4.3Å; Q71-P393 HydrophobicContact CG-CB 4.42Å; Q71-P393 HydrophobicContact CG-CG 3.89Å
72	E	94.9	Very high	94.3	Very high	15 Å²	15	58.4 Å²	58.4	7%	0.07	32%	0.32	C	S	.	.	H	α-helix	trans	-63.2	-39.8	173.5	-73.9	167.3	123.1	0	0	111.6	N68 S69 L74 L75 L76 K108 P393	N68-E72 HydrophobicContact CB-CB 4.13Å; S69-E72 VanDerWaalsContact CB-OE2 3.3Å; S69-E72 WeakPolarHBondContact CB-OE2 3.3Å; S69-E72 PolarHBondContact N-OE2 2.79Å; S69-E72 PolarHBondContact O-N 3.17Å; S69-E72 WeakPolarHBondContact OG-CB 3.46Å; S69-E72 VanDerWaalsContact OG-CG 3.25Å; S69-E72 WeakPolarHBondContact OG-CG 3.19Å; S69-E72 PolarHBondContact OG-N 2.85Å; S69-E72 PolarHBondContact OG-OE2 3.48Å; E72-L74 VanDerWaalsContact C-N 3.32Å; E72-L74 PolarHBondContact O-N 3.38Å; E72-L75 PolarHBondContact O-N 2.96Å; E72-L76 WeakPolarHBondContact O-CB 3.35Å; E72-L76 VanDerWaalsContact O-CG 3.25Å; E72-L76 WeakPolarHBondContact O-CG 3.34Å; E72-L76 PolarHBondContact O-N 3.37Å; E72-K108 IonicContact OE1-NZ 3.52Å; E72-K108 PolarHBondContact OE1-NZ 2.98Å; E72-K108 IonicContact OE2-NZ 2.78Å; E72-P393 HydrophobicContact CG-CB 4.21Å; E72-P393 HydrophobicContact CG-CG 4.37Å
73	K	95.9	Very high	94.3	Very high	134 Å²	134	57.6 Å²	57.6	58%	0.583	32%	0.315	S	S	*	.	H	α-helix	trans	-61.1	-41.2	175.4	-72	176.7	-178.6	173.7	0	111.9	N68 S69 P70 Q71 L76 A77	N68-K73 HydrophobicContact CB-CG 3.82Å; N68-K73 VanDerWaalsContact O-CE 3.24Å; N68-K73 WeakPolarHBondContact O-CE 3.38Å; S69-K73 WeakPolarHBondContact O-CG 3.3Å; S69-K73 PolarHBondContact O-N 2.76Å; P70-K73 PolarHBondContact O-N 3.36Å; Q71-K73 VanDerWaalsContact C-N 3.35Å; Q71-K73 PolarHBondContact O-N 2.93Å; K73-L76 PolarHBondContact O-N 2.94Å; K73-A77 PolarHBondContact O-N 2.83Å; K73-A77 VanDerWaalsContact O-N 3.08Å
74	L	94.2	Very high	94.2	Very high	93 Å²	93	57 Å²	57	49%	0.487	31%	0.313	S	S	.	.	H	α-helix	trans	-65.7	-44.3	175.3	-179.3	55.2	0	0	0	111.4	P70 Q71 E72 L76 A77 I78 F390	P70-L74 PolarHBondContact O-N 2.82Å; P70-L74 VanDerWaalsContact O-N 3.11Å; Q71-L74 PolarHBondContact O-N 3.47Å; E72-L74 VanDerWaalsContact C-N 3.32Å; E72-L74 PolarHBondContact O-N 3.38Å; L74-L76 VanDerWaalsContact C-N 3.34Å; L74-L76 PolarHBondContact O-N 2.78Å; L74-A77 WeakPolarHBondContact O-CB 3.23Å; L74-A77 PolarHBondContact O-N 2.76Å; L74-I78 HydrophobicContact CD1-CD1 4.46Å; L74-I78 HydrophobicContact CG-CD1 4.22Å; L74-I78 WeakPolarHBondContact O-CG1 3.31Å; L74-I78 PolarHBondContact O-N 3.21Å; L74-F390 HydrophobicContact CB-CE2 4.15Å; L74-F390 HydrophobicContact CB-CZ 4.45Å; L74-F390 HydrophobicContact CD2-CD2 3.86Å; L74-F390 HydrophobicContact CD2-CE2 3.55Å; L74-F390 HydrophobicContact CG-CD2 4.32Å; L74-F390 HydrophobicContact CG-CE2 3.77Å; L74-F390 HydrophobicContact CG-CZ 4.34Å
75	L	94.6	Very high	94.2	Very high	1 Å²	1	59.7 Å²	59.7	1%	0.005	32%	0.322	C	S	.	.	H	α-helix	trans	-59.3	-43.3	175.2	175.3	61.7	0	0	0	112.2	Q71 E72 A77 I78 A79 F109 T112 L355 L356 F390 M392 P393	Q71-L75 PolarHBondContact O-N 2.87Å; E72-L75 PolarHBondContact O-N 2.96Å; L75-A77 VanDerWaalsContact C-N 3.32Å; L75-A77 PolarHBondContact O-N 3.44Å; L75-I78 PolarHBondContact O-N 3.39Å; L75-A79 WeakPolarHBondContact O-CB 3.32Å; L75-A79 PolarHBondContact O-N 3.42Å; L75-F109 HydrophobicContact CD1-CD1 4.41Å; L75-F109 HydrophobicContact CD1-CG 4.5Å; L75-F109 HydrophobicContact CD2-CB 3.71Å; L75-F109 HydrophobicContact CD2-CD1 3.7Å; L75-F109 HydrophobicContact CD2-CG 3.77Å; L75-F109 HydrophobicContact CG-CB 4.21Å; L75-F109 HydrophobicContact CG-CD1 4.3Å; L75-F109 HydrophobicContact CG-CG 4.09Å; L75-T112 HydrophobicContact CD2-CG2 3.94Å; L75-L355 HydrophobicContact CD1-CD2 4.32Å; L75-L356 HydrophobicContact CD1-CD2 4.2Å; L75-F390 HydrophobicContact CB-CE1 3.93Å; L75-F390 HydrophobicContact CB-CZ 3.91Å; L75-F390 HydrophobicContact CD1-CE1 4.01Å; L75-F390 HydrophobicContact CG-CE1 4.49Å; L75-M392 HydrophobicContact CD2-SD 3.7Å; L75-P393 HydrophobicContact CB-CG 4.4Å; L75-P393 HydrophobicContact CD2-CG 3.94Å
76	L	95.8	Very high	94.1	Very high	14 Å²	14	60 Å²	60	7%	0.073	32%	0.323	C	S	.	.	H	α-helix	trans	-62.4	-40.7	176.8	-70.4	171.1	0	0	0	111.3	N68 E72 K73 L74 I78 A79 D80 S99 F109	N68-L76 WeakPolarHBondContact ND2-CD1 3.33Å; E72-L76 WeakPolarHBondContact O-CB 3.35Å; E72-L76 VanDerWaalsContact O-CG 3.25Å; E72-L76 WeakPolarHBondContact O-CG 3.34Å; E72-L76 PolarHBondContact O-N 3.37Å; K73-L76 PolarHBondContact O-N 2.94Å; L74-L76 VanDerWaalsContact C-N 3.34Å; L74-L76 PolarHBondContact O-N 2.78Å; L76-I78 PolarHBondContact O-N 3.03Å; L76-A79 PolarHBondContact O-N 2.98Å; L76-D80 WeakPolarHBondContact O-CB 3.49Å; L76-D80 VanDerWaalsContact O-CG 3.28Å; L76-D80 PolarHBondContact O-N 3.43Å; L76-S99 VanDerWaalsContact CD2-OG 3.31Å; L76-S99 WeakPolarHBondContact CD2-OG 3.47Å; L76-F109 HydrophobicContact CD2-CB 4.47Å
77	A	94.7	Very high	94	Very high	54 Å²	54	59 Å²	59	45%	0.446	32%	0.324	S	S	.	.	H	α-helix	trans	-64.2	-38.7	174.9	0	0	0	0	0	112.7	K73 L74 L75 N81	K73-A77 PolarHBondContact O-N 2.83Å; K73-A77 VanDerWaalsContact O-N 3.08Å; L74-A77 WeakPolarHBondContact O-CB 3.23Å; L74-A77 PolarHBondContact O-N 2.76Å; L75-A77 VanDerWaalsContact C-N 3.32Å; L75-A77 PolarHBondContact O-N 3.44Å; A77-N81 WeakPolarHBondContact O-CB 3.46Å; A77-N81 PolarHBondContact O-N 2.97Å
78	I	93.2	Very high	93.9	Very high	52 Å²	52	60.2 Å²	60.2	27%	0.267	33%	0.33	S	S	.	.	H	α-helix	trans	-62.9	-47.6	173.3	-66.8	165.9	0	0	0	110.1	L74 L75 L76 D80 N81 F82 L355 F390	L74-I78 HydrophobicContact CD1-CD1 4.46Å; L74-I78 HydrophobicContact CG-CD1 4.22Å; L74-I78 WeakPolarHBondContact O-CG1 3.31Å; L74-I78 PolarHBondContact O-N 3.21Å; L75-I78 PolarHBondContact O-N 3.39Å; L76-I78 PolarHBondContact O-N 3.03Å; I78-D80 PolarHBondContact O-N 3.37Å; I78-N81 PolarHBondContact O-N 3.47Å; I78-F82 WeakPolarHBondContact O-CB 3.39Å; I78-F82 PolarHBondContact O-N 2.96Å; I78-L355 HydrophobicContact CG2-CD1 4.27Å; I78-L355 HydrophobicContact CG2-CG 4.42Å; I78-F390 HydrophobicContact CD1-CD1 3.99Å; I78-F390 HydrophobicContact CD1-CD2 4.4Å; I78-F390 HydrophobicContact CD1-CE1 4.16Å; I78-F390 HydrophobicContact CD1-CG 4.11Å; I78-F390 HydrophobicContact CD1-CZ 4.44Å
79	A	94.1	Very high	93.8	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-62.9	-40.6	179.3	0	0	0	0	0	112.3	L75 L76 F82 C83 L98 F109 L355	L75-A79 WeakPolarHBondContact O-CB 3.32Å; L75-A79 PolarHBondContact O-N 3.42Å; L76-A79 PolarHBondContact O-N 2.98Å; A79-F82 PolarHBondContact O-N 2.79Å; A79-C83 VanDerWaalsContact O-CB 3.31Å; A79-C83 WeakPolarHBondContact O-CB 3.48Å; A79-C83 PolarHBondContact O-N 3.23Å; A79-L98 HydrophobicContact CB-CB 4.39Å; A79-L98 HydrophobicContact CB-CD1 4.49Å; A79-F109 HydrophobicContact CB-CD2 3.92Å; A79-F109 HydrophobicContact CB-CE2 3.85Å; A79-L355 HydrophobicContact CB-CD2 4.43Å
80	D	94.3	Very high	93.7	Very high	77 Å²	77	65.5 Å²	65.5	41%	0.412	35%	0.348	S	S	.	.	H	α-helix	trans	-65.3	-44.5	177	-74.9	-15.1	0	0	0	111.3	L76 I78 C83 C84	L76-D80 WeakPolarHBondContact O-CB 3.49Å; L76-D80 VanDerWaalsContact O-CG 3.28Å; L76-D80 PolarHBondContact O-N 3.43Å; I78-D80 PolarHBondContact O-N 3.37Å; D80-C83 WeakPolarHBondContact O-CB 3.4Å; D80-C83 PolarHBondContact O-N 3.26Å; D80-C84 PolarHBondContact O-N 3.05Å; D80-C84 PolarHBondContact O-SG 2.87Å; D80-C84 VanDerWaalsContact O-SG 3.33Å
81	N	93.8	Very high	93.5	Very high	93 Å²	93	64.6 Å²	64.6	50%	0.497	34%	0.342	S	S	.	.	H	α-helix	trans	-60.8	-46.5	175	-175.5	15.8	0	0	0	111.4	A77 I78 C83 C84 Q85	A77-N81 WeakPolarHBondContact O-CB 3.46Å; A77-N81 PolarHBondContact O-N 2.97Å; I78-N81 PolarHBondContact O-N 3.47Å; N81-C83 VanDerWaalsContact C-N 3.33Å; N81-C83 PolarHBondContact O-N 2.95Å; N81-C84 PolarHBondContact O-N 3.12Å; N81-Q85 WeakPolarHBondContact O-CG 3.34Å; N81-Q85 PolarHBondContact O-N 3.24Å; N81-Q85 PolarHBondContact OD1-NE2 3.02Å
82	F	93.8	Very high	93.3	Very high	21 Å²	21	68.9 Å²	68.9	9%	0.092	37%	0.367	C	S	.	.	H	α-helix	trans	-59.5	-43.8	176	-176.6	-92.6	0	0	0	111.8	I78 A79 C84 Q85 Y86 L96 L98 V330 E353 L355	I78-F82 WeakPolarHBondContact O-CB 3.39Å; I78-F82 PolarHBondContact O-N 2.96Å; A79-F82 PolarHBondContact O-N 2.79Å; F82-C84 PolarHBondContact O-N 3.31Å; F82-Q85 PolarHBondContact O-N 3.28Å; F82-Y86 VanDerWaalsContact O-CB 3.32Å; F82-Y86 WeakPolarHBondContact O-CB 3.47Å; F82-Y86 PolarHBondContact O-N 3.46Å; F82-L96 HydrophobicContact CD1-CD1 4.5Å; F82-L96 HydrophobicContact CE1-CD1 3.85Å; F82-L98 HydrophobicContact CD1-CD1 4.22Å; F82-V330 HydrophobicContact CE1-CG2 3.72Å; F82-V330 HydrophobicContact CZ-CG2 3.79Å; F82-E353 HydrophobicContact CE2-CG 4.32Å; F82-E353 HydrophobicContact CZ-CG 4.39Å; F82-L355 HydrophobicContact CB-CD1 3.43Å; F82-L355 VanDerWaalsContact CB-CD1 3.43Å; F82-L355 HydrophobicContact CD1-CD1 3.76Å; F82-L355 HydrophobicContact CD2-CD1 3.7Å; F82-L355 HydrophobicContact CE1-CD1 4.45Å; F82-L355 HydrophobicContact CE2-CD1 4.39Å; F82-L355 HydrophobicContact CG-CD1 3.33Å
83	C	91.6	Very high	93	Very high	30 Å²	30	71 Å²	71	20%	0.203	38%	0.375	C	S	.	.	H	α-helix	trans	-60.9	-44.8	176.4	-164.2	0	0	0	0	112	A79 D80 N81 Q85 Y86 V87 L98	A79-C83 VanDerWaalsContact O-CB 3.31Å; A79-C83 WeakPolarHBondContact O-CB 3.48Å; A79-C83 PolarHBondContact O-N 3.23Å; D80-C83 WeakPolarHBondContact O-CB 3.4Å; D80-C83 PolarHBondContact O-N 3.26Å; N81-C83 VanDerWaalsContact C-N 3.33Å; N81-C83 PolarHBondContact O-N 2.95Å; C83-Q85 VanDerWaalsContact C-N 3.34Å; C83-Q85 PolarHBondContact O-N 2.83Å; C83-Y86 PolarHBondContact O-N 3.2Å; C83-V87 WeakPolarHBondContact O-CB 3.46Å; C83-V87 WeakPolarHBondContact O-CG2 3.43Å; C83-V87 PolarHBondContact O-N 3Å; C83-L98 HydrophobicContact CB-CD1 3.79Å
84	C	92.2	Very high	92.6	Very high	90 Å²	90	67.8 Å²	67.8	61%	0.608	36%	0.361	S	S	*	.	H	α-helix	trans	-60.5	-43.3	176.7	-71.9	0	0	0	0	112.1	D80 N81 F82 H88	D80-C84 PolarHBondContact O-N 3.05Å; D80-C84 PolarHBondContact O-SG 2.87Å; D80-C84 VanDerWaalsContact O-SG 3.33Å; N81-C84 PolarHBondContact O-N 3.12Å; F82-C84 PolarHBondContact O-N 3.31Å; C84-H88 WeakPolarHBondContact O-CB 3.27Å; C84-H88 PolarHBondContact O-N 2.86Å; C84-H88 VanDerWaalsContact O-N 3.08Å
85	Q	92.8	Very high	92.5	Very high	95 Å²	95	67.2 Å²	67.2	44%	0.444	36%	0.363	S	S	.	.	H	α-helix	trans	-64.7	-45.5	176.4	-68.5	174.8	23.4	0	0	111.3	N81 F82 C83 V87 H88 L89	N81-Q85 WeakPolarHBondContact O-CG 3.34Å; N81-Q85 PolarHBondContact O-N 3.24Å; N81-Q85 PolarHBondContact OD1-NE2 3.02Å; F82-Q85 PolarHBondContact O-N 3.28Å; C83-Q85 VanDerWaalsContact C-N 3.34Å; C83-Q85 PolarHBondContact O-N 2.83Å; Q85-V87 PolarHBondContact O-N 2.91Å; Q85-H88 WeakPolarHBondContact O-CB 3.43Å; Q85-H88 PolarHBondContact O-N 3.28Å; Q85-L89 WeakPolarHBondContact O-CB 3.34Å; Q85-L89 WeakPolarHBondContact O-CG 3.28Å; Q85-L89 PolarHBondContact O-N 2.84Å
86	Y	92.6	Very high	92.4	Very high	5 Å²	5	68 Å²	68	2%	0.02	37%	0.367	C	S	.	.	H	α-helix	trans	-60.1	-48	178.7	177.1	-91.9	0	0	0	112.2	F82 C83 H88 L89 Y90 R93 L96 V330	F82-Y86 VanDerWaalsContact O-CB 3.32Å; F82-Y86 WeakPolarHBondContact O-CB 3.47Å; F82-Y86 PolarHBondContact O-N 3.46Å; C83-Y86 PolarHBondContact O-N 3.2Å; Y86-H88 PolarHBondContact O-N 3.14Å; Y86-L89 PolarHBondContact O-N 3.29Å; Y86-Y90 AromaticContact CD2-CD2 3.59Å; Y86-Y90 HydrophobicContact CD2-CD2 3.59Å; Y86-Y90 HydrophobicContact CD2-CE2 4.12Å; Y86-Y90 AromaticContact CE2-CD2 3.73Å; Y86-Y90 HydrophobicContact CE2-CD2 3.73Å; Y86-Y90 HydrophobicContact CE2-CE2 4.37Å; Y86-Y90 HydrophobicContact CE2-CG 4.42Å; Y86-Y90 HydrophobicContact CG-CD2 4.25Å; Y86-Y90 WeakPolarHBondContact O-CD2 3.45Å; Y86-Y90 PolarHBondContact O-N 2.95Å; Y86-R93 HydrophobicContact CE1-CB 4.31Å; Y86-R93 WeakPolarHBondContact OH-CD 3.49Å; Y86-R93 PolarHBondContact OH-NE 3.08Å; Y86-R93 PolarHBondContact OH-NH2 2.79Å; Y86-L96 HydrophobicContact CD1-CD1 3.95Å; Y86-L96 HydrophobicContact CD1-CG 3.9Å; Y86-L96 HydrophobicContact CD2-CD1 3.88Å; Y86-L96 HydrophobicContact CE1-CD1 4.07Å; Y86-L96 HydrophobicContact CE1-CD2 4.14Å; Y86-L96 HydrophobicContact CE1-CG 3.66Å; Y86-L96 HydrophobicContact CE2-CD1 4.01Å; Y86-L96 HydrophobicContact CE2-CD2 4.43Å; Y86-L96 HydrophobicContact CE2-CG 4.31Å; Y86-L96 HydrophobicContact CG-CD1 3.83Å; Y86-L96 HydrophobicContact CG-CG 4.3Å; Y86-V330 HydrophobicContact CD2-CG1 4.36Å; Y86-V330 HydrophobicContact CE2-CG1 3.75Å
87	V	93.3	Very high	92.4	Very high	65 Å²	65	68 Å²	68	39%	0.394	37%	0.367	S	S	.	.	H	α-helix	trans	-63.7	-32.9	177.4	172.1	0	0	0	0	111.5	C83 Q85 P95	C83-V87 WeakPolarHBondContact O-CB 3.46Å; C83-V87 WeakPolarHBondContact O-CG2 3.43Å; C83-V87 PolarHBondContact O-N 3Å; Q85-V87 PolarHBondContact O-N 2.91Å; V87-P95 HydrophobicContact CG2-CB 4.38Å; V87-P95 HydrophobicContact CG2-CG 4.38Å
88	H	93.6	Very high	92.4	Very high	157 Å²	157	65.8 Å²	65.8	73%	0.727	35%	0.347	S	S	*	.	H	α-helix	trans	-71.7	-43.2	176.4	-177.1	67.6	0	0	0	112.9	C84 Q85 Y86	C84-H88 WeakPolarHBondContact O-CB 3.27Å; C84-H88 PolarHBondContact O-N 2.86Å; C84-H88 VanDerWaalsContact O-N 3.08Å; Q85-H88 WeakPolarHBondContact O-CB 3.43Å; Q85-H88 PolarHBondContact O-N 3.28Å; Y86-H88 PolarHBondContact O-N 3.14Å
89	L	93.1	Very high	92.6	Very high	108 Å²	108	64.3 Å²	64.3	57%	0.565	34%	0.342	S	S	*	.	H	α-helix	trans	-75.7	-33.2	-178.8	-68.8	172.8	0	0	0	112.6	Q85 Y86 P91	Q85-L89 WeakPolarHBondContact O-CB 3.34Å; Q85-L89 WeakPolarHBondContact O-CG 3.28Å; Q85-L89 PolarHBondContact O-N 2.84Å; Y86-L89 PolarHBondContact O-N 3.29Å; L89-P91 VanDerWaalsContact C-CD 3.47Å; L89-P91 WeakPolarHBondContact O-CD 3.44Å
90	Y	92	Very high	92.7	Very high	81 Å²	81	64.7 Å²	64.7	32%	0.318	34%	0.344	S	S	.	.			trans	-126.2	66.1	-174.7	-52.2	-70.8	0	0	0	111.7	Y86 D92 R93 M332	Y86-Y90 AromaticContact CD2-CD2 3.59Å; Y86-Y90 HydrophobicContact CD2-CD2 3.59Å; Y86-Y90 HydrophobicContact CD2-CE2 4.12Å; Y86-Y90 AromaticContact CE2-CD2 3.73Å; Y86-Y90 HydrophobicContact CE2-CD2 3.73Å; Y86-Y90 HydrophobicContact CE2-CE2 4.37Å; Y86-Y90 HydrophobicContact CE2-CG 4.42Å; Y86-Y90 HydrophobicContact CG-CD2 4.25Å; Y86-Y90 WeakPolarHBondContact O-CD2 3.45Å; Y86-Y90 PolarHBondContact O-N 2.95Å; Y90-D92 PolarHBondContact O-N 2.94Å; Y90-D92 VanDerWaalsContact O-N 3.17Å; Y90-R93 PolarHBondContact O-N 3.32Å; Y90-M332 HydrophobicContact CE1-CE 4.15Å; Y90-M332 HydrophobicContact CE2-CE 3.78Å; Y90-M332 WeakPolarHBondContact OH-CE 3.3Å
91	P	90.1	Very high	92.8	Very high	95 Å²	95	63.7 Å²	63.7	62%	0.617	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-22.7	-174.7	26.7	-35.9	0	0	0	114	L89 R93	L89-P91 VanDerWaalsContact C-CD 3.47Å; L89-P91 WeakPolarHBondContact O-CD 3.44Å; P91-R93 VanDerWaalsContact C-N 3.35Å
92	D	89.1	Confident	92.9	Very high	166 Å²	166	59.3 Å²	59.3	89%	0.888	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-11.6	178	-62.9	-38.1	0	0	0	113.1	Y90	Y90-D92 PolarHBondContact O-N 2.94Å; Y90-D92 VanDerWaalsContact O-N 3.17Å
93	R	89.3	Confident	92.9	Very high	60 Å²	60	59.2 Å²	59.2	23%	0.226	32%	0.315	C	S	.	.	S	Bend	trans	-93.1	148.1	177.2	-67.4	-179.3	74.7	-174.8	-4.4	110.5	Y86 Y90 P91 E320 N331	Y86-R93 HydrophobicContact CE1-CB 4.31Å; Y86-R93 WeakPolarHBondContact OH-CD 3.49Å; Y86-R93 PolarHBondContact OH-NE 3.08Å; Y86-R93 PolarHBondContact OH-NH2 2.79Å; Y90-R93 PolarHBondContact O-N 3.32Å; P91-R93 VanDerWaalsContact C-N 3.35Å; R93-E320 IonicContact CZ-OE2 3.55Å; R93-E320 IonicContact NE-OE2 3.59Å; R93-E320 PolarHBondContact NE-OE2 2.79Å; R93-E320 IonicContact NH2-OE2 2.74Å; R93-E320 PolarHBondContact NH2-OE2 2.82Å; R93-N331 PolarHBondContact NH1-O 3.14Å; R93-N331 PolarHBondContact NH2-O 2.76Å
94	K	87.4	Confident	93	Very high	67 Å²	67	59.7 Å²	59.7	29%	0.291	32%	0.318	S	S	.	.	P	Polyproline II helix	trans	-68.6	149.9	174.3	-72.5	-163	173.4	-164	0	111.1	I147 D148	K94-I147 PolarHBondContact NZ-O 2.91Å; K94-D148 IonicContact NZ-OD1 3.37Å; K94-D148 PolarHBondContact NZ-OD1 3.29Å
95	P	90.6	Very high	93.1	Very high	81 Å²	81	57.6 Å²	57.6	53%	0.526	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-57.8	142	173.1	-24	33.9	0	0	0	112.4	V87	V87-P95 HydrophobicContact CG2-CB 4.38Å; V87-P95 HydrophobicContact CG2-CG 4.38Å
96	L	93.3	Very high	93.3	Very high	17 Å²	17	54.2 Å²	54.2	9%	0.089	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-72.9	146.7	-179.7	-63.8	170.8	0	0	0	111.9	F82 Y86 L98 Y328 V330	F82-L96 HydrophobicContact CD1-CD1 4.5Å; F82-L96 HydrophobicContact CE1-CD1 3.85Å; Y86-L96 HydrophobicContact CD1-CD1 3.95Å; Y86-L96 HydrophobicContact CD1-CG 3.9Å; Y86-L96 HydrophobicContact CD2-CD1 3.88Å; Y86-L96 HydrophobicContact CE1-CD1 4.07Å; Y86-L96 HydrophobicContact CE1-CD2 4.14Å; Y86-L96 HydrophobicContact CE1-CG 3.66Å; Y86-L96 HydrophobicContact CE2-CD1 4.01Å; Y86-L96 HydrophobicContact CE2-CD2 4.43Å; Y86-L96 HydrophobicContact CE2-CG 4.31Å; Y86-L96 HydrophobicContact CG-CD1 3.83Å; Y86-L96 HydrophobicContact CG-CG 4.3Å; L96-L98 HydrophobicContact CB-CD1 4.29Å; L96-L98 HydrophobicContact CB-CD2 4.45Å; L96-L98 HydrophobicContact CB-CG 4Å; L96-L98 PolarHBondContact O-N 2.82Å; L96-Y328 HydrophobicContact CD1-CE1 4.41Å; L96-V330 HydrophobicContact CD1-CG1 4.31Å; L96-V330 HydrophobicContact CD1-CG2 3.51Å; L96-V330 HydrophobicContact CD2-CG1 4.38Å; L96-V330 HydrophobicContact CD2-CG2 4.49Å
97	L	94.9	Very high	93.5	Very high	15 Å²	15	58.4 Å²	58.4	8%	0.079	32%	0.318	C	S	.	.			trans	-82.4	91.8	171.1	-175.5	68.1	0	0	0	109.9	P100 V110 P149 P150 F168 Y328	L97-P100 HydrophobicContact CD1-CB 3.94Å; L97-P100 HydrophobicContact CD1-CG 4.1Å; L97-P100 HydrophobicContact CG-CG 4.49Å; L97-V110 HydrophobicContact CD2-CG1 4.36Å; L97-V110 HydrophobicContact CG-CG1 4.03Å; L97-P149 HydrophobicContact CB-CB 4.03Å; L97-P149 HydrophobicContact CB-CG 4.5Å; L97-P149 HydrophobicContact CD1-CB 4.15Å; L97-P149 HydrophobicContact CD2-CB 4.28Å; L97-P149 HydrophobicContact CG-CB 4.38Å; L97-P150 WeakPolarHBondContact CD1-O 3.28Å; L97-P150 HydrophobicContact CD2-CG 4.3Å; L97-F168 HydrophobicContact CD2-CD1 3.53Å; L97-F168 HydrophobicContact CD2-CE1 3.45Å; L97-F168 VanDerWaalsContact CD2-CE1 3.45Å; L97-F168 HydrophobicContact CD2-CG 4.44Å; L97-F168 HydrophobicContact CD2-CZ 4.31Å; L97-Y328 WeakPolarHBondContact O-CE2 3.36Å; L97-Y328 PolarHBondContact O-OH 3.1Å
98	L	95.8	Very high	93.7	Very high	6 Å²	6	55.5 Å²	55.5	3%	0.031	30%	0.3	C	S	.	.			trans	-105.7	-50.7	-179.6	-64.3	169.9	0	0	0	112.6	A79 F82 C83 L96 P100 F109 V110 Y328	A79-L98 HydrophobicContact CB-CB 4.39Å; A79-L98 HydrophobicContact CB-CD1 4.49Å; F82-L98 HydrophobicContact CD1-CD1 4.22Å; C83-L98 HydrophobicContact CB-CD1 3.79Å; L96-L98 HydrophobicContact CB-CD1 4.29Å; L96-L98 HydrophobicContact CB-CD2 4.45Å; L96-L98 HydrophobicContact CB-CG 4Å; L96-L98 PolarHBondContact O-N 2.82Å; L98-P100 VanDerWaalsContact C-CD 3.49Å; L98-P100 WeakPolarHBondContact O-CD 3.41Å; L98-F109 HydrophobicContact CB-CD2 4.44Å; L98-F109 HydrophobicContact CB-CE2 4.07Å; L98-F109 HydrophobicContact CD2-CE2 3.93Å; L98-F109 HydrophobicContact CD2-CZ 4.4Å; L98-F109 CarbonylContact O-C 3.6Å; L98-F109 WeakPolarHBondContact O-CA 3.31Å; L98-F109 VanDerWaalsContact O-CD2 3.28Å; L98-F109 WeakPolarHBondContact O-CD2 3.41Å; L98-V110 WeakPolarHBondContact O-CG1 3.42Å; L98-V110 PolarHBondContact O-N 2.82Å; L98-Y328 HydrophobicContact CD2-CD1 3.74Å; L98-Y328 HydrophobicContact CD2-CD2 4.03Å; L98-Y328 HydrophobicContact CD2-CE1 3.46Å; L98-Y328 VanDerWaalsContact CD2-CE1 3.46Å; L98-Y328 HydrophobicContact CD2-CE2 3.8Å; L98-Y328 HydrophobicContact CD2-CG 4Å; L98-Y328 VanDerWaalsContact CD2-CZ 3.47Å
99	S	96.1	Very high	93.8	Very high	21 Å²	21	48.1 Å²	48.1	15%	0.147	27%	0.266	C	S	.	.	S	Bend	trans	-129.8	61.6	-168.6	-55.9	0	0	0	0	113.1	L76 K108	L76-S99 VanDerWaalsContact CD2-OG 3.31Å; L76-S99 WeakPolarHBondContact CD2-OG 3.47Å; S99-K108 CarbonylContact C-O 3.55Å; S99-K108 WeakPolarHBondContact CA-O 3.48Å
100	P	96.4	Very high	94	Very high	9 Å²	9	43 Å²	43	6%	0.058	24%	0.239	C	C	.	.			trans	-65.2	164.3	176	28.1	-34.4	0	0	0	112.9	L97 L98 Q107 K108 V110 L153	L97-P100 HydrophobicContact CD1-CB 3.94Å; L97-P100 HydrophobicContact CD1-CG 4.1Å; L97-P100 HydrophobicContact CG-CG 4.49Å; L98-P100 VanDerWaalsContact C-CD 3.49Å; L98-P100 WeakPolarHBondContact O-CD 3.41Å; P100-Q107 WeakPolarHBondContact O-CA 3.19Å; P100-K108 WeakPolarHBondContact CD-O 3.22Å; P100-K108 PolarHBondContact O-N 3.33Å; P100-V110 HydrophobicContact CG-CG1 3.77Å; P100-L153 HydrophobicContact CB-CB 3.92Å; P100-L153 HydrophobicContact CG-CB 3.52Å; P100-L153 HydrophobicContact CG-CD2 4.08Å; P100-L153 HydrophobicContact CG-CG 4.46Å
101	L	97.4	Very high	94.2	Very high	56 Å²	56	39.2 Å²	39.2	29%	0.293	22%	0.224	S	C	.	.	B	Isolated β-bridge	trans	-77.7	137.7	172.6	-62.4	173.7	0	0	0	110.5	Q107 R151 H152 L153	L101-Q107 HydrophobicContact CD2-CG 3.64Å; L101-R151 PolarHBondContact N-O 3.16Å; L101-H152 CarbonylContact O-C 3.59Å; L101-H152 WeakPolarHBondContact O-CA 3.01Å; L101-L153 PolarHBondContact O-N 2.82Å
102	N	95.4	Very high	94.5	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.005	20%	0.195	C	C	.	.			trans	-82.7	-177.4	168.4	73.4	-0.8	0	0	0	111.9	Y65 C104 G105 V106 K108 W396	Y65-N102 PolarHBondContact O-ND2 3.06Å; N102-C104 PolarHBondContact O-N 3.1Å; N102-C104 VanDerWaalsContact O-N 3.12Å; N102-C104 WeakPolarHBondContact OD1-CA 3.44Å; N102-C104 PolarHBondContact OD1-N 3.19Å; N102-G105 PolarHBondContact O-N 2.9Å; N102-G105 PolarHBondContact OD1-N 3.34Å; N102-V106 PolarHBondContact N-O 3.39Å; N102-V106 PolarHBondContact OD1-N 3.05Å; N102-V106 PolarHBondContact OD1-O 3.31Å; N102-K108 HydrophobicContact CB-CG 4.28Å; N102-W396 HydrophobicContact CB-CH2 3.52Å; N102-W396 HydrophobicContact CB-CZ2 4.06Å; N102-W396 HydrophobicContact CB-CZ3 4.16Å
103	E	94.1	Very high	94.9	Very high	18 Å²	18	27 Å²	27	8%	0.084	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-22.3	176.3	56.2	-90.6	-149.1	0	0	115	L58 Y65 Y154 S155 W158	L58-E103 HydrophobicContact CD2-CB 4.23Å; L58-E103 HydrophobicContact CD2-CG 4.17Å; Y65-E103 WeakPolarHBondContact CD1-OE1 3.45Å; Y65-E103 WeakPolarHBondContact CE1-OE1 3.42Å; E103-Y154 HydrophobicContact CB-CD1 3.92Å; E103-Y154 HydrophobicContact CB-CE1 4.18Å; E103-S155 VanDerWaalsContact OE1-CB 3.24Å; E103-S155 WeakPolarHBondContact OE1-CB 3.49Å; E103-S155 PolarHBondContact OE1-OG 2.78Å; E103-S155 PolarHBondContact OE2-N 3.3Å; E103-S155 VanDerWaalsContact OE2-N 3.17Å; E103-W158 HydrophobicContact CB-CG 4.34Å
104	C	93.7	Very high	95.3	Very high	40 Å²	40	24.2 Å²	24.2	27%	0.27	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.5	3.7	177.7	-64.2	0	0	0	0	113.1	Y65 K66 N102 V106	Y65-C104 WeakPolarHBondContact O-CB 3.26Å; K66-C104 HydrophobicContact CG-CB 4.39Å; N102-C104 PolarHBondContact O-N 3.1Å; N102-C104 VanDerWaalsContact O-N 3.12Å; N102-C104 WeakPolarHBondContact OD1-CA 3.44Å; N102-C104 PolarHBondContact OD1-N 3.19Å; C104-V106 HydrophobicContact CB-CG2 4.39Å
105	G	94.2	Very high	95.7	Very high	47 Å²	47	24.8 Å²	24.8	49%	0.485	14%	0.144	S	C	.	.	S	Bend	trans	76	21.2	-178.4	0	0	0	0	0	114.2	N102	N102-G105 PolarHBondContact O-N 2.9Å; N102-G105 PolarHBondContact OD1-N 3.34Å
106	V	96.5	Very high	95.9	Very high	23 Å²	23	23.4 Å²	23.4	14%	0.139	14%	0.135	C	C	.	.			trans	-101.7	133.1	177.6	-177.1	0	0	0	0	109.4	Y65 K66 N102 C104 K108	Y65-V106 WeakPolarHBondContact O-CG2 3.5Å; K66-V106 VanDerWaalsContact O-CG2 3.24Å; K66-V106 WeakPolarHBondContact O-CG2 3.46Å; N102-V106 PolarHBondContact N-O 3.39Å; N102-V106 PolarHBondContact OD1-N 3.05Å; N102-V106 PolarHBondContact OD1-O 3.31Å; C104-V106 HydrophobicContact CB-CG2 4.39Å; V106-K108 PolarHBondContact O-N 3.37Å
107	Q	97.1	Very high	95.9	Very high	94 Å²	94	22.9 Å²	22.9	44%	0.439	13%	0.132	S	C	.	.	B	Isolated β-bridge	trans	-67.8	125	173.2	-72.2	179.8	-38.9	0	0	110.1	N68 P100 L101	N68-Q107 PolarHBondContact ND2-O 3.01Å; N68-Q107 VanDerWaalsContact ND2-O 3.12Å; N68-Q107 PolarHBondContact OD1-O 2.88Å; P100-Q107 WeakPolarHBondContact O-CA 3.19Å; L101-Q107 HydrophobicContact CD2-CG 3.64Å
108	K	97	Very high	95.8	Very high	3 Å²	3	26.6 Å²	26.6	1%	0.013	15%	0.152	C	C	.	.			trans	-129.1	140.9	177.9	-68.3	-63.7	-167.2	-176.9	0	109.5	S64 E67 N68 E72 S99 P100 N102 V106 W396	S64-K108 WeakPolarHBondContact O-CE 3.41Å; S64-K108 PolarHBondContact O-NZ 2.9Å; E67-K108 PolarHBondContact O-NZ 3.36Å; N68-K108 WeakPolarHBondContact OD1-CD 3.43Å; N68-K108 WeakPolarHBondContact OD1-CE 3.38Å; N68-K108 PolarHBondContact OD1-NZ 2.82Å; E72-K108 IonicContact OE1-NZ 3.52Å; E72-K108 PolarHBondContact OE1-NZ 2.98Å; E72-K108 IonicContact OE2-NZ 2.78Å; S99-K108 CarbonylContact C-O 3.55Å; S99-K108 WeakPolarHBondContact CA-O 3.48Å; P100-K108 WeakPolarHBondContact CD-O 3.22Å; P100-K108 PolarHBondContact O-N 3.33Å; N102-K108 HydrophobicContact CB-CG 4.28Å; V106-K108 PolarHBondContact O-N 3.37Å; K108-W396 HydrophobicContact CB-CZ2 3.97Å; K108-W396 HydrophobicContact CD-CD2 4.09Å; K108-W396 HydrophobicContact CD-CG 3.92Å; K108-W396 HydrophobicContact CG-CD2 4.05Å; K108-W396 HydrophobicContact CG-CG 4.37Å; K108-W396 HydrophobicContact CG-CZ2 3.84Å
109	F	97.3	Very high	95.7	Very high	3 Å²	3	27.1 Å²	27.1	1%	0.013	15%	0.154	C	C	.	.			trans	-72.7	132.9	177.5	-172	-108.3	0	0	0	110.3	L75 L76 A79 L98 S111 T112 Y328 L355 M392	L75-F109 HydrophobicContact CD1-CD1 4.41Å; L75-F109 HydrophobicContact CD1-CG 4.5Å; L75-F109 HydrophobicContact CD2-CB 3.71Å; L75-F109 HydrophobicContact CD2-CD1 3.7Å; L75-F109 HydrophobicContact CD2-CG 3.77Å; L75-F109 HydrophobicContact CG-CB 4.21Å; L75-F109 HydrophobicContact CG-CD1 4.3Å; L75-F109 HydrophobicContact CG-CG 4.09Å; L76-F109 HydrophobicContact CD2-CB 4.47Å; A79-F109 HydrophobicContact CB-CD2 3.92Å; A79-F109 HydrophobicContact CB-CE2 3.85Å; L98-F109 HydrophobicContact CB-CD2 4.44Å; L98-F109 HydrophobicContact CB-CE2 4.07Å; L98-F109 HydrophobicContact CD2-CE2 3.93Å; L98-F109 HydrophobicContact CD2-CZ 4.4Å; L98-F109 CarbonylContact O-C 3.6Å; L98-F109 WeakPolarHBondContact O-CA 3.31Å; L98-F109 VanDerWaalsContact O-CD2 3.28Å; L98-F109 WeakPolarHBondContact O-CD2 3.41Å; F109-S111 VanDerWaalsContact CE1-OG 3.25Å; F109-S111 WeakPolarHBondContact CE1-OG 3.44Å; F109-S111 PolarHBondContact O-N 3.48Å; F109-T112 HydrophobicContact CB-CG2 4.28Å; F109-T112 PolarHBondContact O-N 2.82Å; F109-T112 PolarHBondContact O-OG1 3.48Å; F109-Y328 HydrophobicContact CZ-CD2 4.22Å; F109-Y328 HydrophobicContact CZ-CG 4.17Å; F109-L355 HydrophobicContact CE1-CD2 4.2Å; F109-L355 HydrophobicContact CE2-CD2 3.6Å; F109-L355 HydrophobicContact CZ-CD2 3.3Å; F109-M392 HydrophobicContact CD1-CE 4.18Å; F109-M392 HydrophobicContact CD1-SD 4.02Å; F109-M392 HydrophobicContact CE1-CE 3.73Å; F109-M392 HydrophobicContact CE1-SD 4.2Å
110	V	97	Very high	95.4	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.184	C	C	.	.	G	3₁₀ helix	trans	-54.1	-35.3	-171.1	-68.3	0	0	0	0	114.5	L97 L98 P100 T112 T113 L153 W323 Y328	L97-V110 HydrophobicContact CD2-CG1 4.36Å; L97-V110 HydrophobicContact CG-CG1 4.03Å; L98-V110 WeakPolarHBondContact O-CG1 3.42Å; L98-V110 PolarHBondContact O-N 2.82Å; P100-V110 HydrophobicContact CG-CG1 3.77Å; V110-T112 VanDerWaalsContact C-N 3.32Å; V110-T112 PolarHBondContact O-N 3.39Å; V110-T113 WeakPolarHBondContact O-CB 3.45Å; V110-T113 PolarHBondContact O-N 3.12Å; V110-L153 HydrophobicContact CB-CD2 4.32Å; V110-L153 HydrophobicContact CG1-CD2 3.99Å; V110-W323 HydrophobicContact CB-CD2 4.48Å; V110-W323 HydrophobicContact CB-CZ2 4.45Å; V110-W323 HydrophobicContact CG2-CD2 3.98Å; V110-W323 HydrophobicContact CG2-CG 3.92Å; V110-Y328 HydrophobicContact CG2-CD2 3.62Å; V110-Y328 HydrophobicContact CG2-CE2 3.69Å
111	S	96.4	Very high	95.1	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.007	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-68.9	-31.2	179.2	-57.7	0	0	0	0	112.4	F109 T113 L114 N324 N327	F109-S111 VanDerWaalsContact CE1-OG 3.25Å; F109-S111 WeakPolarHBondContact CE1-OG 3.44Å; F109-S111 PolarHBondContact O-N 3.48Å; S111-T113 PolarHBondContact O-N 2.93Å; S111-L114 PolarHBondContact O-N 3.38Å; S111-N324 WeakPolarHBondContact CB-O 3.47Å; S111-N324 PolarHBondContact OG-O 3.03Å; S111-N327 PolarHBondContact OG-O 2.78Å
112	T	96.3	Very high	94.8	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.012	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-77.4	-9.3	177.7	66.3	0	0	0	0	113.2	L75 F109 V110 M392 P393 S395 W396	L75-T112 HydrophobicContact CD2-CG2 3.94Å; F109-T112 HydrophobicContact CB-CG2 4.28Å; F109-T112 PolarHBondContact O-N 2.82Å; F109-T112 PolarHBondContact O-OG1 3.48Å; V110-T112 VanDerWaalsContact C-N 3.32Å; V110-T112 PolarHBondContact O-N 3.39Å; T112-M392 HydrophobicContact CG2-SD 4.02Å; T112-P393 HydrophobicContact CG2-CB 4.47Å; T112-S395 WeakPolarHBondContact O-CA 3.46Å; T112-S395 VanDerWaalsContact O-CB 3.3Å; T112-S395 WeakPolarHBondContact O-CB 3.24Å; T112-S395 PolarHBondContact O-OG 2.79Å; T112-W396 PolarHBondContact O-N 3.18Å; T112-W396 PolarHBondContact O-NE1 3.16Å; T112-W396 VanDerWaalsContact OG1-CD1 3.3Å; T112-W396 PolarHBondContact OG1-NE1 3.38Å
113	T	96.9	Very high	94.5	Very high	2 Å²	2	40 Å²	40	1%	0.012	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-80.8	-20	172.1	-48.1	0	0	0	0	111.8	V110 S111 R115 L153 T172 W396 V397	V110-T113 WeakPolarHBondContact O-CB 3.45Å; V110-T113 PolarHBondContact O-N 3.12Å; S111-T113 PolarHBondContact O-N 2.93Å; T113-R115 PolarHBondContact O-N 3.45Å; T113-L153 HydrophobicContact CG2-CD2 4.18Å; T113-L153 HydrophobicContact CG2-CG 4.35Å; T113-T172 HydrophobicContact CG2-CG2 3.8Å; T113-W396 HydrophobicContact CG2-CH2 4.46Å; T113-W396 HydrophobicContact CG2-CZ2 3.77Å; T113-V397 HydrophobicContact CG2-CG2 4.3Å
114	L	97.1	Very high	94.5	Very high	2 Å²	2	39.5 Å²	39.5	1%	0.01	23%	0.226	C	C	.	.			trans	-76.8	121.1	176.6	-68.2	172	0	0	0	110.3	S111 P116 T172 C175 S176 L179 N324 H325 S395	S111-L114 PolarHBondContact O-N 3.38Å; L114-P116 WeakPolarHBondContact O-CD 3.36Å; L114-T172 HydrophobicContact CD2-CG2 3.92Å; L114-T172 WeakPolarHBondContact CD2-O 3.47Å; L114-C175 HydrophobicContact CD2-CB 3.79Å; L114-S176 WeakPolarHBondContact CA-OG 3.47Å; L114-L179 HydrophobicContact CD1-CD1 4.31Å; L114-N324 VanDerWaalsContact CD1-C 3.4Å; L114-H325 HydrophobicContact CB-CB 4.28Å; L114-S395 VanDerWaalsContact O-CB 3.31Å; L114-S395 WeakPolarHBondContact O-CB 3.44Å
115	R	95.5	Very high	94.5	Very high	80 Å²	80	41.7 Å²	41.7	30%	0.302	23%	0.229	S	C	.	.			trans	-116	89.6	179.2	-175.9	67.5	-177.4	-161.7	3.8	110.2	T113 T117 S176 S395 V397	T113-R115 PolarHBondContact O-N 3.45Å; R115-T117 PolarHBondContact O-N 3.11Å; R115-T117 PolarHBondContact O-OG1 2.99Å; R115-S176 PolarHBondContact N-OG 3.25Å; R115-S176 WeakPolarHBondContact O-CB 3.5Å; R115-S395 WeakPolarHBondContact CD-OG 3.32Å; R115-S395 PolarHBondContact NH1-O 2.7Å; R115-V397 HydrophobicContact CB-CB 4.23Å; R115-V397 HydrophobicContact CB-CG1 4.47Å; R115-V397 WeakPolarHBondContact CD-O 3.36Å
116	P	96	Very high	94.5	Very high	52 Å²	52	41.4 Å²	41.4	34%	0.338	22%	0.22	S	C	.	.			trans	-49.3	113.5	173.6	-27	34.6	0	0	0	110.8	L114 S176 L179 H325	L114-P116 WeakPolarHBondContact O-CD 3.36Å; P116-S176 WeakPolarHBondContact CA-O 3.33Å; P116-L179 HydrophobicContact CB-CB 4.06Å; P116-L179 HydrophobicContact CG-CB 4.04Å; P116-L179 HydrophobicContact CG-CD1 4.41Å; P116-H325 HydrophobicContact CG-CB 3.86Å
117	T	93.4	Very high	94.4	Very high	6 Å²	6	42.3 Å²	42.3	4%	0.037	22%	0.221	C	C	.	.			trans	-137.7	119.3	-175.5	-54.2	0	0	0	0	110.5	R115 L119 S176 Q399 I400	R115-T117 PolarHBondContact O-N 3.11Å; R115-T117 PolarHBondContact O-OG1 2.99Å; T117-L119 HydrophobicContact CG2-CD2 4.22Å; T117-L119 HydrophobicContact CG2-CG 4.45Å; T117-S176 PolarHBondContact N-O 3.49Å; T117-Q399 HydrophobicContact CG2-CG 3.65Å; T117-I400 HydrophobicContact CG2-CB 3.96Å; T117-I400 WeakPolarHBondContact CG2-O 3.43Å
118	L	93.1	Very high	94.4	Very high	93 Å²	93	42.5 Å²	42.5	49%	0.487	22%	0.221	S	C	.	.			trans	-90.3	126.4	168.9	-172.7	67.9	0	0	0	109.4	Y125	L118-Y125 HydrophobicContact CD1-CD1 3.71Å; L118-Y125 HydrophobicContact CD1-CE1 3.49Å; L118-Y125 VanDerWaalsContact CD1-CE1 3.49Å; L118-Y125 HydrophobicContact CG-CE1 4.05Å
119	L	91.8	Very high	94.2	Very high	17 Å²	17	42.5 Å²	42.5	9%	0.089	22%	0.223	C	C	.	.			trans	-103.4	155.9	-179	-67.1	167.7	0	0	0	111.1	T117 Y121 L124 Y125 L177 I400 I402	T117-L119 HydrophobicContact CG2-CD2 4.22Å; T117-L119 HydrophobicContact CG2-CG 4.45Å; L119-Y121 HydrophobicContact CB-CD2 4.25Å; L119-Y121 PolarHBondContact O-N 3.42Å; L119-L124 HydrophobicContact CB-CD1 4.27Å; L119-L124 HydrophobicContact CD1-CD1 3.5Å; L119-Y125 WeakPolarHBondContact O-CE1 3.33Å; L119-Y125 PolarHBondContact O-OH 3.41Å; L119-L177 HydrophobicContact CD1-CD2 3.61Å; L119-L177 HydrophobicContact CG-CD2 4.38Å; L119-I400 VanDerWaalsContact CD2-O 3.31Å; L119-I400 WeakPolarHBondContact CD2-O 3.5Å; L119-I402 HydrophobicContact CD1-CD1 3.26Å; L119-I402 HydrophobicContact CD1-CG1 3.66Å; L119-I402 HydrophobicContact CD2-CG1 4.39Å
120	S	90.3	Very high	94.2	Very high	111 Å²	111	42.4 Å²	42.4	78%	0.776	22%	0.222	S	C	*	.	S	Bend	trans	-71.7	1.9	-177.4	-50.6	0	0	0	0	115.3	P122	S120-P122 WeakPolarHBondContact O-CD 3.34Å
121	Y	90.8	Very high	94.1	Very high	68 Å²	68	42.4 Å²	42.4	27%	0.267	22%	0.222	S	C	.	.			trans	-92	114.4	-176.2	-61.6	-72.7	0	0	0	110.8	L119 E123 L124 I402 Q404 M407	L119-Y121 HydrophobicContact CB-CD2 4.25Å; L119-Y121 PolarHBondContact O-N 3.42Å; Y121-E123 PolarHBondContact O-N 3.08Å; Y121-E123 VanDerWaalsContact O-N 3.16Å; Y121-L124 HydrophobicContact CD2-CD1 4.12Å; Y121-L124 HydrophobicContact CG-CD1 4.46Å; Y121-L124 PolarHBondContact O-N 2.71Å; Y121-I402 HydrophobicContact CE2-CB 4.27Å; Y121-I402 PolarHBondContact OH-O 3.34Å; Y121-Q404 PolarHBondContact OH-N 2.9Å; Y121-M407 HydrophobicContact CD1-CE 4.23Å; Y121-M407 HydrophobicContact CD1-CG 4.12Å; Y121-M407 HydrophobicContact CD2-CE 4.28Å; Y121-M407 HydrophobicContact CD2-CG 3.94Å; Y121-M407 HydrophobicContact CD2-SD 4.09Å; Y121-M407 HydrophobicContact CE1-CB 4.39Å; Y121-M407 HydrophobicContact CE1-CG 3.79Å; Y121-M407 HydrophobicContact CE2-CG 3.61Å; Y121-M407 HydrophobicContact CE2-SD 4.28Å; Y121-M407 HydrophobicContact CG-CE 3.95Å; Y121-M407 HydrophobicContact CG-CG 4.2Å; Y121-M407 HydrophobicContact CG-SD 4.34Å
122	P	90.7	Very high	94	Very high	98 Å²	98	44.1 Å²	44.1	64%	0.636	23%	0.234	S	C	*	.	G	3₁₀ helix	trans	-59.5	-30.4	-177	-25.9	35.2	0	0	0	114.3	S120 L124 Y125	S120-P122 WeakPolarHBondContact O-CD 3.34Å; P122-L124 PolarHBondContact O-N 3.23Å; P122-Y125 HydrophobicContact CB-CD2 4.5Å; P122-Y125 WeakPolarHBondContact O-CB 3.35Å; P122-Y125 PolarHBondContact O-N 2.9Å; P122-Y125 VanDerWaalsContact O-N 3.13Å
123	E	90.3	Very high	93.9	Very high	81 Å²	81	44 Å²	44	38%	0.379	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-59	-35.2	176.3	-174.1	179	169.7	0	0	112.1	Y121 Y125 S126 G129 R410	Y121-E123 PolarHBondContact O-N 3.08Å; Y121-E123 VanDerWaalsContact O-N 3.16Å; E123-Y125 PolarHBondContact O-N 2.9Å; E123-S126 PolarHBondContact O-N 3.49Å; E123-S126 PolarHBondContact O-OG 3.3Å; E123-G129 WeakPolarHBondContact O-CA 3.36Å; E123-R410 IonicContact OE1-CZ 3.7Å; E123-R410 IonicContact OE1-NH1 3.63Å; E123-R410 PolarHBondContact OE1-NH1 3.22Å; E123-R410 IonicContact OE1-NH2 3.58Å; E123-R410 PolarHBondContact OE1-NH2 2.74Å; E123-R410 IonicContact OE2-CZ 2.85Å; E123-R410 IonicContact OE2-NH2 2.85Å; E123-R410 PolarHBondContact OE2-NH2 2.97Å
124	L	93.2	Very high	93.8	Very high	6 Å²	6	43.9 Å²	43.9	3%	0.031	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-82.7	11	-179.5	-55.3	-179	0	0	0	113.2	L119 Y121 P122 C130 F133 I402 M407	L119-L124 HydrophobicContact CB-CD1 4.27Å; L119-L124 HydrophobicContact CD1-CD1 3.5Å; Y121-L124 HydrophobicContact CD2-CD1 4.12Å; Y121-L124 HydrophobicContact CG-CD1 4.46Å; Y121-L124 PolarHBondContact O-N 2.71Å; P122-L124 PolarHBondContact O-N 3.23Å; L124-C130 PolarHBondContact O-SG 2.93Å; L124-F133 HydrophobicContact CD2-CB 3.72Å; L124-F133 HydrophobicContact CD2-CG 4.07Å; L124-I402 HydrophobicContact CD1-CD1 3.81Å; L124-M407 HydrophobicContact CD1-CE 4.04Å; L124-M407 HydrophobicContact CD1-SD 4Å; L124-M407 HydrophobicContact CD2-CE 4.35Å; L124-M407 HydrophobicContact CG-CE 4.14Å
125	Y	93.1	Very high	93.6	Very high	87 Å²	87	44.2 Å²	44.2	34%	0.341	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	-88.6	-19.2	170.4	-62.3	-13	0	0	0	112.5	L118 L119 P122 E123 Y183 R293	L118-Y125 HydrophobicContact CD1-CD1 3.71Å; L118-Y125 HydrophobicContact CD1-CE1 3.49Å; L118-Y125 VanDerWaalsContact CD1-CE1 3.49Å; L118-Y125 HydrophobicContact CG-CE1 4.05Å; L119-Y125 WeakPolarHBondContact O-CE1 3.33Å; L119-Y125 PolarHBondContact O-OH 3.41Å; P122-Y125 HydrophobicContact CB-CD2 4.5Å; P122-Y125 WeakPolarHBondContact O-CB 3.35Å; P122-Y125 PolarHBondContact O-N 2.9Å; P122-Y125 VanDerWaalsContact O-N 3.13Å; E123-Y125 PolarHBondContact O-N 2.9Å; Y125-Y183 WeakPolarHBondContact O-CE2 3.25Å; Y125-Y183 PolarHBondContact O-OH 3.45Å; Y125-R293 PolarHBondContact O-NH1 3.34Å
126	S	95.1	Very high	93.4	Very high	41 Å²	41	41.8 Å²	41.8	29%	0.287	23%	0.227	S	C	.	.	S	Bend	trans	-90.4	146.1	174.1	67.6	0	0	0	0	110.3	E123 E128 G129 C130	E123-S126 PolarHBondContact O-N 3.49Å; E123-S126 PolarHBondContact O-OG 3.3Å; S126-E128 PolarHBondContact O-N 3.38Å; S126-G129 PolarHBondContact O-N 2.93Å; S126-G129 PolarHBondContact OG-N 3.09Å; S126-C130 PolarHBondContact O-N 3.37Å; S126-C130 VanDerWaalsContact O-N 3.1Å; S126-C130 PolarHBondContact O-SG 3.49Å; S126-C130 VanDerWaalsContact O-SG 3.4Å
127	W	94.9	Very high	93.3	Very high	42 Å²	42	39.3 Å²	39.3	16%	0.159	21%	0.211	C	C	.	.	H	α-helix	trans	-65.9	-33.4	176.1	71.8	-93	0	0	0	110.7	C130 A131 L178 Y183 I288 F299 I301 S308	W127-C130 PolarHBondContact O-N 3.48Å; W127-A131 HydrophobicContact CE3-CB 4.4Å; W127-A131 WeakPolarHBondContact O-CB 3.34Å; W127-A131 PolarHBondContact O-N 2.83Å; W127-L178 HydrophobicContact CB-CD2 3.61Å; W127-Y183 HydrophobicContact CB-CE1 4.15Å; W127-Y183 HydrophobicContact CB-CE2 4.26Å; W127-Y183 PolarHBondContact N-OH 3.09Å; W127-I288 HydrophobicContact CB-CD1 4.01Å; W127-I288 HydrophobicContact CG-CD1 4.42Å; W127-F299 AromaticContact CD2-CE2 3.92Å; W127-F299 HydrophobicContact CD2-CE2 3.92Å; W127-F299 AromaticContact CD2-CZ 3.82Å; W127-F299 HydrophobicContact CD2-CZ 3.82Å; W127-F299 AromaticContact CE2-CZ 3.84Å; W127-F299 HydrophobicContact CE3-CE2 4.03Å; W127-F299 HydrophobicContact CE3-CZ 4.4Å; W127-F299 HydrophobicContact CG-CE2 4.5Å; W127-F299 HydrophobicContact CG-CZ 4.01Å; W127-F299 HydrophobicContact CH2-CE2 4.5Å; W127-F299 HydrophobicContact CZ2-CE2 4.36Å; W127-F299 HydrophobicContact CZ2-CZ 4.45Å; W127-F299 HydrophobicContact CZ3-CE2 4.33Å; W127-F299 AromaticContact NE1-CZ 4Å; W127-I301 HydrophobicContact CB-CD1 4.39Å; W127-I301 HydrophobicContact CD2-CD1 4.3Å; W127-I301 HydrophobicContact CE3-CD1 3.64Å; W127-I301 HydrophobicContact CE3-CG1 4.05Å; W127-I301 HydrophobicContact CZ3-CD1 4.41Å; W127-I301 HydrophobicContact CZ3-CG1 4.36Å; W127-S308 WeakPolarHBondContact CH2-OG 3.34Å
128	E	95.5	Very high	93.3	Very high	97 Å²	97	39.1 Å²	39.1	45%	0.453	21%	0.21	S	C	.	.	H	α-helix	trans	-60.7	-46	175.6	-63.9	84.6	169.5	0	0	111.1	S126 A131 S132	S126-E128 PolarHBondContact O-N 3.38Å; E128-A131 PolarHBondContact O-N 3.12Å; E128-S132 WeakPolarHBondContact O-CB 3.37Å; E128-S132 PolarHBondContact O-N 2.93Å
129	G	94.3	Very high	93.3	Very high	4 Å²	4	37 Å²	37	4%	0.041	20%	0.203	C	C	.	.	H	α-helix	trans	-66	-43.2	178.8	0	0	0	0	0	112.4	E123 S126 F133	E123-G129 WeakPolarHBondContact O-CA 3.36Å; S126-G129 PolarHBondContact O-N 2.93Å; S126-G129 PolarHBondContact OG-N 3.09Å; G129-F133 VanDerWaalsContact O-CB 3.29Å; G129-F133 WeakPolarHBondContact O-CB 3.49Å; G129-F133 PolarHBondContact O-N 3.5Å
130	C	95.7	Very high	93.4	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-59.9	-48.4	173.2	-66.1	0	0	0	0	111.9	L124 S126 W127 F133 V134 L174 L177 L178	L124-C130 PolarHBondContact O-SG 2.93Å; S126-C130 PolarHBondContact O-N 3.37Å; S126-C130 VanDerWaalsContact O-N 3.1Å; S126-C130 PolarHBondContact O-SG 3.49Å; S126-C130 VanDerWaalsContact O-SG 3.4Å; W127-C130 PolarHBondContact O-N 3.48Å; C130-F133 PolarHBondContact O-N 2.85Å; C130-V134 WeakPolarHBondContact O-CG2 3.38Å; C130-V134 PolarHBondContact O-N 2.82Å; C130-L174 HydrophobicContact CB-CD1 3.74Å; C130-L177 HydrophobicContact CB-CB 4.47Å; C130-L178 HydrophobicContact CB-CD2 4.01Å; C130-L178 HydrophobicContact CB-CG 4.4Å
131	A	96.3	Very high	93.6	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-66.5	-42.8	-177.4	0	0	0	0	0	111.9	W127 E128 S135 L174 I301	W127-A131 HydrophobicContact CE3-CB 4.4Å; W127-A131 WeakPolarHBondContact O-CB 3.34Å; W127-A131 PolarHBondContact O-N 2.83Å; E128-A131 PolarHBondContact O-N 3.12Å; A131-S135 VanDerWaalsContact O-CB 3.26Å; A131-S135 WeakPolarHBondContact O-CB 3.42Å; A131-S135 PolarHBondContact O-N 3.45Å; A131-S135 PolarHBondContact O-OG 2.91Å; A131-L174 HydrophobicContact CB-CD1 4.29Å; A131-L174 HydrophobicContact CB-CD2 4.47Å; A131-I301 HydrophobicContact CB-CG2 3.79Å
132	S	93.9	Very high	93.8	Very high	37 Å²	37	39.4 Å²	39.4	26%	0.259	21%	0.209	S	C	.	.	H	α-helix	trans	-59.5	-51.9	174.4	-175.9	0	0	0	0	110.7	E128 V134 S135 E136	E128-S132 WeakPolarHBondContact O-CB 3.37Å; E128-S132 PolarHBondContact O-N 2.93Å; S132-V134 PolarHBondContact O-N 2.86Å; S132-S135 PolarHBondContact O-N 2.87Å; S132-S135 PolarHBondContact O-OG 2.89Å; S132-E136 WeakPolarHBondContact O-CB 3.38Å; S132-E136 WeakPolarHBondContact O-CG 3.27Å; S132-E136 PolarHBondContact O-N 3.49Å
133	F	93.9	Very high	93.9	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-55.9	-53.9	178.5	174.6	-95.3	0	0	0	112	L124 G129 C130 S135 E136 F137 L177 I402 M407	L124-F133 HydrophobicContact CD2-CB 3.72Å; L124-F133 HydrophobicContact CD2-CG 4.07Å; G129-F133 VanDerWaalsContact O-CB 3.29Å; G129-F133 WeakPolarHBondContact O-CB 3.49Å; G129-F133 PolarHBondContact O-N 3.5Å; C130-F133 PolarHBondContact O-N 2.85Å; F133-S135 VanDerWaalsContact C-N 3.32Å; F133-S135 PolarHBondContact O-N 3.27Å; F133-E136 PolarHBondContact O-N 3.37Å; F133-F137 HydrophobicContact CD1-CB 4.44Å; F133-F137 HydrophobicContact CE1-CB 4.02Å; F133-F137 HydrophobicContact CE1-CD1 4.23Å; F133-F137 HydrophobicContact CE1-CD2 4.43Å; F133-F137 AromaticContact CE1-CG 3.97Å; F133-F137 HydrophobicContact CE1-CG 3.97Å; F133-F137 HydrophobicContact CE2-CB 4.16Å; F133-F137 AromaticContact CE2-CD2 3.92Å; F133-F137 HydrophobicContact CE2-CD2 3.92Å; F133-F137 HydrophobicContact CE2-CG 4.15Å; F133-F137 HydrophobicContact CZ-CB 3.86Å; F133-F137 HydrophobicContact CZ-CD1 4.11Å; F133-F137 AromaticContact CZ-CD2 3.57Å; F133-F137 HydrophobicContact CZ-CD2 3.57Å; F133-F137 HydrophobicContact CZ-CE2 4.11Å; F133-F137 AromaticContact CZ-CG 3.56Å; F133-F137 HydrophobicContact CZ-CG 3.56Å; F133-F137 WeakPolarHBondContact O-CB 3.35Å; F133-F137 PolarHBondContact O-N 2.8Å; F133-L177 HydrophobicContact CD1-CD1 4.42Å; F133-I402 HydrophobicContact CD1-CD1 4.18Å; F133-I402 HydrophobicContact CE1-CD1 3.52Å; F133-I402 HydrophobicContact CE2-CD1 4.29Å; F133-I402 HydrophobicContact CE2-CG2 4.1Å; F133-I402 HydrophobicContact CZ-CD1 3.6Å; F133-I402 HydrophobicContact CZ-CG1 4.4Å; F133-I402 HydrophobicContact CZ-CG2 3.8Å; F133-M407 HydrophobicContact CD2-CE 4.4Å; F133-M407 HydrophobicContact CD2-SD 3.78Å; F133-M407 HydrophobicContact CE2-SD 3.6Å; F133-M407 VanDerWaalsContact CE2-SD 3.6Å; F133-M407 HydrophobicContact CZ-SD 4.37Å
134	V	95.1	Very high	94	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-61.2	-42.8	-178	172.5	0	0	0	0	111.4	C130 S132 E136 F137 L138 F170 L173 L174 L177	C130-V134 WeakPolarHBondContact O-CG2 3.38Å; C130-V134 PolarHBondContact O-N 2.82Å; S132-V134 PolarHBondContact O-N 2.86Å; V134-E136 VanDerWaalsContact C-N 3.33Å; V134-E136 PolarHBondContact O-N 3.16Å; V134-F137 PolarHBondContact O-N 2.78Å; V134-L138 HydrophobicContact CG1-CD1 4.09Å; V134-L138 PolarHBondContact O-N 3.14Å; V134-F170 HydrophobicContact CG1-CB 4.48Å; V134-F170 HydrophobicContact CG1-CD1 3.97Å; V134-F170 HydrophobicContact CG1-CG 4.46Å; V134-L173 HydrophobicContact CG1-CD2 4.28Å; V134-L173 HydrophobicContact CG2-CD2 3.92Å; V134-L173 HydrophobicContact CG2-CG 3.97Å; V134-L174 HydrophobicContact CB-CB 4.47Å; V134-L174 HydrophobicContact CG1-CB 4.32Å; V134-L174 HydrophobicContact CG2-CB 4.14Å; V134-L174 HydrophobicContact CG2-CD1 4.2Å; V134-L177 HydrophobicContact CG2-CD1 3.95Å
135	S	93.8	Very high	94	Very high	9 Å²	9	42.4 Å²	42.4	6%	0.063	23%	0.226	C	C	.	.	H	α-helix	trans	-64.2	-38.7	-179.9	77.4	0	0	0	0	111.9	A131 S132 F133 P303 K416	A131-S135 VanDerWaalsContact O-CB 3.26Å; A131-S135 WeakPolarHBondContact O-CB 3.42Å; A131-S135 PolarHBondContact O-N 3.45Å; A131-S135 PolarHBondContact O-OG 2.91Å; S132-S135 PolarHBondContact O-N 2.87Å; S132-S135 PolarHBondContact O-OG 2.89Å; F133-S135 VanDerWaalsContact C-N 3.32Å; F133-S135 PolarHBondContact O-N 3.27Å; S135-P303 WeakPolarHBondContact CA-O 3.25Å; S135-P303 WeakPolarHBondContact CB-O 3.36Å; S135-K416 PolarHBondContact O-NZ 2.92Å
136	E	91.4	Very high	94	Very high	28 Å²	28	40.1 Å²	40.1	13%	0.131	22%	0.221	C	C	.	.	H	α-helix	trans	-76.5	-39.6	179.4	-68.5	-177.4	158	0	0	111.5	S132 F133 V134 R410 C411 K427	S132-E136 WeakPolarHBondContact O-CB 3.38Å; S132-E136 WeakPolarHBondContact O-CG 3.27Å; S132-E136 PolarHBondContact O-N 3.49Å; F133-E136 PolarHBondContact O-N 3.37Å; V134-E136 VanDerWaalsContact C-N 3.33Å; V134-E136 PolarHBondContact O-N 3.16Å; E136-R410 CarbonylContact C-O 3.43Å; E136-R410 HydrophobicContact CB-CB 4.36Å; E136-R410 WeakPolarHBondContact CB-O 3.4Å; E136-R410 WeakPolarHBondContact OE2-CD 3.48Å; E136-R410 IonicContact OE2-NH1 3.66Å; E136-C411 VanDerWaalsContact O-CA 3.3Å; E136-C411 WeakPolarHBondContact O-CA 3.3Å; E136-C411 VanDerWaalsContact O-CB 3.25Å; E136-C411 WeakPolarHBondContact O-CB 3.49Å; E136-K427 IonicContact OE1-NZ 3.12Å; E136-K427 PolarHBondContact OE1-NZ 2.85Å
137	F	92.4	Very high	94	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-73.6	-35	-170.6	-175.3	-99.9	0	0	0	113.7	F133 V134 M160 Q163 D406 R410 P412	F133-F137 HydrophobicContact CD1-CB 4.44Å; F133-F137 HydrophobicContact CE1-CB 4.02Å; F133-F137 HydrophobicContact CE1-CD1 4.23Å; F133-F137 HydrophobicContact CE1-CD2 4.43Å; F133-F137 AromaticContact CE1-CG 3.97Å; F133-F137 HydrophobicContact CE1-CG 3.97Å; F133-F137 HydrophobicContact CE2-CB 4.16Å; F133-F137 AromaticContact CE2-CD2 3.92Å; F133-F137 HydrophobicContact CE2-CD2 3.92Å; F133-F137 HydrophobicContact CE2-CG 4.15Å; F133-F137 HydrophobicContact CZ-CB 3.86Å; F133-F137 HydrophobicContact CZ-CD1 4.11Å; F133-F137 AromaticContact CZ-CD2 3.57Å; F133-F137 HydrophobicContact CZ-CD2 3.57Å; F133-F137 HydrophobicContact CZ-CE2 4.11Å; F133-F137 AromaticContact CZ-CG 3.56Å; F133-F137 HydrophobicContact CZ-CG 3.56Å; F133-F137 WeakPolarHBondContact O-CB 3.35Å; F133-F137 PolarHBondContact O-N 2.8Å; V134-F137 PolarHBondContact O-N 2.78Å; F137-M160 HydrophobicContact CD1-CE 3.83Å; F137-M160 HydrophobicContact CE1-CE 3.38Å; F137-M160 HydrophobicContact CE1-SD 3.86Å; F137-M160 HydrophobicContact CZ-CE 4.2Å; F137-M160 HydrophobicContact CZ-SD 4.08Å; F137-Q163 HydrophobicContact CE1-CB 4.48Å; F137-Q163 HydrophobicContact CE1-CG 3.88Å; F137-Q163 HydrophobicContact CE2-CG 4.16Å; F137-Q163 HydrophobicContact CZ-CG 3.66Å; F137-D406 HydrophobicContact CE2-CB 3.77Å; F137-D406 HydrophobicContact CZ-CB 4.47Å; F137-R410 WeakPolarHBondContact CA-O 3.42Å; F137-R410 PolarHBondContact N-O 2.84Å; F137-P412 WeakPolarHBondContact O-CD 3.33Å; F137-P412 WeakPolarHBondContact O-CG 3.2Å
138	L	93.4	Very high	93.8	Very high	2 Å²	2	41.8 Å²	41.8	1%	0.01	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-101.3	143.1	-177	-61.7	-178.8	0	0	0	112.2	V134 L159 F170 L173	V134-L138 HydrophobicContact CG1-CD1 4.09Å; V134-L138 PolarHBondContact O-N 3.14Å; L138-L159 HydrophobicContact CD1-CD1 4.49Å; L138-L159 HydrophobicContact CD2-CB 4.17Å; L138-F170 HydrophobicContact CB-CD1 4.12Å; L138-F170 HydrophobicContact CB-CD2 4.02Å; L138-F170 HydrophobicContact CB-CE1 3.54Å; L138-F170 HydrophobicContact CB-CE2 3.43Å; L138-F170 VanDerWaalsContact CB-CE2 3.43Å; L138-F170 HydrophobicContact CB-CG 4.37Å; L138-F170 HydrophobicContact CB-CZ 3.19Å; L138-F170 HydrophobicContact CD1-CB 4.46Å; L138-F170 HydrophobicContact CD1-CD1 4.09Å; L138-F170 HydrophobicContact CD1-CD2 3.68Å; L138-F170 HydrophobicContact CD1-CE1 4.36Å; L138-F170 HydrophobicContact CD1-CE2 3.98Å; L138-F170 HydrophobicContact CD1-CG 3.79Å; L138-F170 HydrophobicContact CD1-CZ 4.34Å; L138-F170 HydrophobicContact CG-CE2 4.36Å; L138-F170 HydrophobicContact CG-CZ 4.39Å; L138-F170 WeakPolarHBondContact O-CZ 3.4Å; L138-L173 HydrophobicContact CD1-CD2 3.87Å; L138-L173 HydrophobicContact CG-CD2 4.34Å
139	S	93.3	Very high	93.7	Very high	50 Å²	50	39 Å²	39	35%	0.35	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	131.5	166.4	-78.6	0	0	0	0	110.9	K141 Q163 R164 G165	S139-K141 PolarHBondContact O-N 3.19Å; S139-Q163 PolarHBondContact N-O 3.36Å; S139-R164 WeakPolarHBondContact O-CA 3.48Å; S139-G165 PolarHBondContact O-N 3.13Å
140	L	94.5	Very high	93.7	Very high	40 Å²	40	39.6 Å²	39.6	21%	0.209	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	127.3	-179.7	175.6	65.5	0	0	0	111.2	P142 G165 L199 L304	L140-P142 HydrophobicContact CD2-CG 4.45Å; L140-P142 HydrophobicContact CG-CG 4.39Å; L140-G165 CarbonylContact C-O 3.57Å; L140-G165 WeakPolarHBondContact CA-O 3.26Å; L140-L199 HydrophobicContact CB-CD2 4.43Å; L140-L199 HydrophobicContact CD2-CB 3.75Å; L140-L304 HydrophobicContact CD1-CD1 4.11Å; L140-L304 HydrophobicContact CD1-CD2 3.84Å; L140-L304 HydrophobicContact CD2-CD1 4.03Å
141	K	94.5	Very high	93.6	Very high	135 Å²	135	49.8 Å²	49.8	59%	0.587	26%	0.262	S	S	*	.			trans	-103.6	107.7	159.2	-174.2	178.2	178.8	-178.2	0	108.1	S139 G165 S166	S139-K141 PolarHBondContact O-N 3.19Å; K141-G165 PolarHBondContact N-O 3.05Å; K141-S166 WeakPolarHBondContact O-CA 3.22Å
142	P	93.8	Very high	93.5	Very high	70 Å²	70	53.2 Å²	53.2	46%	0.455	28%	0.278	S	S	.	.			trans	-58.6	152.2	179	-24.4	34.6	0	0	0	112.1	L140 L198	L140-P142 HydrophobicContact CD2-CG 4.45Å; L140-P142 HydrophobicContact CG-CG 4.39Å; P142-L198 HydrophobicContact CB-CD2 4.39Å
143	L	94.3	Very high	93.6	Very high	28 Å²	28	51.6 Å²	51.6	15%	0.147	27%	0.266	C	S	.	.			trans	-68.6	137.4	173.1	-63.3	177.3	0	0	0	110.2	P150 F168 V282	L143-P150 HydrophobicContact CD2-CB 3.89Å; L143-P150 HydrophobicContact CD2-CG 4.31Å; L143-F168 HydrophobicContact CD1-CD2 4.42Å; L143-F168 HydrophobicContact CD1-CE2 4.02Å; L143-V282 HydrophobicContact CD1-CB 4.42Å; L143-V282 HydrophobicContact CD1-CG1 4.45Å
144	D	91	Very high	93.7	Very high	159 Å²	159	54.2 Å²	54.2	85%	0.85	28%	0.276	S	S	*	.	S	Bend	trans	-136.1	108.5	176.1	-172.5	20.7	0	0	0	109.9
145	P	93	Very high	93.7	Very high	61 Å²	61	54.2 Å²	54.2	40%	0.396	28%	0.276	S	S	.	.	S	Bend	cis	-72.9	156	-2	32.5	-36.4	0	0	0	112.6	I147 D148	P145-I147 HydrophobicContact CB-CG1 4.28Å; P145-I147 HydrophobicContact CG-CG1 4.47Å; P145-I147 PolarHBondContact O-N 2.8Å; P145-D148 HydrophobicContact CG-CB 4.29Å; P145-D148 WeakPolarHBondContact CG-OD2 3.38Å
146	P	93.9	Very high	93.8	Very high	39 Å²	39	53.8 Å²	53.8	25%	0.253	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-4.5	-174.7	31.1	-37.5	0	0	0	114.7	L277 R281 V282	P146-L277 HydrophobicContact CG-CD1 4.08Å; P146-R281 WeakPolarHBondContact O-CA 3.43Å; P146-V282 PolarHBondContact O-N 3.33Å
147	I	94.4	Very high	93.8	Very high	53 Å²	53	53.6 Å²	53.6	27%	0.272	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-12.3	-175.5	61.9	173.3	0	0	0	112.8	K94 P145 L277 L280 V282	K94-I147 PolarHBondContact NZ-O 2.91Å; P145-I147 HydrophobicContact CB-CG1 4.28Å; P145-I147 HydrophobicContact CG-CG1 4.47Å; P145-I147 PolarHBondContact O-N 2.8Å; I147-L277 HydrophobicContact CG2-CD1 4.19Å; I147-L277 HydrophobicContact CG2-CD2 4.31Å; I147-L280 WeakPolarHBondContact CA-O 3.43Å; I147-L280 HydrophobicContact CG2-CB 4.23Å; I147-V282 WeakPolarHBondContact O-CG2 3.5Å
148	D	92.5	Very high	93.8	Very high	66 Å²	66	55.8 Å²	55.8	35%	0.353	28%	0.282	S	S	.	.	S	Bend	trans	-114.2	147.1	-175.5	-64.3	-28.6	0	0	0	110.1	K94 P145	K94-D148 IonicContact NZ-OD1 3.37Å; K94-D148 PolarHBondContact NZ-OD1 3.29Å; P145-D148 HydrophobicContact CG-CB 4.29Å; P145-D148 WeakPolarHBondContact CG-OD2 3.38Å
149	P	92.5	Very high	93.8	Very high	37 Å²	37	55.7 Å²	55.7	24%	0.24	28%	0.282	C	S	.	.			trans	-63.7	154.5	171.7	29.5	-35.1	0	0	0	110.5	L97 F168 V282	L97-P149 HydrophobicContact CB-CB 4.03Å; L97-P149 HydrophobicContact CB-CG 4.5Å; L97-P149 HydrophobicContact CD1-CB 4.15Å; L97-P149 HydrophobicContact CD2-CB 4.28Å; L97-P149 HydrophobicContact CG-CB 4.38Å; P149-F168 HydrophobicContact CB-CZ 4.45Å; P149-V282 HydrophobicContact CB-CG1 4.47Å
150	P	94.3	Very high	93.7	Very high	18 Å²	18	54.3 Å²	54.3	12%	0.117	27%	0.27	C	S	.	.			trans	-67.9	138.6	-174.9	29.5	-36.7	0	0	0	111.5	L97 L143 H152 F168	L97-P150 WeakPolarHBondContact CD1-O 3.28Å; L97-P150 HydrophobicContact CD2-CG 4.3Å; L143-P150 HydrophobicContact CD2-CB 3.89Å; L143-P150 HydrophobicContact CD2-CG 4.31Å; P150-H152 VanDerWaalsContact C-N 3.26Å; P150-H152 WeakPolarHBondContact CB-O 3.37Å; P150-H152 PolarHBondContact O-N 2.79Å; P150-F168 VanDerWaalsContact CD-CD2 3.42Å; P150-F168 VanDerWaalsContact CD-CE2 3.41Å; P150-F168 HydrophobicContact CG-CB 4.01Å; P150-F168 HydrophobicContact CG-CD1 4.28Å; P150-F168 HydrophobicContact CG-CD2 3.6Å; P150-F168 HydrophobicContact CG-CE2 4.13Å; P150-F168 HydrophobicContact CG-CG 3.7Å
151	R	93.2	Very high	93.4	Very high	213 Å²	213	56.5 Å²	56.5	80%	0.804	28%	0.28	S	S	*	.	S	Bend	trans	-68.3	-28.5	174.2	-65	-176.4	-179.5	-177.8	0.3	112.8	L101	L101-R151 PolarHBondContact N-O 3.16Å
152	H	94.9	Very high	93.2	Very high	73 Å²	73	51.4 Å²	51.4	34%	0.338	26%	0.26	S	S	.	.	B	Isolated β-bridge	trans	-116.8	137.2	178.4	-64.3	80.2	0	0	0	110.3	L101 P150 Y154	L101-H152 CarbonylContact O-C 3.59Å; L101-H152 WeakPolarHBondContact O-CA 3.01Å; P150-H152 VanDerWaalsContact C-N 3.26Å; P150-H152 WeakPolarHBondContact CB-O 3.37Å; P150-H152 PolarHBondContact O-N 2.79Å; H152-Y154 HydrophobicContact CB-CE2 4.08Å
153	L	96.2	Very high	93.1	Very high	2 Å²	2	49.6 Å²	49.6	1%	0.01	25%	0.245	C	C	.	.			trans	-120.9	114.2	169.9	-177.1	66.6	0	0	0	107.8	P100 L101 V110 T113 F168	P100-L153 HydrophobicContact CB-CB 3.92Å; P100-L153 HydrophobicContact CG-CB 3.52Å; P100-L153 HydrophobicContact CG-CD2 4.08Å; P100-L153 HydrophobicContact CG-CG 4.46Å; L101-L153 PolarHBondContact O-N 2.82Å; V110-L153 HydrophobicContact CB-CD2 4.32Å; V110-L153 HydrophobicContact CG1-CD2 3.99Å; T113-L153 HydrophobicContact CG2-CD2 4.18Å; T113-L153 HydrophobicContact CG2-CG 4.35Å; L153-F168 HydrophobicContact CD1-CB 3.79Å
154	Y	95.6	Very high	93	Very high	55 Å²	55	52.9 Å²	52.9	22%	0.216	26%	0.256	C	S	.	.			trans	-84.1	143.4	-173.6	-66.2	-79.9	0	0	0	111.1	E103 H152 W158 D169	E103-Y154 HydrophobicContact CB-CD1 3.92Å; E103-Y154 HydrophobicContact CB-CE1 4.18Å; H152-Y154 HydrophobicContact CB-CE2 4.08Å; Y154-W158 AromaticContact CD1-CD2 3.68Å; Y154-W158 HydrophobicContact CD1-CD2 3.68Å; Y154-W158 AromaticContact CD1-CE2 3.9Å; Y154-W158 AromaticContact CD1-CE3 3.76Å; Y154-W158 HydrophobicContact CD1-CE3 3.76Å; Y154-W158 HydrophobicContact CD1-CG 4.18Å; Y154-W158 HydrophobicContact CD1-CH2 4.27Å; Y154-W158 HydrophobicContact CD1-CZ2 4.2Å; Y154-W158 HydrophobicContact CD1-CZ3 4.04Å; Y154-W158 HydrophobicContact CD2-CE3 4.45Å; Y154-W158 HydrophobicContact CD2-CZ3 4.19Å; Y154-W158 HydrophobicContact CE1-CD2 4.39Å; Y154-W158 HydrophobicContact CE1-CH2 4.31Å; Y154-W158 HydrophobicContact CE1-CZ2 4.11Å; Y154-W158 HydrophobicContact CG-CD2 4.11Å; Y154-W158 AromaticContact CG-CE3 3.7Å; Y154-W158 HydrophobicContact CG-CE3 3.7Å; Y154-W158 HydrophobicContact CG-CH2 4.46Å; Y154-W158 AromaticContact CG-CZ3 3.88Å; Y154-W158 HydrophobicContact CG-CZ3 3.88Å; Y154-D169 PolarHBondContact N-OD1 3.12Å
155	S	94.9	Very high	93.2	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.217	C	C	.	.			trans	-66.9	149.5	177.2	74.9	0	0	0	0	112.4	E103 T157 W158 L159	E103-S155 VanDerWaalsContact OE1-CB 3.24Å; E103-S155 WeakPolarHBondContact OE1-CB 3.49Å; E103-S155 PolarHBondContact OE1-OG 2.78Å; E103-S155 PolarHBondContact OE2-N 3.3Å; E103-S155 VanDerWaalsContact OE2-N 3.17Å; S155-T157 PolarHBondContact O-N 2.74Å; S155-T157 VanDerWaalsContact O-N 3.1Å; S155-T157 PolarHBondContact OG-N 3.09Å; S155-W158 WeakPolarHBondContact O-CB 3.32Å; S155-W158 PolarHBondContact O-N 2.81Å; S155-W158 PolarHBondContact OG-N 3.21Å; S155-W158 VanDerWaalsContact OG-N 3.17Å; S155-L159 WeakPolarHBondContact O-CG 3.39Å; S155-L159 PolarHBondContact O-N 2.79Å; S155-L159 VanDerWaalsContact O-N 3.09Å
156	P	95.3	Very high	93.3	Very high	0 Å²	0	43 Å²	43	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-47.5	-35.5	167.3	-33.2	35.5	0	0	0	114.4	L159 M160 T172 L173 V397 I400	P156-L159 PolarHBondContact O-N 3.26Å; P156-M160 WeakPolarHBondContact O-CG 3.47Å; P156-M160 PolarHBondContact O-N 2.75Å; P156-T172 HydrophobicContact CG-CG2 4.34Å; P156-L173 HydrophobicContact CB-CD1 3.98Å; P156-V397 HydrophobicContact CB-CG1 4.37Å; P156-V397 HydrophobicContact CG-CG1 4.37Å; P156-I400 HydrophobicContact CB-CD1 3.82Å; P156-I400 HydrophobicContact CB-CG1 3.82Å; P156-I400 HydrophobicContact CG-CD1 4.32Å
157	T	92.3	Very high	93.5	Very high	25 Å²	25	41.4 Å²	41.4	15%	0.153	19%	0.191	C	C	.	.	H	α-helix	trans	-64.5	-42.7	177.3	-48.8	0	0	0	0	112.1	Y61 Y65 S155 M160 V397	Y61-T157 HydrophobicContact CE1-CG2 4.15Å; Y65-T157 PolarHBondContact OH-OG1 2.94Å; S155-T157 PolarHBondContact O-N 2.74Å; S155-T157 VanDerWaalsContact O-N 3.1Å; S155-T157 PolarHBondContact OG-N 3.09Å; T157-M160 PolarHBondContact O-N 3.42Å; T157-V397 WeakPolarHBondContact OG1-CG1 3.38Å
158	W	92.6	Very high	93.6	Very high	45 Å²	45	38.9 Å²	38.9	17%	0.17	18%	0.178	C	C	.	.	H	α-helix	trans	-65.2	-41.7	176.4	-172.3	92.5	0	0	0	111.1	E103 Y154 S155 M160 Q161 T162 R164	E103-W158 HydrophobicContact CB-CG 4.34Å; Y154-W158 AromaticContact CD1-CD2 3.68Å; Y154-W158 HydrophobicContact CD1-CD2 3.68Å; Y154-W158 AromaticContact CD1-CE2 3.9Å; Y154-W158 AromaticContact CD1-CE3 3.76Å; Y154-W158 HydrophobicContact CD1-CE3 3.76Å; Y154-W158 HydrophobicContact CD1-CG 4.18Å; Y154-W158 HydrophobicContact CD1-CH2 4.27Å; Y154-W158 HydrophobicContact CD1-CZ2 4.2Å; Y154-W158 HydrophobicContact CD1-CZ3 4.04Å; Y154-W158 HydrophobicContact CD2-CE3 4.45Å; Y154-W158 HydrophobicContact CD2-CZ3 4.19Å; Y154-W158 HydrophobicContact CE1-CD2 4.39Å; Y154-W158 HydrophobicContact CE1-CH2 4.31Å; Y154-W158 HydrophobicContact CE1-CZ2 4.11Å; Y154-W158 HydrophobicContact CG-CD2 4.11Å; Y154-W158 AromaticContact CG-CE3 3.7Å; Y154-W158 HydrophobicContact CG-CE3 3.7Å; Y154-W158 HydrophobicContact CG-CH2 4.46Å; Y154-W158 AromaticContact CG-CZ3 3.88Å; Y154-W158 HydrophobicContact CG-CZ3 3.88Å; S155-W158 WeakPolarHBondContact O-CB 3.32Å; S155-W158 PolarHBondContact O-N 2.81Å; S155-W158 PolarHBondContact OG-N 3.21Å; S155-W158 VanDerWaalsContact OG-N 3.17Å; W158-M160 VanDerWaalsContact C-N 3.32Å; W158-M160 PolarHBondContact O-N 3.18Å; W158-Q161 PolarHBondContact O-N 3Å; W158-T162 HydrophobicContact CD2-CG2 3.84Å; W158-T162 HydrophobicContact CE3-CG2 4.12Å; W158-T162 HydrophobicContact CH2-CG2 3.82Å; W158-T162 WeakPolarHBondContact CH2-OG1 3.44Å; W158-T162 HydrophobicContact CZ2-CG2 3.51Å; W158-T162 HydrophobicContact CZ3-CG2 4.13Å; W158-T162 WeakPolarHBondContact CZ3-OG1 3.49Å; W158-T162 PolarHBondContact O-N 3.22Å; W158-T162 PolarHBondContact O-OG1 3.47Å; W158-R164 VanDerWaalsContact CZ3-O 3.31Å; W158-R164 WeakPolarHBondContact CZ3-O 3.49Å
159	L	92.8	Very high	93.8	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-62.4	-35.9	177.7	-61.6	173.5	0	0	0	113.1	L138 S155 P156 Q161 Q163 R164 D169 L173	L138-L159 HydrophobicContact CD1-CD1 4.49Å; L138-L159 HydrophobicContact CD2-CB 4.17Å; S155-L159 WeakPolarHBondContact O-CG 3.39Å; S155-L159 PolarHBondContact O-N 2.79Å; S155-L159 VanDerWaalsContact O-N 3.09Å; P156-L159 PolarHBondContact O-N 3.26Å; L159-Q161 PolarHBondContact O-N 2.9Å; L159-Q163 WeakPolarHBondContact O-CA 3.45Å; L159-Q163 PolarHBondContact O-N 2.75Å; L159-R164 VanDerWaalsContact CD2-O 3.22Å; L159-R164 WeakPolarHBondContact CD2-O 3.21Å; L159-D169 HydrophobicContact CD1-CB 3.78Å; L159-D169 WeakPolarHBondContact CD1-O 3.25Å; L159-D169 HydrophobicContact CD2-CB 3.72Å; L159-D169 HydrophobicContact CG-CB 4.35Å; L159-L173 HydrophobicContact CD1-CB 4.09Å
160	M	90.9	Very high	94.1	Very high	21 Å²	21	34.1 Å²	34.1	10%	0.103	15%	0.15	C	C	.	.	H	α-helix	trans	-62.1	-30.4	174.6	-69.2	-58	97.1	0	0	112.4	F137 P156 T157 W158 L173 I400 I402	F137-M160 HydrophobicContact CD1-CE 3.83Å; F137-M160 HydrophobicContact CE1-CE 3.38Å; F137-M160 HydrophobicContact CE1-SD 3.86Å; F137-M160 HydrophobicContact CZ-CE 4.2Å; F137-M160 HydrophobicContact CZ-SD 4.08Å; P156-M160 WeakPolarHBondContact O-CG 3.47Å; P156-M160 PolarHBondContact O-N 2.75Å; T157-M160 PolarHBondContact O-N 3.42Å; W158-M160 VanDerWaalsContact C-N 3.32Å; W158-M160 PolarHBondContact O-N 3.18Å; M160-L173 HydrophobicContact CE-CD1 3.72Å; M160-L173 HydrophobicContact CE-CD2 3.34Å; M160-L173 HydrophobicContact CE-CG 4.18Å; M160-I400 HydrophobicContact CG-CG2 4.4Å; M160-I400 HydrophobicContact SD-CG2 4.43Å; M160-I402 HydrophobicContact SD-CG1 4.1Å
161	Q	89.2	Confident	94.3	Very high	87 Å²	87	33.3 Å²	33.3	41%	0.407	15%	0.145	S	C	.	.	H	α-helix	trans	-86.4	-41.3	-178.8	-65.1	176.5	-7.7	0	0	112.5	V56 Y61 W158 L159	V56-Q161 HydrophobicContact CG2-CB 4.3Å; Y61-Q161 PolarHBondContact OH-OE1 3.26Å; W158-Q161 PolarHBondContact O-N 3Å; L159-Q161 PolarHBondContact O-N 2.9Å
162	T	89.6	Confident	94.5	Very high	28 Å²	28	23.1 Å²	23.1	17%	0.172	11%	0.107	C	C	.	.	H	α-helix	trans	-95.7	-20.5	-172.4	63.8	0	0	0	0	114.1	V56 W158 R164	V56-T162 HydrophobicContact CG2-CG2 3.55Å; W158-T162 HydrophobicContact CD2-CG2 3.84Å; W158-T162 HydrophobicContact CE3-CG2 4.12Å; W158-T162 HydrophobicContact CH2-CG2 3.82Å; W158-T162 WeakPolarHBondContact CH2-OG1 3.44Å; W158-T162 HydrophobicContact CZ2-CG2 3.51Å; W158-T162 HydrophobicContact CZ3-CG2 4.13Å; W158-T162 WeakPolarHBondContact CZ3-OG1 3.49Å; W158-T162 PolarHBondContact O-N 3.22Å; W158-T162 PolarHBondContact O-OG1 3.47Å; T162-R164 WeakPolarHBondContact O-CG 3.23Å; T162-R164 PolarHBondContact O-N 3Å; T162-R164 VanDerWaalsContact O-N 3.09Å
163	Q	92.4	Very high	94.6	Very high	32 Å²	32	19.7 Å²	19.7	15%	0.15	9%	0.09	C	C	.	.			trans	51.3	29.9	-177.4	-50.6	-178.5	-46.9	0	0	114.2	F137 S139 L159 P412	F137-Q163 HydrophobicContact CE1-CB 4.48Å; F137-Q163 HydrophobicContact CE1-CG 3.88Å; F137-Q163 HydrophobicContact CE2-CG 4.16Å; F137-Q163 HydrophobicContact CZ-CG 3.66Å; S139-Q163 PolarHBondContact N-O 3.36Å; L159-Q163 WeakPolarHBondContact O-CA 3.45Å; L159-Q163 PolarHBondContact O-N 2.75Å; Q163-P412 HydrophobicContact CB-CB 4.3Å; Q163-P412 HydrophobicContact CB-CG 3.73Å; Q163-P412 VanDerWaalsContact OE1-CA 3.27Å
164	R	91.8	Very high	94.7	Very high	96 Å²	96	19.6 Å²	19.6	36%	0.362	9%	0.09	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	138.5	-178.1	-70.7	175	-178	-149.4	-15.3	109	E51 S139 W158 L159 T162	E51-R164 IonicContact OE1-CZ 3.71Å; E51-R164 IonicContact OE1-NH1 2.91Å; E51-R164 IonicContact OE1-NH2 3.59Å; E51-R164 PolarHBondContact OE1-NH2 3.39Å; E51-R164 IonicContact OE2-CZ 2.85Å; E51-R164 IonicContact OE2-NH1 3.65Å; E51-R164 PolarHBondContact OE2-NH1 2.99Å; E51-R164 IonicContact OE2-NH2 3.24Å; E51-R164 PolarHBondContact OE2-NH2 3.46Å; S139-R164 WeakPolarHBondContact O-CA 3.48Å; W158-R164 VanDerWaalsContact CZ3-O 3.31Å; W158-R164 WeakPolarHBondContact CZ3-O 3.49Å; L159-R164 VanDerWaalsContact CD2-O 3.22Å; L159-R164 WeakPolarHBondContact CD2-O 3.21Å; T162-R164 WeakPolarHBondContact O-CG 3.23Å; T162-R164 PolarHBondContact O-N 3Å; T162-R164 VanDerWaalsContact O-N 3.09Å
165	G	93.9	Very high	94.8	Very high	3 Å²	3	17 Å²	17	3%	0.031	8%	0.08	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.9	163.7	-179.8	0	0	0	0	0	113.7	S139 L140 K141 F170	S139-G165 PolarHBondContact O-N 3.13Å; L140-G165 CarbonylContact C-O 3.57Å; L140-G165 WeakPolarHBondContact CA-O 3.26Å; K141-G165 PolarHBondContact N-O 3.05Å; G165-F170 WeakPolarHBondContact O-CE2 3.41Å
166	S	96.3	Very high	95	Very high	10 Å²	10	17 Å²	17	7%	0.07	8%	0.08	C	C	.	.			trans	-79.5	170.5	169.2	72	0	0	0	0	111.6	K141 F168 D169 F170	K141-S166 WeakPolarHBondContact O-CA 3.22Å; S166-F168 PolarHBondContact O-N 3.33Å; S166-F168 VanDerWaalsContact O-N 3.12Å; S166-F168 PolarHBondContact OG-N 2.8Å; S166-D169 WeakPolarHBondContact CB-OD2 3.1Å; S166-D169 PolarHBondContact N-OD2 2.85Å; S166-D169 WeakPolarHBondContact O-CB 3.43Å; S166-D169 PolarHBondContact O-N 3.46Å; S166-D169 PolarHBondContact OG-N 2.85Å; S166-D169 PolarHBondContact OG-OD2 3.47Å; S166-F170 WeakPolarHBondContact O-CD2 3.45Å; S166-F170 PolarHBondContact O-N 3.19Å
167	C	96.9	Very high	95.1	Very high	5 Å²	5	17.2 Å²	17.2	3%	0.034	8%	0.081	C	C	.	.	H	α-helix	trans	-56.6	-27.3	174.6	58.4	0	0	0	0	114.1	S171 H283 C284 L304	C167-S171 WeakPolarHBondContact O-CB 3.42Å; C167-S171 PolarHBondContact O-N 3.09Å; C167-S171 VanDerWaalsContact O-N 3.1Å; C167-S171 PolarHBondContact O-OG 2.96Å; C167-H283 WeakPolarHBondContact CB-CE1 3.48Å; C167-H283 WeakPolarHBondContact CB-ND1 3.37Å; C167-H283 PolarHBondContact SG-ND1 3.45Å; C167-H283 VanDerWaalsContact SG-ND1 3.43Å; C167-C284 PolarHBondContact SG-N 3.41Å; C167-L304 HydrophobicContact CB-CD2 4.44Å
168	F	97.8	Very high	95.3	Very high	0 Å²	0	16 Å²	16	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-72.9	-40	174.4	-73.3	-99.6	0	0	0	112.1	L97 L143 P149 P150 L153 S166 S171 T172 V282 C284 W323	L97-F168 HydrophobicContact CD2-CD1 3.53Å; L97-F168 HydrophobicContact CD2-CE1 3.45Å; L97-F168 VanDerWaalsContact CD2-CE1 3.45Å; L97-F168 HydrophobicContact CD2-CG 4.44Å; L97-F168 HydrophobicContact CD2-CZ 4.31Å; L143-F168 HydrophobicContact CD1-CD2 4.42Å; L143-F168 HydrophobicContact CD1-CE2 4.02Å; P149-F168 HydrophobicContact CB-CZ 4.45Å; P150-F168 VanDerWaalsContact CD-CD2 3.42Å; P150-F168 VanDerWaalsContact CD-CE2 3.41Å; P150-F168 HydrophobicContact CG-CB 4.01Å; P150-F168 HydrophobicContact CG-CD1 4.28Å; P150-F168 HydrophobicContact CG-CD2 3.6Å; P150-F168 HydrophobicContact CG-CE2 4.13Å; P150-F168 HydrophobicContact CG-CG 3.7Å; L153-F168 HydrophobicContact CD1-CB 3.79Å; S166-F168 PolarHBondContact O-N 3.33Å; S166-F168 VanDerWaalsContact O-N 3.12Å; S166-F168 PolarHBondContact OG-N 2.8Å; F168-S171 PolarHBondContact O-N 3.42Å; F168-T172 WeakPolarHBondContact O-CB 3.28Å; F168-T172 PolarHBondContact O-N 2.88Å; F168-T172 PolarHBondContact O-OG1 3.37Å; F168-V282 HydrophobicContact CE2-CG1 3.8Å; F168-V282 HydrophobicContact CZ-CG1 3.64Å; F168-C284 HydrophobicContact CB-CB 4.18Å; F168-C284 HydrophobicContact CD1-CB 3.55Å; F168-C284 HydrophobicContact CD2-CB 3.67Å; F168-C284 HydrophobicContact CE1-CB 3.71Å; F168-C284 HydrophobicContact CE2-CB 3.81Å; F168-C284 HydrophobicContact CG-CB 3.52Å; F168-C284 HydrophobicContact CZ-CB 3.83Å; F168-W323 HydrophobicContact CD1-CH2 4.05Å; F168-W323 HydrophobicContact CD1-CZ2 4.5Å; F168-W323 HydrophobicContact CE1-CH2 4.06Å
169	D	97.4	Very high	95.5	Very high	3 Å²	3	14.8 Å²	14.8	2%	0.016	7%	0.07	C	C	.	.	H	α-helix	trans	-65.7	-43.6	177.5	-58.2	-51.7	0	0	0	110.7	Y154 L159 S166 S171 T172 L173	Y154-D169 PolarHBondContact N-OD1 3.12Å; L159-D169 HydrophobicContact CD1-CB 3.78Å; L159-D169 WeakPolarHBondContact CD1-O 3.25Å; L159-D169 HydrophobicContact CD2-CB 3.72Å; L159-D169 HydrophobicContact CG-CB 4.35Å; S166-D169 WeakPolarHBondContact CB-OD2 3.1Å; S166-D169 PolarHBondContact N-OD2 2.85Å; S166-D169 WeakPolarHBondContact O-CB 3.43Å; S166-D169 PolarHBondContact O-N 3.46Å; S166-D169 PolarHBondContact OG-N 2.85Å; S166-D169 PolarHBondContact OG-OD2 3.47Å; D169-S171 PolarHBondContact O-N 3.02Å; D169-T172 PolarHBondContact O-N 2.94Å; D169-L173 PolarHBondContact O-N 3.1Å
170	F	97.8	Very high	95.6	Very high	1 Å²	1	15.7 Å²	15.7	0%	0.004	8%	0.08	C	C	.	.	H	α-helix	trans	-57	-49.5	173	-88.4	-114.1	0	0	0	111.8	V134 L138 G165 S166 T172 L173 L174 P303 L304	V134-F170 HydrophobicContact CG1-CB 4.48Å; V134-F170 HydrophobicContact CG1-CD1 3.97Å; V134-F170 HydrophobicContact CG1-CG 4.46Å; L138-F170 HydrophobicContact CB-CD1 4.12Å; L138-F170 HydrophobicContact CB-CD2 4.02Å; L138-F170 HydrophobicContact CB-CE1 3.54Å; L138-F170 HydrophobicContact CB-CE2 3.43Å; L138-F170 VanDerWaalsContact CB-CE2 3.43Å; L138-F170 HydrophobicContact CB-CG 4.37Å; L138-F170 HydrophobicContact CB-CZ 3.19Å; L138-F170 HydrophobicContact CD1-CB 4.46Å; L138-F170 HydrophobicContact CD1-CD1 4.09Å; L138-F170 HydrophobicContact CD1-CD2 3.68Å; L138-F170 HydrophobicContact CD1-CE1 4.36Å; L138-F170 HydrophobicContact CD1-CE2 3.98Å; L138-F170 HydrophobicContact CD1-CG 3.79Å; L138-F170 HydrophobicContact CD1-CZ 4.34Å; L138-F170 HydrophobicContact CG-CE2 4.36Å; L138-F170 HydrophobicContact CG-CZ 4.39Å; L138-F170 WeakPolarHBondContact O-CZ 3.4Å; G165-F170 WeakPolarHBondContact O-CE2 3.41Å; S166-F170 WeakPolarHBondContact O-CD2 3.45Å; S166-F170 PolarHBondContact O-N 3.19Å; F170-T172 VanDerWaalsContact C-N 3.34Å; F170-T172 PolarHBondContact O-N 2.79Å; F170-L173 PolarHBondContact O-N 3.14Å; F170-L174 WeakPolarHBondContact O-CB 3.35Å; F170-L174 PolarHBondContact O-N 3.04Å; F170-P303 HydrophobicContact CB-CB 3.97Å; F170-P303 HydrophobicContact CB-CG 4.03Å; F170-L304 HydrophobicContact CB-CD2 4.18Å; F170-L304 HydrophobicContact CD1-CD2 3.54Å; F170-L304 HydrophobicContact CD2-CD2 3.97Å; F170-L304 HydrophobicContact CE1-CD2 3.67Å; F170-L304 HydrophobicContact CE2-CD2 4.08Å; F170-L304 HydrophobicContact CG-CD2 3.65Å; F170-L304 HydrophobicContact CZ-CD2 3.91Å
171	S	98.1	Very high	95.8	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-63.8	-39.9	179	-60.5	0	0	0	0	112	C167 F168 D169 L174 C175 C187 C284 W285 P303	C167-S171 WeakPolarHBondContact O-CB 3.42Å; C167-S171 PolarHBondContact O-N 3.09Å; C167-S171 VanDerWaalsContact O-N 3.1Å; C167-S171 PolarHBondContact O-OG 2.96Å; F168-S171 PolarHBondContact O-N 3.42Å; D169-S171 PolarHBondContact O-N 3.02Å; S171-L174 PolarHBondContact O-N 2.64Å; S171-C175 WeakPolarHBondContact O-CB 3.45Å; S171-C175 PolarHBondContact O-N 3.47Å; S171-C187 PolarHBondContact O-SG 3.3Å; S171-C284 WeakPolarHBondContact CB-SG 3.5Å; S171-C284 PolarHBondContact OG-O 3.01Å; S171-C284 PolarHBondContact OG-SG 3.28Å; S171-C284 VanDerWaalsContact OG-SG 3.4Å; S171-W285 WeakPolarHBondContact OG-CA 3.45Å; S171-W285 PolarHBondContact OG-N 3.22Å; S171-P303 WeakPolarHBondContact OG-CG 3.33Å
172	T	97.7	Very high	96	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-64.2	-44.9	179.8	-60.3	0	0	0	0	111.4	T113 L114 P156 F168 D169 F170 S176	T113-T172 HydrophobicContact CG2-CG2 3.8Å; L114-T172 HydrophobicContact CD2-CG2 3.92Å; L114-T172 WeakPolarHBondContact CD2-O 3.47Å; P156-T172 HydrophobicContact CG-CG2 4.34Å; F168-T172 WeakPolarHBondContact O-CB 3.28Å; F168-T172 PolarHBondContact O-N 2.88Å; F168-T172 PolarHBondContact O-OG1 3.37Å; D169-T172 PolarHBondContact O-N 2.94Å; F170-T172 VanDerWaalsContact C-N 3.34Å; F170-T172 PolarHBondContact O-N 2.79Å; T172-S176 VanDerWaalsContact O-CB 3.3Å; T172-S176 WeakPolarHBondContact O-CB 3.46Å; T172-S176 PolarHBondContact O-N 2.66Å; T172-S176 PolarHBondContact O-OG 3.15Å
173	L	97.5	Very high	96.4	Very high	0 Å²	0	12 Å²	12	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-63.7	-50.1	174.5	177.2	63.2	0	0	0	111.2	V134 L138 P156 L159 M160 D169 F170 C175 S176 L177 I400	V134-L173 HydrophobicContact CG1-CD2 4.28Å; V134-L173 HydrophobicContact CG2-CD2 3.92Å; V134-L173 HydrophobicContact CG2-CG 3.97Å; L138-L173 HydrophobicContact CD1-CD2 3.87Å; L138-L173 HydrophobicContact CG-CD2 4.34Å; P156-L173 HydrophobicContact CB-CD1 3.98Å; L159-L173 HydrophobicContact CD1-CB 4.09Å; M160-L173 HydrophobicContact CE-CD1 3.72Å; M160-L173 HydrophobicContact CE-CD2 3.34Å; M160-L173 HydrophobicContact CE-CG 4.18Å; D169-L173 PolarHBondContact O-N 3.1Å; F170-L173 PolarHBondContact O-N 3.14Å; L173-C175 PolarHBondContact O-N 2.89Å; L173-S176 WeakPolarHBondContact O-CB 3.29Å; L173-S176 PolarHBondContact O-N 2.97Å; L173-L177 WeakPolarHBondContact O-CG 3.4Å; L173-L177 PolarHBondContact O-N 3.02Å; L173-L177 VanDerWaalsContact O-N 3.1Å; L173-I400 HydrophobicContact CD1-CD1 4.12Å; L173-I400 HydrophobicContact CD1-CG2 4.44Å
174	L	98	Very high	96.5	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-60.3	-48.4	-178.7	178.3	58.1	0	0	0	111.8	C130 A131 V134 F170 S171 S176 L177 L178 V286 I301 P303	C130-L174 HydrophobicContact CB-CD1 3.74Å; A131-L174 HydrophobicContact CB-CD1 4.29Å; A131-L174 HydrophobicContact CB-CD2 4.47Å; V134-L174 HydrophobicContact CB-CB 4.47Å; V134-L174 HydrophobicContact CG1-CB 4.32Å; V134-L174 HydrophobicContact CG2-CB 4.14Å; V134-L174 HydrophobicContact CG2-CD1 4.2Å; F170-L174 WeakPolarHBondContact O-CB 3.35Å; F170-L174 PolarHBondContact O-N 3.04Å; S171-L174 PolarHBondContact O-N 2.64Å; L174-S176 VanDerWaalsContact C-N 3.3Å; L174-S176 PolarHBondContact O-N 3.35Å; L174-L177 PolarHBondContact O-N 2.82Å; L174-L178 HydrophobicContact CD1-CD1 3.88Å; L174-L178 HydrophobicContact CD1-CG 4.04Å; L174-L178 HydrophobicContact CD2-CD1 4.43Å; L174-L178 HydrophobicContact CG-CD1 3.74Å; L174-L178 HydrophobicContact CG-CG 4.35Å; L174-L178 VanDerWaalsContact O-CG 3.3Å; L174-L178 WeakPolarHBondContact O-CG 3.48Å; L174-L178 PolarHBondContact O-N 2.75Å; L174-V286 HydrophobicContact CB-CG2 4.17Å; L174-V286 HydrophobicContact CD2-CB 4.24Å; L174-V286 HydrophobicContact CD2-CG2 3.82Å; L174-V286 HydrophobicContact CG-CG2 4.04Å; L174-I301 HydrophobicContact CD2-CB 4.29Å; L174-I301 HydrophobicContact CD2-CG2 3.72Å; L174-P303 HydrophobicContact CD2-CB 3.78Å
175	C	98	Very high	96.8	Very high	0 Å²	0	7.8 Å²	7.8	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-62.1	-38.1	178.6	-169.2	0	0	0	0	111.3	L114 S171 L173 L177 L178 L179 C187 V286	L114-C175 HydrophobicContact CD2-CB 3.79Å; S171-C175 WeakPolarHBondContact O-CB 3.45Å; S171-C175 PolarHBondContact O-N 3.47Å; L173-C175 PolarHBondContact O-N 2.89Å; C175-L177 PolarHBondContact O-N 3.04Å; C175-L178 PolarHBondContact O-N 3.37Å; C175-L179 VanDerWaalsContact O-CB 3.27Å; C175-L179 WeakPolarHBondContact O-CB 3.41Å; C175-L179 WeakPolarHBondContact O-CD1 3.39Å; C175-L179 WeakPolarHBondContact O-CG 3.29Å; C175-L179 PolarHBondContact O-N 2.81Å; C175-C187 VanDerWaalsContact CB-SG 3.53Å; C175-V286 HydrophobicContact CB-CG2 4.25Å
176	S	97.8	Very high	97	Very high	0 Å²	0	8.4 Å²	8.4	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-61.5	-41.1	175.1	-64.5	0	0	0	0	112.8	L114 R115 P116 T117 T172 L173 L174 G180	L114-S176 WeakPolarHBondContact CA-OG 3.47Å; R115-S176 PolarHBondContact N-OG 3.25Å; R115-S176 WeakPolarHBondContact O-CB 3.5Å; P116-S176 WeakPolarHBondContact CA-O 3.33Å; T117-S176 PolarHBondContact N-O 3.49Å; T172-S176 VanDerWaalsContact O-CB 3.3Å; T172-S176 WeakPolarHBondContact O-CB 3.46Å; T172-S176 PolarHBondContact O-N 2.66Å; T172-S176 PolarHBondContact O-OG 3.15Å; L173-S176 WeakPolarHBondContact O-CB 3.29Å; L173-S176 PolarHBondContact O-N 2.97Å; L174-S176 VanDerWaalsContact C-N 3.3Å; L174-S176 PolarHBondContact O-N 3.35Å; S176-G180 PolarHBondContact O-N 3.22Å; S176-G180 VanDerWaalsContact O-N 3.12Å
177	L	97.3	Very high	97.1	Very high	5 Å²	5	7.9 Å²	7.9	3%	0.026	5%	0.053	C	C	.	.	H	α-helix	trans	-69	-45.3	176.2	-64.5	177.8	0	0	0	111.7	L119 C130 F133 V134 L173 L174 C175 G180 A181 I400	L119-L177 HydrophobicContact CD1-CD2 3.61Å; L119-L177 HydrophobicContact CG-CD2 4.38Å; C130-L177 HydrophobicContact CB-CB 4.47Å; F133-L177 HydrophobicContact CD1-CD1 4.42Å; V134-L177 HydrophobicContact CG2-CD1 3.95Å; L173-L177 WeakPolarHBondContact O-CG 3.4Å; L173-L177 PolarHBondContact O-N 3.02Å; L173-L177 VanDerWaalsContact O-N 3.1Å; L174-L177 PolarHBondContact O-N 2.82Å; C175-L177 PolarHBondContact O-N 3.04Å; L177-G180 PolarHBondContact O-N 2.65Å; L177-A181 PolarHBondContact O-N 3.32Å; L177-I400 HydrophobicContact CD2-CD1 4.26Å; L177-I400 HydrophobicContact CD2-CG2 4.39Å
178	L	97.3	Very high	97.2	Very high	0 Å²	0	7.7 Å²	7.7	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-64	-42.8	179.8	-70.6	169.9	0	0	0	112.3	W127 C130 L174 C175 G180 A181 G182 Y183 A185 V286 I288 I301	W127-L178 HydrophobicContact CB-CD2 3.61Å; C130-L178 HydrophobicContact CB-CD2 4.01Å; C130-L178 HydrophobicContact CB-CG 4.4Å; L174-L178 HydrophobicContact CD1-CD1 3.88Å; L174-L178 HydrophobicContact CD1-CG 4.04Å; L174-L178 HydrophobicContact CD2-CD1 4.43Å; L174-L178 HydrophobicContact CG-CD1 3.74Å; L174-L178 HydrophobicContact CG-CG 4.35Å; L174-L178 VanDerWaalsContact O-CG 3.3Å; L174-L178 WeakPolarHBondContact O-CG 3.48Å; L174-L178 PolarHBondContact O-N 2.75Å; C175-L178 PolarHBondContact O-N 3.37Å; L178-G180 VanDerWaalsContact C-N 3.32Å; L178-G180 PolarHBondContact O-N 2.74Å; L178-A181 CarbonylContact O-C 3.59Å; L178-A181 PolarHBondContact O-N 2.84Å; L178-G182 PolarHBondContact O-N 2.9Å; L178-Y183 HydrophobicContact CB-CD2 4.39Å; L178-Y183 HydrophobicContact CD2-CD2 3.8Å; L178-Y183 HydrophobicContact CD2-CE2 4.21Å; L178-Y183 HydrophobicContact CD2-CG 4.29Å; L178-Y183 PolarHBondContact O-N 3.2Å; L178-A185 HydrophobicContact CB-CB 3.75Å; L178-A185 HydrophobicContact CD1-CB 4.21Å; L178-V286 HydrophobicContact CD1-CG1 3.81Å; L178-I288 HydrophobicContact CD1-CD1 4.09Å; L178-I288 HydrophobicContact CD2-CD1 4.34Å; L178-I301 HydrophobicContact CD1-CD1 4.06Å
179	L	96.6	Very high	97.1	Very high	19 Å²	19	8.1 Å²	8.1	10%	0.099	5%	0.054	C	C	.	.	H	α-helix	trans	-62	-40.9	173.9	-73.2	169.2	0	0	0	111.2	L114 P116 C175 A181 G182 A185 H325	L114-L179 HydrophobicContact CD1-CD1 4.31Å; P116-L179 HydrophobicContact CB-CB 4.06Å; P116-L179 HydrophobicContact CG-CB 4.04Å; P116-L179 HydrophobicContact CG-CD1 4.41Å; C175-L179 VanDerWaalsContact O-CB 3.27Å; C175-L179 WeakPolarHBondContact O-CB 3.41Å; C175-L179 WeakPolarHBondContact O-CD1 3.39Å; C175-L179 WeakPolarHBondContact O-CG 3.29Å; C175-L179 PolarHBondContact O-N 2.81Å; L179-A181 VanDerWaalsContact C-N 3.32Å; L179-A181 PolarHBondContact O-N 2.87Å; L179-G182 WeakPolarHBondContact O-CA 3.33Å; L179-G182 PolarHBondContact O-N 2.77Å; L179-A185 HydrophobicContact CD2-CB 4.35Å; L179-A185 WeakPolarHBondContact CD2-O 3.23Å; L179-A185 HydrophobicContact CG-CB 4.31Å; L179-H325 HydrophobicContact CD1-CB 4.16Å; L179-H325 WeakPolarHBondContact CD1-ND1 3.23Å; L179-H325 WeakPolarHBondContact CD2-ND1 3.2Å
180	G	94.9	Very high	97.1	Very high	20 Å²	20	8 Å²	8	21%	0.206	6%	0.055	C	C	.	.	H	α-helix	trans	-63.9	-36.3	174.1	0	0	0	0	0	113.4	S176 L177 L178 G182	S176-G180 PolarHBondContact O-N 3.22Å; S176-G180 VanDerWaalsContact O-N 3.12Å; L177-G180 PolarHBondContact O-N 2.65Å; L178-G180 VanDerWaalsContact C-N 3.32Å; L178-G180 PolarHBondContact O-N 2.74Å; G180-G182 PolarHBondContact O-N 3.47Å
181	A	94.9	Very high	97	Very high	2 Å²	2	9.9 Å²	9.9	2%	0.017	6%	0.062	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-5.8	169.2	0	0	0	0	0	112.8	L177 L178 L179 Y183 R293	L177-A181 PolarHBondContact O-N 3.32Å; L178-A181 CarbonylContact O-C 3.59Å; L178-A181 PolarHBondContact O-N 2.84Å; L179-A181 VanDerWaalsContact C-N 3.32Å; L179-A181 PolarHBondContact O-N 2.87Å; A181-Y183 HydrophobicContact CB-CD2 3.9Å; A181-Y183 HydrophobicContact CB-CE2 3.96Å; A181-R293 PolarHBondContact O-NE 3.03Å; A181-R293 PolarHBondContact O-NH2 2.81Å
182	G	94.9	Very high	96.8	Very high	34 Å²	34	9.9 Å²	9.9	35%	0.351	6%	0.062	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.8	16.8	176.2	0	0	0	0	0	115.1	L178 L179 G180	L178-G182 PolarHBondContact O-N 2.9Å; L179-G182 WeakPolarHBondContact O-CA 3.33Å; L179-G182 PolarHBondContact O-N 2.77Å; G180-G182 PolarHBondContact O-N 3.47Å
183	Y	96.3	Very high	96.7	Very high	21 Å²	21	11 Å²	11	8%	0.082	7%	0.069	C	C	.	.			trans	-73.7	149	165.6	-67.9	-86.5	0	0	0	110.5	Y125 W127 L178 A181 A185 I288 R293 V295	Y125-Y183 WeakPolarHBondContact O-CE2 3.25Å; Y125-Y183 PolarHBondContact O-OH 3.45Å; W127-Y183 HydrophobicContact CB-CE1 4.15Å; W127-Y183 HydrophobicContact CB-CE2 4.26Å; W127-Y183 PolarHBondContact N-OH 3.09Å; L178-Y183 HydrophobicContact CB-CD2 4.39Å; L178-Y183 HydrophobicContact CD2-CD2 3.8Å; L178-Y183 HydrophobicContact CD2-CE2 4.21Å; L178-Y183 HydrophobicContact CD2-CG 4.29Å; L178-Y183 PolarHBondContact O-N 3.2Å; A181-Y183 HydrophobicContact CB-CD2 3.9Å; A181-Y183 HydrophobicContact CB-CE2 3.96Å; Y183-A185 VanDerWaalsContact C-N 3.3Å; Y183-A185 PolarHBondContact O-N 3.09Å; Y183-I288 HydrophobicContact CD1-CD1 4.42Å; Y183-I288 HydrophobicContact CD1-CG2 4.42Å; Y183-R293 HydrophobicContact CD1-CB 3.76Å; Y183-R293 HydrophobicContact CD1-CG 4.08Å; Y183-R293 HydrophobicContact CD2-CG 4.47Å; Y183-R293 HydrophobicContact CE1-CB 3.57Å; Y183-R293 HydrophobicContact CE1-CG 4.04Å; Y183-R293 HydrophobicContact CE2-CG 4.43Å; Y183-R293 HydrophobicContact CG-CB 4.46Å; Y183-R293 HydrophobicContact CG-CG 4.29Å; Y183-V295 HydrophobicContact CD1-CG2 4.02Å; Y183-V295 HydrophobicContact CE1-CG2 4.03Å
184	N	95.6	Very high	96.5	Very high	41 Å²	41	14.9 Å²	14.9	22%	0.219	9%	0.086	C	C	.	.			trans	-82.4	78.3	171.9	-166.5	5.8	0	0	0	109.4	Y186 L289 N292	N184-Y186 WeakPolarHBondContact OD1-CE2 3.39Å; N184-Y186 VanDerWaalsContact OD1-CZ 3.28Å; N184-Y186 PolarHBondContact OD1-OH 3.3Å; N184-L289 HydrophobicContact CB-CB 4.27Å; N184-L289 PolarHBondContact O-N 3.07Å; N184-N292 HydrophobicContact CB-CB 4.24Å
185	A	97.6	Very high	96.2	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	143.5	-169.9	0	0	0	0	0	113	L178 L179 Y183 V286 L287 N324	L178-A185 HydrophobicContact CB-CB 3.75Å; L178-A185 HydrophobicContact CD1-CB 4.21Å; L179-A185 HydrophobicContact CD2-CB 4.35Å; L179-A185 WeakPolarHBondContact CD2-O 3.23Å; L179-A185 HydrophobicContact CG-CB 4.31Å; Y183-A185 VanDerWaalsContact C-N 3.3Å; Y183-A185 PolarHBondContact O-N 3.09Å; A185-V286 HydrophobicContact CB-CG1 4.22Å; A185-L287 CarbonylContact C-O 3.58Å; A185-L287 WeakPolarHBondContact CA-O 3.46Å; A185-N324 WeakPolarHBondContact O-CB 3.41Å
186	Y	98.3	Very high	96	Very high	15 Å²	15	18.3 Å²	18.3	6%	0.059	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	138.4	-179.6	-58.5	-101.4	0	0	0	110.3	N184 V286 L287 L289 I322 W323 N324 W329 L346	N184-Y186 WeakPolarHBondContact OD1-CE2 3.39Å; N184-Y186 VanDerWaalsContact OD1-CZ 3.28Å; N184-Y186 PolarHBondContact OD1-OH 3.3Å; Y186-V286 CarbonylContact O-C 3.53Å; Y186-V286 VanDerWaalsContact O-CA 3.29Å; Y186-V286 WeakPolarHBondContact O-CA 3.49Å; Y186-L287 PolarHBondContact N-O 3.03Å; Y186-L287 PolarHBondContact O-N 2.85Å; Y186-L289 HydrophobicContact CD2-CD1 4.24Å; Y186-L289 HydrophobicContact CD2-CG 4.19Å; Y186-L289 HydrophobicContact CE2-CD1 3.47Å; Y186-L289 VanDerWaalsContact CE2-CD1 3.47Å; Y186-L289 HydrophobicContact CE2-CG 3.79Å; Y186-I322 HydrophobicContact CD1-CD1 4.14Å; Y186-I322 HydrophobicContact CD1-CG1 4.47Å; Y186-I322 HydrophobicContact CG-CD1 4.37Å; Y186-W323 CarbonylContact C-O 3.51Å; Y186-W323 VanDerWaalsContact CA-O 3.31Å; Y186-W323 WeakPolarHBondContact CA-O 3.25Å; Y186-N324 HydrophobicContact CD1-CB 3.73Å; Y186-N324 HydrophobicContact CE1-CB 3.89Å; Y186-N324 VanDerWaalsContact CE1-ND2 3.26Å; Y186-N324 WeakPolarHBondContact CE1-ND2 3.28Å; Y186-N324 HydrophobicContact CG-CB 4.37Å; Y186-W329 HydrophobicContact CD1-CE3 4.29Å; Y186-W329 AromaticContact CD1-CZ3 3.9Å; Y186-W329 HydrophobicContact CD1-CZ3 3.9Å; Y186-W329 HydrophobicContact CE1-CE3 4.18Å; Y186-W329 AromaticContact CE1-CH2 3.79Å; Y186-W329 HydrophobicContact CE1-CH2 3.79Å; Y186-W329 AromaticContact CE1-CZ3 3.54Å; Y186-W329 HydrophobicContact CE1-CZ3 3.54Å; Y186-L346 HydrophobicContact CD1-CD1 4.17Å; Y186-L346 HydrophobicContact CE1-CD1 3.52Å; Y186-L346 HydrophobicContact CE2-CD1 4.39Å
187	C	98.4	Very high	95.8	Very high	0 Å²	0	19 Å²	19	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	137.2	161.2	-71.9	0	0	0	0	108.9	S171 C175 I322 W323	S171-C187 PolarHBondContact O-SG 3.3Å; C175-C187 VanDerWaalsContact CB-SG 3.53Å; C187-I322 CarbonylContact O-C 3.58Å; C187-I322 WeakPolarHBondContact O-CA 3.15Å; C187-W323 HydrophobicContact CB-CD2 3.77Å; C187-W323 HydrophobicContact CB-CE3 4.26Å; C187-W323 HydrophobicContact CB-CG 4.31Å; C187-W323 HydrophobicContact CB-CH2 3.91Å; C187-W323 HydrophobicContact CB-CZ2 3.4Å; C187-W323 VanDerWaalsContact CB-CZ2 3.4Å; C187-W323 HydrophobicContact CB-CZ3 4.3Å; C187-W323 PolarHBondContact N-O 3.07Å; C187-W323 PolarHBondContact O-N 3.15Å
188	V	98.1	Very high	95.6	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	120.7	-178.8	-177.8	0	0	0	0	108.5	C284 W285 L287 I319 I322	V188-C284 WeakPolarHBondContact O-CA 3.42Å; V188-C284 PolarHBondContact O-SG 2.92Å; V188-W285 HydrophobicContact CB-CD2 4.01Å; V188-W285 HydrophobicContact CB-CG 4.15Å; V188-W285 HydrophobicContact CB-CZ2 4.32Å; V188-W285 HydrophobicContact CG1-CD2 3.99Å; V188-W285 HydrophobicContact CG1-CH2 4.03Å; V188-W285 HydrophobicContact CG1-CZ2 3.42Å; V188-W285 VanDerWaalsContact CG1-CZ2 3.42Å; V188-W285 PolarHBondContact N-O 3.17Å; V188-W285 PolarHBondContact O-N 3.45Å; V188-L287 HydrophobicContact CG2-CB 3.46Å; V188-L287 VanDerWaalsContact CG2-CB 3.46Å; V188-I319 HydrophobicContact CG1-CB 4.31Å; V188-I319 HydrophobicContact CG1-CD1 3.7Å; V188-I319 HydrophobicContact CG1-CG1 3.64Å; V188-I319 HydrophobicContact CG1-CG2 3.81Å; V188-I322 HydrophobicContact CB-CG2 4.18Å; V188-I322 HydrophobicContact CG1-CG2 3.99Å; V188-I322 HydrophobicContact CG2-CG2 3.84Å
189	S	97.4	Very high	95.4	Very high	9 Å²	9	24.3 Å²	24.3	6%	0.063	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	126.7	169.7	177.9	0	0	0	0	109.5	E320 S321	S189-E320 PolarHBondContact O-N 3.38Å; S189-S321 PolarHBondContact N-O 3.19Å; S189-S321 PolarHBondContact O-N 3.03Å
190	G	95.7	Very high	95.1	Very high	2 Å²	2	26.5 Å²	26.5	2%	0.021	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.8	-152.8	-177.7	0	0	0	0	0	112.7	V282 H283 G318	G190-V282 WeakPolarHBondContact O-CA 3.33Å; G190-H283 PolarHBondContact N-O 2.81Å; G190-H283 PolarHBondContact O-N 2.78Å; G190-G318 CarbonylContact C-O 3.52Å; G190-G318 VanDerWaalsContact CA-O 3.26Å; G190-G318 WeakPolarHBondContact CA-O 2.99Å
191	Y	95.8	Very high	94.9	Very high	39 Å²	39	26.4 Å²	26.4	15%	0.153	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	139.2	-175.8	-53.2	-75.3	0	0	0	111.7	G279 R281 V282 L317 G318 E320	Y191-G279 WeakPolarHBondContact CD1-O 3.47Å; Y191-R281 VanDerWaalsContact CA-O 3.3Å; Y191-R281 WeakPolarHBondContact CA-O 3.32Å; Y191-V282 HydrophobicContact CD1-CG2 4.39Å; Y191-V282 HydrophobicContact CE1-CG2 4.03Å; Y191-L317 PolarHBondContact O-N 3.07Å; Y191-G318 PolarHBondContact N-O 3.34Å; Y191-E320 HydrophobicContact CE2-CG 3.69Å; Y191-E320 VanDerWaalsContact CE2-OE1 3.29Å; Y191-E320 WeakPolarHBondContact CE2-OE1 3.05Å
192	A	95.4	Very high	94.5	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.008	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	163.8	178.6	0	0	0	0	0	112.1	M196 R281 H283 C315	A192-M196 HydrophobicContact CB-CB 4.3Å; A192-M196 HydrophobicContact CB-CG 4.36Å; A192-M196 HydrophobicContact CB-SD 3.96Å; A192-R281 PolarHBondContact N-O 2.82Å; A192-H283 HydrophobicContact CB-CB 3.71Å; A192-C315 WeakPolarHBondContact CA-O 3.3Å
193	V	94.3	Very high	94.1	Very high	24 Å²	24	29.6 Å²	29.6	15%	0.145	15%	0.152	C	C	.	.			trans	-64.2	151	175.1	-63.2	0	0	0	0	111.7	E195 M196 C197 C315 L317	V193-E195 PolarHBondContact O-N 2.88Å; V193-E195 VanDerWaalsContact O-N 3.17Å; V193-M196 HydrophobicContact CG2-CB 3.97Å; V193-M196 WeakPolarHBondContact O-CB 3.37Å; V193-M196 PolarHBondContact O-N 3.16Å; V193-C197 PolarHBondContact O-N 3.39Å; V193-C197 VanDerWaalsContact O-N 3.16Å; V193-C315 HydrophobicContact CG2-CB 3.89Å; V193-C315 PolarHBondContact N-O 3.22Å; V193-C315 VanDerWaalsContact N-O 3.1Å; V193-L317 HydrophobicContact CG1-CD1 4.19Å; V193-L317 HydrophobicContact CG1-CD2 4.09Å; V193-L317 HydrophobicContact CG1-CG 4.26Å
194	K	93.8	Very high	93.7	Very high	81 Å²	81	32.3 Å²	32.3	35%	0.352	17%	0.166	S	C	.	.	H	α-helix	trans	-51.2	-42.6	-176.5	-179.6	179.3	176.3	-174.7	0	113.3	M196 C197 L198 D275	K194-M196 VanDerWaalsContact C-N 3.27Å; K194-M196 PolarHBondContact O-N 3.41Å; K194-C197 PolarHBondContact O-N 2.91Å; K194-L198 HydrophobicContact CD-CD1 4.41Å; K194-L198 HydrophobicContact CG-CD1 3.73Å; K194-L198 HydrophobicContact CG-CG 4.38Å; K194-L198 WeakPolarHBondContact O-CB 2.95Å; K194-L198 WeakPolarHBondContact O-CG 3.37Å; K194-L198 PolarHBondContact O-N 2.94Å; K194-D275 WeakPolarHBondContact CB-OD2 3.45Å; K194-D275 HydrophobicContact CD-CB 4.47Å
195	E	92	Very high	93.3	Very high	55 Å²	55	36.1 Å²	36.1	26%	0.257	18%	0.182	S	C	.	.	H	α-helix	trans	-62.5	-38.8	-176.8	-62	66.3	-138.8	0	0	110.6	V193 L199 N200 L272	V193-E195 PolarHBondContact O-N 2.88Å; V193-E195 VanDerWaalsContact O-N 3.17Å; E195-L199 PolarHBondContact O-N 3.43Å; E195-L199 VanDerWaalsContact O-N 3.16Å; E195-N200 PolarHBondContact O-N 3.09Å; E195-L272 HydrophobicContact CG-CD1 4.04Å; E195-L272 WeakPolarHBondContact OE1-CD1 3.43Å
196	M	93.1	Very high	92.8	Very high	16 Å²	16	36.1 Å²	36.1	8%	0.079	18%	0.182	C	C	.	.	H	α-helix	trans	-70	-46.7	177	-173.2	171.5	-75.2	0	0	111.3	A192 V193 K194 L198 L199 L309 C315 F316	A192-M196 HydrophobicContact CB-CB 4.3Å; A192-M196 HydrophobicContact CB-CG 4.36Å; A192-M196 HydrophobicContact CB-SD 3.96Å; V193-M196 HydrophobicContact CG2-CB 3.97Å; V193-M196 WeakPolarHBondContact O-CB 3.37Å; V193-M196 PolarHBondContact O-N 3.16Å; K194-M196 VanDerWaalsContact C-N 3.27Å; K194-M196 PolarHBondContact O-N 3.41Å; M196-L198 VanDerWaalsContact C-N 3.26Å; M196-L198 PolarHBondContact O-N 3Å; M196-L199 PolarHBondContact O-N 2.86Å; M196-L309 HydrophobicContact CE-CD1 3.7Å; M196-C315 HydrophobicContact CE-CB 3.46Å; M196-C315 VanDerWaalsContact CE-CB 3.46Å; M196-C315 HydrophobicContact SD-CB 4.44Å; M196-F316 HydrophobicContact CE-CE1 4.06Å; M196-F316 HydrophobicContact CE-CE2 4.46Å; M196-F316 HydrophobicContact CE-CZ 3.95Å; M196-F316 HydrophobicContact SD-CD1 4.08Å; M196-F316 HydrophobicContact SD-CE1 3.58Å; M196-F316 VanDerWaalsContact SD-CE1 3.58Å; M196-F316 HydrophobicContact SD-CZ 4.08Å
197	C	93.9	Very high	92.3	Very high	15 Å²	15	38.6 Å²	38.6	10%	0.101	20%	0.2	C	C	.	.	H	α-helix	trans	-62.7	-32.3	179.9	-60.6	0	0	0	0	113.3	V193 K194	V193-C197 PolarHBondContact O-N 3.39Å; V193-C197 VanDerWaalsContact O-N 3.16Å; K194-C197 PolarHBondContact O-N 2.91Å
198	L	92.9	Very high	91.7	Very high	75 Å²	75	43.1 Å²	43.1	39%	0.393	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98	3.7	-178	-61.8	179.9	0	0	0	113.8	P142 K194 M196 N200	P142-L198 HydrophobicContact CB-CD2 4.39Å; K194-L198 HydrophobicContact CD-CD1 4.41Å; K194-L198 HydrophobicContact CG-CD1 3.73Å; K194-L198 HydrophobicContact CG-CG 4.38Å; K194-L198 WeakPolarHBondContact O-CB 2.95Å; K194-L198 WeakPolarHBondContact O-CG 3.37Å; K194-L198 PolarHBondContact O-N 2.94Å; M196-L198 VanDerWaalsContact C-N 3.26Å; M196-L198 PolarHBondContact O-N 3Å; L198-N200 PolarHBondContact O-N 3.09Å
199	L	93	Very high	91	Very high	41 Å²	41	47.1 Å²	47.1	22%	0.215	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.3	32.1	-173.1	-172.3	52.1	0	0	0	112.9	L140 E195 M196 Q201 L304 T305	L140-L199 HydrophobicContact CB-CD2 4.43Å; L140-L199 HydrophobicContact CD2-CB 3.75Å; E195-L199 PolarHBondContact O-N 3.43Å; E195-L199 VanDerWaalsContact O-N 3.16Å; M196-L199 PolarHBondContact O-N 2.86Å; L199-Q201 PolarHBondContact O-N 2.9Å; L199-L304 HydrophobicContact CB-CD1 4.36Å; L199-L304 HydrophobicContact CD1-CB 3.86Å; L199-L304 HydrophobicContact CD2-CB 4.33Å; L199-L304 HydrophobicContact CG-CB 4.5Å; L199-T305 HydrophobicContact CD1-CG2 3.46Å; L199-T305 VanDerWaalsContact CD1-CG2 3.46Å
200	N	90.1	Very high	89.9	Confident	65 Å²	65	50 Å²	50	35%	0.348	26%	0.261	S	S	.	.			trans	-82	112.3	178.6	-171.9	3.1	0	0	0	110.3	E195 L198 S202	E195-N200 PolarHBondContact O-N 3.09Å; L198-N200 PolarHBondContact O-N 3.09Å; N200-S202 WeakPolarHBondContact OD1-CB 3.16Å; N200-S202 PolarHBondContact OD1-N 2.78Å; N200-S202 PolarHBondContact OD1-OG 2.8Å
201	Q	91.1	Very high	87.9	Confident	18 Å²	18	55.5 Å²	55.5	8%	0.084	30%	0.295	C	S	.	.			trans	-109.7	7.2	-179.5	-66.9	177.8	92.7	0	0	112.8	L199 L203 Q204 T305 I418 Q419 Y420	L199-Q201 PolarHBondContact O-N 2.9Å; Q201-L203 PolarHBondContact O-N 3.05Å; Q201-Q204 WeakPolarHBondContact O-CB 3.35Å; Q201-Q204 PolarHBondContact O-N 3.14Å; Q201-T305 HydrophobicContact CG-CG2 4.47Å; Q201-I418 HydrophobicContact CB-CG2 4.44Å; Q201-Q419 CarbonylContact C-O 3.57Å; Q201-Q419 WeakPolarHBondContact CB-O 3.41Å; Q201-Y420 HydrophobicContact CB-CD1 4.19Å; Q201-Y420 HydrophobicContact CB-CE1 4.16Å; Q201-Y420 WeakPolarHBondContact O-CA 3.41Å
202	S	87.2	Confident	85.4	Confident	40 Å²	40	62 Å²	62	28%	0.28	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-19.4	-170.8	68.3	0	0	0	0	115.4	N200 Q419 Y420 R421	N200-S202 WeakPolarHBondContact OD1-CB 3.16Å; N200-S202 PolarHBondContact OD1-N 2.78Å; N200-S202 PolarHBondContact OD1-OG 2.8Å; S202-Q419 PolarHBondContact N-O 3.37Å; S202-Y420 CarbonylContact O-C 3.54Å; S202-Y420 VanDerWaalsContact O-C 3.23Å; S202-R421 WeakPolarHBondContact O-CA 3.26Å; S202-R421 PolarHBondContact O-N 3.46Å
203	L	86.3	Confident	82.7	Confident	64 Å²	64	67 Å²	67	34%	0.335	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-4.5	175.3	-64.4	-178.9	0	0	0	113.5	Q201 L272	Q201-L203 PolarHBondContact O-N 3.05Å; L203-L272 HydrophobicContact CD1-CD1 3.71Å; L203-L272 HydrophobicContact CD1-CD2 3.5Å; L203-L272 HydrophobicContact CD1-CG 3.43Å; L203-L272 VanDerWaalsContact CD1-CG 3.43Å
204	Q	87.4	Confident	80.1	Confident	78 Å²	78	75.2 Å²	75.2	36%	0.364	39%	0.39	S	S	.	.	S	Bend	trans	-81.1	142.1	175.9	-61.2	-174.4	7.8	0	0	110.2	Q201 Y420 R421	Q201-Q204 WeakPolarHBondContact O-CB 3.35Å; Q201-Q204 PolarHBondContact O-N 3.14Å; Q204-Y420 HydrophobicContact CB-CD1 4.3Å; Q204-Y420 WeakPolarHBondContact O-CB 3.36Å; Q204-R421 WeakPolarHBondContact O-CB 3.49Å; Q204-R421 PolarHBondContact O-N 2.77Å
205	E	87.6	Confident	77.3	Confident	120 Å²	120	74.8 Å²	74.8	56%	0.561	41%	0.409	S	S	*	.	P	Polyproline II helix	trans	-66.7	138.8	172.5	-64.7	-172	168.4	0	0	110.9	P207 R421	E205-P207 WeakPolarHBondContact O-CD 3.07Å; E205-R421 IonicContact OE1-NH1 2.69Å; E205-R421 PolarHBondContact OE1-NH1 3.38Å
206	C	87.9	Confident	74.5	Confident	1 Å²	1	81.1 Å²	81.1	1%	0.007	44%	0.435	C	S	.	.	P	Polyproline II helix	trans	-70	125.4	176.9	-173.3	0	0	0	0	109.6	L208 L209 Y420 A423	C206-L208 PolarHBondContact O-N 3.12Å; C206-L208 VanDerWaalsContact O-N 3.1Å; C206-L209 HydrophobicContact CB-CB 4.43Å; C206-L209 HydrophobicContact CB-CD1 3.94Å; C206-L209 HydrophobicContact CB-CG 4.02Å; C206-L209 PolarHBondContact O-N 2.98Å; C206-Y420 HydrophobicContact CB-CD1 4.44Å; C206-Y420 HydrophobicContact CB-CD2 3.89Å; C206-Y420 HydrophobicContact CB-CG 3.83Å; C206-A423 HydrophobicContact CB-CB 4.07Å
207	P	87.2	Confident	71.6	Confident	67 Å²	67	84.7 Å²	84.7	44%	0.435	47%	0.467	S	S	.	.	G	3₁₀ helix	trans	-56.4	-30.4	-179.6	-27.2	35.1	0	0	0	114.3	E205 L209 V210	E205-P207 WeakPolarHBondContact O-CD 3.07Å; P207-L209 VanDerWaalsContact C-N 3.25Å; P207-L209 PolarHBondContact O-N 3.39Å; P207-V210 PolarHBondContact O-N 2.87Å
208	L	85.8	Confident	68.8	Low	95 Å²	95	90.2 Å²	90.2	50%	0.497	50%	0.501	S	S	.	.	G	3₁₀ helix	trans	-73	-15	179	-63.1	178.9	0	0	0	113.8	C206 L425 T439 L441 W458	C206-L208 PolarHBondContact O-N 3.12Å; C206-L208 VanDerWaalsContact O-N 3.1Å; L208-L425 HydrophobicContact CD1-CD1 3.69Å; L208-L425 HydrophobicContact CD1-CD2 4.39Å; L208-T439 HydrophobicContact CD1-CG2 4.44Å; L208-L441 HydrophobicContact CB-CD2 3.84Å; L208-L441 HydrophobicContact CD1-CD2 4.39Å; L208-W458 HydrophobicContact CD1-CH2 4.12Å; L208-W458 HydrophobicContact CD1-CZ3 4.29Å
209	L	83.6	Confident	66.3	Low	84 Å²	84	95.7 Å²	95.7	44%	0.44	52%	0.524	S	S	.	.	G	3₁₀ helix	trans	-92.9	-16.8	176	-64.5	178.4	0	0	0	112.6	C206 P207 T211 A423 L441	C206-L209 HydrophobicContact CB-CB 4.43Å; C206-L209 HydrophobicContact CB-CD1 3.94Å; C206-L209 HydrophobicContact CB-CG 4.02Å; C206-L209 PolarHBondContact O-N 2.98Å; P207-L209 VanDerWaalsContact C-N 3.25Å; P207-L209 PolarHBondContact O-N 3.39Å; L209-T211 PolarHBondContact O-N 3.41Å; L209-A423 HydrophobicContact CD1-CB 3.98Å; L209-L441 HydrophobicContact CD2-CD2 3.75Å; L209-L441 HydrophobicContact CG-CD2 4.11Å
210	V	73.1	Confident	63.8	Low	68 Å²	68	102.3 Å²	102.3	41%	0.412	55%	0.554	S	S	.	*			trans	-73.3	101.2	179	-175.3	0	0	0	0	108.2	P207 H212	P207-V210 PolarHBondContact O-N 2.87Å; V210-H212 PolarHBondContact O-N 2.92Å; V210-H212 VanDerWaalsContact O-N 3.09Å
211	T	53.8	Low	61.6	Low	119 Å²	119	108.7 Å²	108.7	73%	0.73	58%	0.579	S	S	*	*			trans	-67.6	109.8	168.1	35.6	0	0	0	0	107.7	L209 V213	L209-T211 PolarHBondContact O-N 3.41Å; T211-V213 PolarHBondContact O-N 2.86Å
212	H	43.9	Very low	59.6	Low	175 Å²	175	119.3 Å²	119.3	81%	0.81	62%	0.618	S	S	*	*			trans	-62.3	91.3	166.3	-73.9	-74	0	0	0	107.8	V210 K214	V210-H212 PolarHBondContact O-N 2.92Å; V210-H212 VanDerWaalsContact O-N 3.09Å; H212-K214 VanDerWaalsContact C-N 3.27Å; H212-K214 PolarHBondContact O-N 2.96Å
213	V	39.7	Very low	58.1	Low	106 Å²	106	126.1 Å²	126.1	64%	0.642	65%	0.646	S	S	*	*			trans	-63.2	96.4	170.7	-177.9	0	0	0	0	105.6	T211 G215	T211-V213 PolarHBondContact O-N 2.86Å; V213-G215 PolarHBondContact O-N 3.25Å
214	K	39.4	Very low	56.7	Low	197 Å²	197	129 Å²	129	86%	0.857	67%	0.665	S	S	*	*			trans	-47.3	114.9	164.8	-82.4	-177.9	175.4	177.7	0	105.8	H212 K216	H212-K214 VanDerWaalsContact C-N 3.27Å; H212-K214 PolarHBondContact O-N 2.96Å; K214-K216 PolarHBondContact O-N 3.02Å; K214-K216 VanDerWaalsContact O-N 3.12Å
215	G	33.6	Very low	55.6	Low	71 Å²	71	133.8 Å²	133.8	73%	0.732	69%	0.685	S	S	*	*			trans	-42.1	121.1	-166.7	0	0	0	0	0	110.3	V213 A217	V213-G215 PolarHBondContact O-N 3.25Å; G215-A217 PolarHBondContact O-N 3.21Å
216	K	33.5	Very low	54.3	Low	189 Å²	189	137 Å²	137	82%	0.822	70%	0.697	S	S	*	*			trans	-49.5	113.3	169.8	-76.7	-179.2	176.7	177.4	0	105.9	K214 T218	K214-K216 PolarHBondContact O-N 3.02Å; K214-K216 VanDerWaalsContact O-N 3.12Å; K216-T218 PolarHBondContact O-N 2.81Å
217	A	33.7	Very low	53.1	Low	90 Å²	90	146.9 Å²	146.9	74%	0.744	74%	0.736	S	S	*	*			trans	-51.4	112.5	170.8	0	0	0	0	0	105.9	G215 E219	G215-A217 PolarHBondContact O-N 3.21Å; A217-E219 PolarHBondContact O-N 3.3Å
218	T	34.8	Very low	51.9	Low	131 Å²	131	147.1 Å²	147.1	80%	0.804	74%	0.739	S	S	*	*			trans	-50.5	109.4	172.5	5	0	0	0	0	106.3	K216 Q220	K216-T218 PolarHBondContact O-N 2.81Å; T218-Q220 VanDerWaalsContact C-N 3.29Å; T218-Q220 PolarHBondContact O-N 3.38Å
219	E	39	Very low	50.9	Low	190 Å²	190	149.1 Å²	149.1	89%	0.888	76%	0.755	S	S	*	*			trans	-56.8	101.4	172	-77.1	-174.2	156	0	0	106.6	A217 K221	A217-E219 PolarHBondContact O-N 3.3Å; E219-K221 PolarHBondContact O-N 2.7Å
220	Q	41.5	Very low	49.9	Very low	181 Å²	181	154 Å²	154	85%	0.846	77%	0.773	S	S	*	*			trans	-59.7	110.1	170.1	-71.4	-178.1	-8	0	0	105.8	T218 R222	T218-Q220 VanDerWaalsContact C-N 3.29Å; T218-Q220 PolarHBondContact O-N 3.38Å; Q220-R222 PolarHBondContact O-N 2.71Å
221	K	44.3	Very low	49.7	Very low	199 Å²	199	156 Å²	156	87%	0.865	79%	0.787	S	S	*	*			trans	-48.6	110.5	170.3	-76.9	-178.9	176.3	177.5	0	107.3	E219 Q223	E219-K221 PolarHBondContact O-N 2.7Å; K221-Q223 PolarHBondContact O-N 3.41Å
222	R	49.1	Very low	50.7	Low	240 Å²	240	156.3 Å²	156.3	91%	0.906	79%	0.791	S	S	*	*			trans	-53.9	112.4	178.1	-84.2	179.9	169.5	178.2	-2.2	108.1	Q220 V224	Q220-R222 PolarHBondContact O-N 2.71Å; R222-V224 PolarHBondContact O-N 3.24Å; R222-V224 VanDerWaalsContact O-N 3.15Å
223	Q	54.5	Low	51.9	Low	184 Å²	184	158.9 Å²	158.9	86%	0.86	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-60.3	118.6	172.4	-73.1	-176	-7.6	0	0	108.4	K221 K225	K221-Q223 PolarHBondContact O-N 3.41Å; Q223-K225 PolarHBondContact O-N 3.22Å
224	V	57.3	Low	53.1	Low	124 Å²	124	157.8 Å²	157.8	75%	0.752	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-67.1	116.4	179	-177.7	0	0	0	0	108.2	R222	R222-V224 PolarHBondContact O-N 3.24Å; R222-V224 VanDerWaalsContact O-N 3.15Å
225	K	64.9	Low	54.9	Low	178 Å²	178	156.2 Å²	156.2	77%	0.774	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-68.3	140.4	176.2	-66.9	-178.4	179.7	-179.9	0	109.9	Q223 Y227 S228	Q223-K225 PolarHBondContact O-N 3.22Å; K225-Y227 PolarHBondContact O-N 3.49Å; K225-S228 PolarHBondContact O-N 3.12Å
226	K	59.1	Low	56.8	Low	187 Å²	187	161.1 Å²	161.1	81%	0.813	78%	0.78	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52	-15.8	-174.1	-167.4	173.6	179.7	179.1	0	116.1
227	Y	63.8	Low	59.1	Low	209 Å²	209	154.6 Å²	154.6	82%	0.82	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.1	45.8	-178.9	-58.1	-74.1	0	0	0	112.9	K225	K225-Y227 PolarHBondContact O-N 3.49Å
228	S	61.3	Low	61.2	Low	72 Å²	72	152 Å²	152	50%	0.503	74%	0.74	S	S	.	*	P	Polyproline II helix	trans	-84.7	135.3	170.2	62.5	0	0	0	0	111.4	K225 K230	K225-S228 PolarHBondContact O-N 3.12Å; S228-K230 PolarHBondContact O-N 2.63Å
229	V	65.3	Low	63.2	Low	137 Å²	137	152 Å²	152	83%	0.83	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-53.9	128	173.1	-178.5	0	0	0	0	109.3
230	K	62.8	Low	65.2	Low	188 Å²	188	148.9 Å²	148.9	82%	0.817	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-61.2	129.9	178.8	-71	-176.5	-180	179	0	108.6	S228	S228-K230 PolarHBondContact O-N 2.63Å
231	P	67.6	Low	67	Low	110 Å²	110	143.6 Å²	143.6	71%	0.714	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-59	155.1	176.3	23.5	-31.5	0	0	0	110.5	R233	P231-R233 PolarHBondContact O-N 2.82Å
232	P	76.8	Confident	68.8	Low	124 Å²	124	142.2 Å²	142.2	81%	0.805	68%	0.68	S	S	*	*	P	Polyproline II helix	trans	-50.5	141.8	175.6	-22.8	31.6	0	0	0	110.9	D234	P232-D234 PolarHBondContact O-N 3.4Å; P232-D234 VanDerWaalsContact O-N 3.11Å
233	R	67.8	Low	70.4	Confident	230 Å²	230	135.4 Å²	135.4	87%	0.868	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-59.3	117	179.7	-125.2	177.4	-177.4	-174.6	-0.5	108.7	P231 L235	P231-R233 PolarHBondContact O-N 2.82Å; R233-L235 PolarHBondContact O-N 2.82Å
234	D	65.4	Low	71.8	Confident	82 Å²	82	130.3 Å²	130.3	44%	0.439	63%	0.634	S	S	.	*	P	Polyproline II helix	trans	-66.8	117	173.1	-163	-13.2	0	0	0	108.1	P232 R236 Q241	P232-D234 PolarHBondContact O-N 3.4Å; P232-D234 VanDerWaalsContact O-N 3.11Å; D234-R236 VanDerWaalsContact C-N 3.27Å; D234-R236 WeakPolarHBondContact OD1-CB 3.34Å; D234-R236 WeakPolarHBondContact OD1-CG 3.46Å; D234-R236 IonicContact OD1-CZ 3.66Å; D234-R236 PolarHBondContact OD1-N 3.22Å; D234-R236 IonicContact OD1-NE 2.84Å; D234-R236 PolarHBondContact OD1-NE 3.38Å; D234-R236 IonicContact OD1-NH2 3.59Å; D234-R236 IonicContact OD2-CZ 3.41Å; D234-R236 IonicContact OD2-NE 3.21Å; D234-R236 PolarHBondContact OD2-NE 2.78Å; D234-R236 IonicContact OD2-NH2 2.84Å; D234-R236 PolarHBondContact OD2-NH2 2.77Å; D234-Q241 PolarHBondContact OD2-NE2 2.77Å
235	L	77.9	Confident	73.1	Confident	165 Å²	165	130 Å²	130	86%	0.864	62%	0.624	S	S	*	*			trans	-87.6	2.9	-177.6	-62.7	175.6	0	0	0	112.2	R233	R233-L235 PolarHBondContact O-N 2.82Å
236	R	73	Confident	74.2	Confident	173 Å²	173	130.1 Å²	130.1	65%	0.653	62%	0.62	S	S	*	*	S	Bend	trans	-76.3	142.5	176.1	-67.7	176.4	-76.3	-175	0	110.8	D234 G238	D234-R236 VanDerWaalsContact C-N 3.27Å; D234-R236 WeakPolarHBondContact OD1-CB 3.34Å; D234-R236 WeakPolarHBondContact OD1-CG 3.46Å; D234-R236 IonicContact OD1-CZ 3.66Å; D234-R236 PolarHBondContact OD1-N 3.22Å; D234-R236 IonicContact OD1-NE 2.84Å; D234-R236 PolarHBondContact OD1-NE 3.38Å; D234-R236 IonicContact OD1-NH2 3.59Å; D234-R236 IonicContact OD2-CZ 3.41Å; D234-R236 IonicContact OD2-NE 3.21Å; D234-R236 PolarHBondContact OD2-NE 2.78Å; D234-R236 IonicContact OD2-NH2 2.84Å; D234-R236 PolarHBondContact OD2-NH2 2.77Å; R236-G238 PolarHBondContact O-N 2.71Å
237	S	81.4	Confident	75.5	Confident	52 Å²	52	128 Å²	128	36%	0.364	61%	0.607	S	S	.	*			trans	-65.3	118.4	179.7	175.2	0	0	0	0	111	F239 E240 Q241	S237-F239 PolarHBondContact O-N 3.41Å; S237-F239 VanDerWaalsContact O-N 3.09Å; S237-F239 PolarHBondContact OG-N 2.78Å; S237-E240 PolarHBondContact O-N 3.33Å; S237-E240 VanDerWaalsContact O-N 3.11Å; S237-Q241 PolarHBondContact O-N 2.86Å
238	G	76.8	Confident	76.6	Confident	35 Å²	35	122.7 Å²	122.7	36%	0.361	59%	0.59	S	S	.	*	H	α-helix	trans	-66	-7.6	175.9	0	0	0	0	0	114.5	R236 R242	R236-G238 PolarHBondContact O-N 2.71Å; G238-R242 PolarHBondContact O-NE 2.75Å
239	F	78.7	Confident	77.8	Confident	131 Å²	131	121.6 Å²	121.6	58%	0.575	59%	0.585	S	S	*	*	H	α-helix	trans	-82.9	-44.3	169.6	-180	-95.5	0	0	0	111.3	S237 R242 Q243	S237-F239 PolarHBondContact O-N 3.41Å; S237-F239 VanDerWaalsContact O-N 3.09Å; S237-F239 PolarHBondContact OG-N 2.78Å; F239-R242 PolarHBondContact O-N 3.46Å; F239-Q243 HydrophobicContact CE1-CG 4.23Å; F239-Q243 HydrophobicContact CZ-CG 4.42Å; F239-Q243 PolarHBondContact O-N 3.32Å
240	E	80	Confident	79	Confident	126 Å²	126	119.3 Å²	119.3	59%	0.589	57%	0.568	S	S	*	*	H	α-helix	trans	-65.4	-40.6	176.7	-67.1	176.4	163.2	0	0	111.2	S237 R242 Q243 E244	S237-E240 PolarHBondContact O-N 3.33Å; S237-E240 VanDerWaalsContact O-N 3.11Å; E240-R242 PolarHBondContact O-N 2.76Å; E240-Q243 PolarHBondContact O-N 2.79Å; E240-E244 WeakPolarHBondContact O-CB 3.38Å; E240-E244 PolarHBondContact O-N 3.44Å
241	Q	79.4	Confident	80.2	Confident	69 Å²	69	112.8 Å²	112.8	32%	0.322	55%	0.55	S	S	.	.	H	α-helix	trans	-58	-46.8	172.5	-74.9	178.8	-12.9	0	0	111.4	D234 S237 Q243 E244 E245	D234-Q241 PolarHBondContact OD2-NE2 2.77Å; S237-Q241 PolarHBondContact O-N 2.86Å; Q241-Q243 VanDerWaalsContact C-N 3.35Å; Q241-Q243 PolarHBondContact O-N 2.81Å; Q241-E244 PolarHBondContact O-N 3.06Å; Q241-E245 VanDerWaalsContact O-CB 3.31Å; Q241-E245 WeakPolarHBondContact O-CB 3.31Å; Q241-E245 VanDerWaalsContact O-CG 3.23Å; Q241-E245 WeakPolarHBondContact O-CG 3.49Å; Q241-E245 PolarHBondContact O-N 3.1Å
242	R	82.3	Confident	81.2	Confident	171 Å²	171	113.9 Å²	113.9	65%	0.645	55%	0.545	S	S	*	.	H	α-helix	trans	-66.2	-33.1	177.2	-84	-176.8	-76.8	-179.7	-5.1	113.4	G238 F239 E240 R246	G238-R242 PolarHBondContact O-NE 2.75Å; F239-R242 PolarHBondContact O-N 3.46Å; E240-R242 PolarHBondContact O-N 2.76Å; R242-R246 VanDerWaalsContact O-CB 3.3Å; R242-R246 WeakPolarHBondContact O-CB 3.29Å; R242-R246 PolarHBondContact O-N 3.42Å
243	Q	82.9	Confident	81.7	Confident	96 Å²	96	110.2 Å²	110.2	45%	0.449	53%	0.525	S	S	.	.	H	α-helix	trans	-69.4	-41.4	174.1	-99.3	-169.9	-40.2	0	0	112.2	F239 E240 Q241 R246 R247	F239-Q243 HydrophobicContact CE1-CG 4.23Å; F239-Q243 HydrophobicContact CZ-CG 4.42Å; F239-Q243 PolarHBondContact O-N 3.32Å; E240-Q243 PolarHBondContact O-N 2.79Å; Q241-Q243 VanDerWaalsContact C-N 3.35Å; Q241-Q243 PolarHBondContact O-N 2.81Å; Q243-R246 PolarHBondContact O-N 3.46Å; Q243-R247 PolarHBondContact O-N 2.9Å
244	E	83.6	Confident	82.8	Confident	77 Å²	77	104 Å²	104	36%	0.36	51%	0.509	S	S	.	.	H	α-helix	trans	-68.8	-44.2	177.3	-170.1	58.7	-142.3	0	0	110.8	E240 Q241 R246 R247 Q248	E240-E244 WeakPolarHBondContact O-CB 3.38Å; E240-E244 PolarHBondContact O-N 3.44Å; Q241-E244 PolarHBondContact O-N 3.06Å; E244-R246 VanDerWaalsContact C-N 3.31Å; E244-R246 PolarHBondContact O-N 3.09Å; E244-R247 PolarHBondContact O-N 3.41Å; E244-R247 IonicContact OE2-CZ 3.4Å; E244-R247 VanDerWaalsContact OE2-CZ 3.26Å; E244-R247 IonicContact OE2-NH1 3.1Å; E244-R247 PolarHBondContact OE2-NH1 2.74Å; E244-R247 IonicContact OE2-NH2 3.39Å; E244-R247 PolarHBondContact OE2-NH2 2.61Å; E244-Q248 WeakPolarHBondContact O-CB 3.32Å; E244-Q248 VanDerWaalsContact O-CG 3.31Å; E244-Q248 WeakPolarHBondContact O-CG 3.43Å; E244-Q248 PolarHBondContact O-N 2.86Å; E244-Q248 PolarHBondContact OE1-NE2 3.44Å
245	E	85.3	Confident	83.9	Confident	117 Å²	117	105.1 Å²	105.1	55%	0.547	51%	0.514	S	S	.	.	H	α-helix	trans	-57.3	-43	172.7	-77.6	171.7	178.1	0	0	111.7	Q241 Q248 A249	Q241-E245 VanDerWaalsContact O-CB 3.31Å; Q241-E245 WeakPolarHBondContact O-CB 3.31Å; Q241-E245 VanDerWaalsContact O-CG 3.23Å; Q241-E245 WeakPolarHBondContact O-CG 3.49Å; Q241-E245 PolarHBondContact O-N 3.1Å; E245-Q248 PolarHBondContact O-N 3.25Å; E245-A249 VanDerWaalsContact O-CB 3.26Å; E245-A249 WeakPolarHBondContact O-CB 3.37Å; E245-A249 PolarHBondContact O-N 3.04Å
246	R	87.3	Confident	84.4	Confident	181 Å²	181	101.6 Å²	101.6	68%	0.683	50%	0.495	S	S	*	.	H	α-helix	trans	-66.6	-41.6	176.9	-167.3	173.1	-176.6	-173.9	1.8	112	R242 Q243 E244 A249 D250	R242-R246 VanDerWaalsContact O-CB 3.3Å; R242-R246 WeakPolarHBondContact O-CB 3.29Å; R242-R246 PolarHBondContact O-N 3.42Å; Q243-R246 PolarHBondContact O-N 3.46Å; E244-R246 VanDerWaalsContact C-N 3.31Å; E244-R246 PolarHBondContact O-N 3.09Å; R246-A249 PolarHBondContact O-N 2.82Å; R246-D250 WeakPolarHBondContact O-CB 3.3Å; R246-D250 PolarHBondContact O-N 3.33Å
247	R	87.1	Confident	85.3	Confident	143 Å²	143	100.4 Å²	100.4	54%	0.54	50%	0.495	S	S	.	.	H	α-helix	trans	-62	-42.3	173.7	-96.7	-174	-84.9	131.3	-0.2	112.2	Q243 E244 A251	Q243-R247 PolarHBondContact O-N 2.9Å; E244-R247 PolarHBondContact O-N 3.41Å; E244-R247 IonicContact OE2-CZ 3.4Å; E244-R247 VanDerWaalsContact OE2-CZ 3.26Å; E244-R247 IonicContact OE2-NH1 3.1Å; E244-R247 PolarHBondContact OE2-NH1 2.74Å; E244-R247 IonicContact OE2-NH2 3.39Å; E244-R247 PolarHBondContact OE2-NH2 2.61Å; R247-A251 VanDerWaalsContact O-CB 3.31Å; R247-A251 WeakPolarHBondContact O-CB 3.43Å; R247-A251 PolarHBondContact O-N 2.94Å
248	Q	86.3	Confident	85.6	Confident	97 Å²	97	104.5 Å²	104.5	45%	0.453	51%	0.506	S	S	.	.	H	α-helix	trans	-66.7	-41.7	176.3	-71.1	177.5	10.4	0	0	111.6	E244 E245 A251 Q252	E244-Q248 WeakPolarHBondContact O-CB 3.32Å; E244-Q248 VanDerWaalsContact O-CG 3.31Å; E244-Q248 WeakPolarHBondContact O-CG 3.43Å; E244-Q248 PolarHBondContact O-N 2.86Å; E244-Q248 PolarHBondContact OE1-NE2 3.44Å; E245-Q248 PolarHBondContact O-N 3.25Å; Q248-A251 PolarHBondContact O-N 3.12Å; Q248-Q252 WeakPolarHBondContact O-CB 3.37Å; Q248-Q252 VanDerWaalsContact O-CG 3.22Å; Q248-Q252 WeakPolarHBondContact O-CG 3.42Å; Q248-Q252 PolarHBondContact O-N 2.91Å
249	A	87.3	Confident	85.9	Confident	50 Å²	50	108.4 Å²	108.4	41%	0.413	52%	0.515	S	S	.	.	H	α-helix	trans	-64.4	-43.4	176.3	0	0	0	0	0	112.1	E245 R246 Q252 A253	E245-A249 VanDerWaalsContact O-CB 3.26Å; E245-A249 WeakPolarHBondContact O-CB 3.37Å; E245-A249 PolarHBondContact O-N 3.04Å; R246-A249 PolarHBondContact O-N 2.82Å; A249-Q252 PolarHBondContact O-N 2.95Å; A249-A253 WeakPolarHBondContact O-CB 3.32Å; A249-A253 PolarHBondContact O-N 3.15Å
250	D	89.1	Confident	86.2	Confident	89 Å²	89	107 Å²	107	48%	0.476	51%	0.51	S	S	.	.	H	α-helix	trans	-64.7	-42.3	176.3	-69.9	-21.9	0	0	0	110.9	R246 A253 I254	R246-D250 WeakPolarHBondContact O-CB 3.3Å; R246-D250 PolarHBondContact O-N 3.33Å; D250-A253 PolarHBondContact O-N 2.84Å; D250-I254 VanDerWaalsContact O-CG1 3.28Å; D250-I254 WeakPolarHBondContact O-CG1 3.2Å; D250-I254 PolarHBondContact O-N 2.74Å
251	A	88.3	Confident	86.6	Confident	51 Å²	51	106.5 Å²	106.5	42%	0.421	51%	0.508	S	S	.	.	H	α-helix	trans	-63.5	-41.9	175.2	0	0	0	0	0	112.4	R247 Q248 I254 L255	R247-A251 VanDerWaalsContact O-CB 3.31Å; R247-A251 WeakPolarHBondContact O-CB 3.43Å; R247-A251 PolarHBondContact O-N 2.94Å; Q248-A251 PolarHBondContact O-N 3.12Å; A251-I254 PolarHBondContact O-N 3.09Å; A251-L255 WeakPolarHBondContact O-CG 3.19Å; A251-L255 PolarHBondContact O-N 3.07Å
252	Q	87.9	Confident	86.8	Confident	132 Å²	132	105.8 Å²	105.8	62%	0.617	51%	0.514	S	S	*	.	H	α-helix	trans	-64.4	-41.8	174.6	-75.6	174.5	10.5	0	0	111.6	Q248 A249 I254 L255 L256	Q248-Q252 WeakPolarHBondContact O-CB 3.37Å; Q248-Q252 VanDerWaalsContact O-CG 3.22Å; Q248-Q252 WeakPolarHBondContact O-CG 3.42Å; Q248-Q252 PolarHBondContact O-N 2.91Å; A249-Q252 PolarHBondContact O-N 2.95Å; Q252-I254 VanDerWaalsContact C-N 3.34Å; Q252-I254 PolarHBondContact O-N 3.4Å; Q252-L255 PolarHBondContact O-N 3.09Å; Q252-L256 WeakPolarHBondContact O-CB 3.29Å; Q252-L256 PolarHBondContact O-N 3.28Å
253	A	89.1	Confident	86.8	Confident	48 Å²	48	103.2 Å²	103.2	40%	0.397	51%	0.509	S	S	.	.	H	α-helix	trans	-64.3	-37.8	177.4	0	0	0	0	0	112.2	A249 D250 K257	A249-A253 WeakPolarHBondContact O-CB 3.32Å; A249-A253 PolarHBondContact O-N 3.15Å; D250-A253 PolarHBondContact O-N 2.84Å; A253-K257 WeakPolarHBondContact O-CB 3.24Å; A253-K257 WeakPolarHBondContact O-CG 3.24Å; A253-K257 PolarHBondContact O-N 2.87Å
254	I	90.6	Very high	86.9	Confident	100 Å²	100	106.4 Å²	106.4	51%	0.513	52%	0.517	S	S	.	.	H	α-helix	trans	-65.9	-45.2	174.1	-68.8	164.8	0	0	0	110.8	D250 A251 Q252 K257 K258	D250-I254 VanDerWaalsContact O-CG1 3.28Å; D250-I254 WeakPolarHBondContact O-CG1 3.2Å; D250-I254 PolarHBondContact O-N 2.74Å; A251-I254 PolarHBondContact O-N 3.09Å; Q252-I254 VanDerWaalsContact C-N 3.34Å; Q252-I254 PolarHBondContact O-N 3.4Å; I254-K257 PolarHBondContact O-N 2.64Å; I254-K258 WeakPolarHBondContact O-CG 3.37Å; I254-K258 PolarHBondContact O-N 3.41Å
255	L	87.6	Confident	86.9	Confident	105 Å²	105	107.1 Å²	107.1	55%	0.55	52%	0.523	S	S	.	.	H	α-helix	trans	-61.6	-43.6	176.7	-76.3	170.7	0	0	0	111.7	A251 Q252 K258 Q259	A251-L255 WeakPolarHBondContact O-CG 3.19Å; A251-L255 PolarHBondContact O-N 3.07Å; Q252-L255 PolarHBondContact O-N 3.09Å; L255-K258 PolarHBondContact O-N 3.34Å; L255-Q259 WeakPolarHBondContact O-CG 3.25Å; L255-Q259 PolarHBondContact O-N 3.1Å
256	L	88.8	Confident	86.5	Confident	90 Å²	90	105 Å²	105	47%	0.471	51%	0.513	S	S	.	.	H	α-helix	trans	-62.8	-43.3	177.7	-166.7	110	0	0	0	111.5	Q252 K258 Q259 Q260	Q252-L256 WeakPolarHBondContact O-CB 3.29Å; Q252-L256 PolarHBondContact O-N 3.28Å; L256-K258 PolarHBondContact O-N 3.35Å; L256-Q259 PolarHBondContact O-N 3.02Å; L256-Q260 WeakPolarHBondContact O-CG 3.3Å; L256-Q260 PolarHBondContact O-N 2.96Å
257	K	90.8	Very high	86.2	Confident	149 Å²	149	102.7 Å²	102.7	65%	0.648	51%	0.51	S	S	*	.	H	α-helix	trans	-61	-43.9	174.3	-82.3	-174.3	176.2	-176.6	0	112.2	A253 I254 Q259 Q260 E261	A253-K257 WeakPolarHBondContact O-CB 3.24Å; A253-K257 WeakPolarHBondContact O-CG 3.24Å; A253-K257 PolarHBondContact O-N 2.87Å; I254-K257 PolarHBondContact O-N 2.64Å; K257-Q259 VanDerWaalsContact C-N 3.32Å; K257-Q259 PolarHBondContact O-N 3Å; K257-Q260 PolarHBondContact O-N 3.36Å; K257-E261 WeakPolarHBondContact O-CB 3.32Å; K257-E261 PolarHBondContact O-N 2.96Å
258	K	88.3	Confident	86.1	Confident	138 Å²	138	102.1 Å²	102.1	60%	0.6	51%	0.513	S	S	*	.	H	α-helix	trans	-62.4	-39.4	175.7	-76	-173.3	177	-174	0	112.1	I254 L255 L256 A262	I254-K258 WeakPolarHBondContact O-CG 3.37Å; I254-K258 PolarHBondContact O-N 3.41Å; L255-K258 PolarHBondContact O-N 3.34Å; L256-K258 PolarHBondContact O-N 3.35Å; K258-A262 VanDerWaalsContact O-CB 3.31Å; K258-A262 WeakPolarHBondContact O-CB 3.28Å; K258-A262 PolarHBondContact O-N 3.38Å
259	Q	83.4	Confident	85.7	Confident	116 Å²	116	107.6 Å²	107.6	54%	0.542	53%	0.53	S	S	.	.	H	α-helix	trans	-63.3	-48.9	174.7	-75.7	175.3	-10.6	0	0	111.2	L255 L256 K257 E261 A262 E263	L255-Q259 WeakPolarHBondContact O-CG 3.25Å; L255-Q259 PolarHBondContact O-N 3.1Å; L256-Q259 PolarHBondContact O-N 3.02Å; K257-Q259 VanDerWaalsContact C-N 3.32Å; K257-Q259 PolarHBondContact O-N 3Å; Q259-E261 VanDerWaalsContact C-N 3.33Å; Q259-E261 PolarHBondContact O-N 2.96Å; Q259-A262 PolarHBondContact O-N 3.23Å; Q259-E263 WeakPolarHBondContact O-CB 3.42Å; Q259-E263 WeakPolarHBondContact O-CG 3.22Å; Q259-E263 PolarHBondContact O-N 2.73Å
260	Q	86.1	Confident	85.5	Confident	101 Å²	101	106.9 Å²	106.9	47%	0.472	52%	0.518	S	S	.	.	H	α-helix	trans	-61.7	-39	178	-73.2	176.9	-13.4	0	0	112.8	L256 K257 R264	L256-Q260 WeakPolarHBondContact O-CG 3.3Å; L256-Q260 PolarHBondContact O-N 2.96Å; K257-Q260 PolarHBondContact O-N 3.36Å; Q260-R264 WeakPolarHBondContact O-CB 3.41Å; Q260-R264 WeakPolarHBondContact O-CG 3.45Å; Q260-R264 PolarHBondContact O-N 2.79Å
261	E	87.4	Confident	85.1	Confident	116 Å²	116	112.6 Å²	112.6	54%	0.542	53%	0.533	S	S	.	.	H	α-helix	trans	-67.5	-41.3	176	-171.3	174.3	-170.3	0	0	111.6	K257 Q259 R264 L265	K257-E261 WeakPolarHBondContact O-CB 3.32Å; K257-E261 PolarHBondContact O-N 2.96Å; Q259-E261 VanDerWaalsContact C-N 3.33Å; Q259-E261 PolarHBondContact O-N 2.96Å; E261-R264 PolarHBondContact O-N 2.77Å; E261-L265 HydrophobicContact CG-CD1 4.26Å; E261-L265 WeakPolarHBondContact O-CB 3.19Å; E261-L265 WeakPolarHBondContact O-CG 3.44Å; E261-L265 PolarHBondContact O-N 3.49Å
262	A	82.7	Confident	84.5	Confident	55 Å²	55	113.8 Å²	113.8	46%	0.455	53%	0.532	S	S	.	.	H	α-helix	trans	-64.4	-42.6	174.5	0	0	0	0	0	112.3	K258 Q259 L265 Q266	K258-A262 VanDerWaalsContact O-CB 3.31Å; K258-A262 WeakPolarHBondContact O-CB 3.28Å; K258-A262 PolarHBondContact O-N 3.38Å; Q259-A262 PolarHBondContact O-N 3.23Å; A262-L265 PolarHBondContact O-N 2.7Å; A262-Q266 WeakPolarHBondContact O-CB 3.32Å; A262-Q266 PolarHBondContact O-N 2.97Å
263	E	82.4	Confident	84.2	Confident	116 Å²	116	112.7 Å²	112.7	54%	0.542	54%	0.536	S	S	.	.	H	α-helix	trans	-60.5	-46.9	174.5	-77.3	174.2	176.6	0	0	111.1	Q259 L265 Q266 E267	Q259-E263 WeakPolarHBondContact O-CB 3.42Å; Q259-E263 WeakPolarHBondContact O-CG 3.22Å; Q259-E263 PolarHBondContact O-N 2.73Å; E263-L265 PolarHBondContact O-N 2.75Å; E263-Q266 CarbonylContact O-C 3.6Å; E263-Q266 WeakPolarHBondContact O-CB 3.36Å; E263-Q266 PolarHBondContact O-N 2.89Å; E263-Q266 VanDerWaalsContact O-N 3.12Å; E263-E267 WeakPolarHBondContact O-CG 3.28Å; E263-E267 PolarHBondContact O-N 3.11Å
264	R	85.1	Confident	84	Confident	163 Å²	163	116.2 Å²	116.2	62%	0.615	56%	0.555	S	S	*	*	H	α-helix	trans	-60.1	-46	176.4	-82.5	-174.8	56	-123.3	-14.5	113.1	Q260 E261 Q266 E267 E268	Q260-R264 WeakPolarHBondContact O-CB 3.41Å; Q260-R264 WeakPolarHBondContact O-CG 3.45Å; Q260-R264 PolarHBondContact O-N 2.79Å; E261-R264 PolarHBondContact O-N 2.77Å; R264-Q266 PolarHBondContact O-N 2.84Å; R264-E267 PolarHBondContact O-N 3.43Å; R264-E268 WeakPolarHBondContact O-CB 3.45Å; R264-E268 PolarHBondContact O-N 3.28Å
265	L	83.9	Confident	84	Confident	93 Å²	93	112.9 Å²	112.9	49%	0.487	54%	0.538	S	S	.	.	H	α-helix	trans	-61.6	-34.7	176.2	-81.8	160.5	0	0	0	111.4	E261 A262 E263 R269	E261-L265 HydrophobicContact CG-CD1 4.26Å; E261-L265 WeakPolarHBondContact O-CB 3.19Å; E261-L265 WeakPolarHBondContact O-CG 3.44Å; E261-L265 PolarHBondContact O-N 3.49Å; A262-L265 PolarHBondContact O-N 2.7Å; E263-L265 PolarHBondContact O-N 2.75Å; L265-R269 WeakPolarHBondContact O-CG 3.4Å; L265-R269 PolarHBondContact O-N 3.2Å; L265-R269 VanDerWaalsContact O-N 3.16Å
266	Q	77.8	Confident	84.2	Confident	71 Å²	71	113.6 Å²	113.6	33%	0.332	55%	0.549	S	S	.	.	H	α-helix	trans	-71.5	-45.2	176.4	-173.9	173.1	-8.1	0	0	112	A262 E263 R264 E268 R269 E270	A262-Q266 WeakPolarHBondContact O-CB 3.32Å; A262-Q266 PolarHBondContact O-N 2.97Å; E263-Q266 CarbonylContact O-C 3.6Å; E263-Q266 WeakPolarHBondContact O-CB 3.36Å; E263-Q266 PolarHBondContact O-N 2.89Å; E263-Q266 VanDerWaalsContact O-N 3.12Å; R264-Q266 PolarHBondContact O-N 2.84Å; Q266-E268 VanDerWaalsContact C-N 3.27Å; Q266-E268 PolarHBondContact O-N 3.36Å; Q266-R269 PolarHBondContact O-N 3.04Å; Q266-E270 WeakPolarHBondContact CG-OE1 3.37Å; Q266-E270 PolarHBondContact NE2-OE1 2.9Å; Q266-E270 WeakPolarHBondContact O-CG 3.48Å; Q266-E270 PolarHBondContact O-N 3.04Å
267	E	81.3	Confident	84.3	Confident	133 Å²	133	111.8 Å²	111.8	62%	0.621	54%	0.54	S	S	*	.	H	α-helix	trans	-58.1	-40.6	174.2	-74.6	179.2	172.5	0	0	111.8	E263 R264 E270 R271	E263-E267 WeakPolarHBondContact O-CG 3.28Å; E263-E267 PolarHBondContact O-N 3.11Å; R264-E267 PolarHBondContact O-N 3.43Å; E267-E270 PolarHBondContact O-N 3.21Å; E267-R271 PolarHBondContact O-N 2.9Å
268	E	83.8	Confident	84.3	Confident	131 Å²	131	110 Å²	110	61%	0.612	54%	0.537	S	S	*	.	H	α-helix	trans	-65.9	-38.4	177.3	-171.4	170.7	-165.5	0	0	112.1	R264 Q266 R271	R264-E268 WeakPolarHBondContact O-CB 3.45Å; R264-E268 PolarHBondContact O-N 3.28Å; Q266-E268 VanDerWaalsContact C-N 3.27Å; Q266-E268 PolarHBondContact O-N 3.36Å; E268-R271 WeakPolarHBondContact O-CB 3.37Å; E268-R271 PolarHBondContact O-N 2.93Å
269	R	79.1	Confident	84.4	Confident	212 Å²	212	104.9 Å²	104.9	80%	0.8	52%	0.522	S	S	*	.	H	α-helix	trans	-68.7	-34.4	174.3	-78.7	178.6	168.1	-160.6	-3.8	113.4	L265 Q266 R271	L265-R269 WeakPolarHBondContact O-CG 3.4Å; L265-R269 PolarHBondContact O-N 3.2Å; L265-R269 VanDerWaalsContact O-N 3.16Å; Q266-R269 PolarHBondContact O-N 3.04Å; R269-R271 VanDerWaalsContact C-N 3.32Å
270	E	81.4	Confident	84.8	Confident	35 Å²	35	103.7 Å²	103.7	16%	0.164	52%	0.52	C	S	.	.	H	α-helix	trans	-85.8	-6.9	-179.8	-69.3	177.5	-170.6	0	0	112.9	Q266 E267 L272 R421 L447	Q266-E270 WeakPolarHBondContact CG-OE1 3.37Å; Q266-E270 PolarHBondContact NE2-OE1 2.9Å; Q266-E270 WeakPolarHBondContact O-CG 3.48Å; Q266-E270 PolarHBondContact O-N 3.04Å; E267-E270 PolarHBondContact O-N 3.21Å; E270-L272 PolarHBondContact O-N 2.81Å; E270-R421 IonicContact OE1-CZ 2.71Å; E270-R421 VanDerWaalsContact OE1-CZ 3.28Å; E270-R421 IonicContact OE1-NE 2.75Å; E270-R421 PolarHBondContact OE1-NE 3.2Å; E270-R421 IonicContact OE1-NH2 3.09Å; E270-R421 PolarHBondContact OE1-NH2 3.21Å; E270-R421 IonicContact OE2-CZ 3.97Å; E270-R421 IonicContact OE2-NE 2.84Å; E270-R421 PolarHBondContact OE2-NE 2.81Å; E270-R421 VanDerWaalsContact OE2-NE 3.09Å; E270-R421 IonicContact OE2-NH2 3.72Å; E270-R421 PolarHBondContact OE2-NH2 2.71Å; E270-L447 HydrophobicContact CG-CD1 3.61Å; E270-L447 HydrophobicContact CG-CD2 4.15Å
271	R	81	Confident	85.2	Confident	209 Å²	209	99.9 Å²	99.9	79%	0.789	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-64.6	118.2	-179.7	-170.2	173.9	-176.8	158	1.6	110.4	E267 E268 R269	E267-R271 PolarHBondContact O-N 2.9Å; E268-R271 WeakPolarHBondContact O-CB 3.37Å; E268-R271 PolarHBondContact O-N 2.93Å; R269-R271 VanDerWaalsContact C-N 3.32Å
272	L	75.8	Confident	85.6	Confident	77 Å²	77	94.9 Å²	94.9	40%	0.403	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-65.7	146.6	176.9	-72.6	167.9	0	0	0	111.7	E195 L203 E270	E195-L272 HydrophobicContact CG-CD1 4.04Å; E195-L272 WeakPolarHBondContact OE1-CD1 3.43Å; L203-L272 HydrophobicContact CD1-CD1 3.71Å; L203-L272 HydrophobicContact CD1-CD2 3.5Å; L203-L272 HydrophobicContact CD1-CG 3.43Å; L203-L272 VanDerWaalsContact CD1-CG 3.43Å; E270-L272 PolarHBondContact O-N 2.81Å
273	P	82.8	Confident	86.3	Confident	108 Å²	108	92.2 Å²	92.2	70%	0.701	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-56.1	144.7	166.3	-21.1	31.9	0	0	0	110.7	D275	P273-D275 PolarHBondContact O-N 2.85Å
274	P	84.9	Confident	87	Confident	123 Å²	123	86.7 Å²	86.7	80%	0.799	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-59.1	133	176.3	24.7	-32.8	0	0	0	110.6	P276	P274-P276 WeakPolarHBondContact O-CD 3.42Å
275	D	88.8	Confident	87.7	Confident	30 Å²	30	79 Å²	79	16%	0.16	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-79.8	117.2	177	-177.7	25.3	0	0	0	110.4	K194 P273 L277 L278 R281	K194-D275 WeakPolarHBondContact CB-OD2 3.45Å; K194-D275 HydrophobicContact CD-CB 4.47Å; P273-D275 PolarHBondContact O-N 2.85Å; D275-L277 PolarHBondContact O-N 2.81Å; D275-L277 VanDerWaalsContact O-N 3.17Å; D275-L277 PolarHBondContact OD1-N 3.48Å; D275-L278 HydrophobicContact CB-CB 4.31Å; D275-L278 WeakPolarHBondContact O-CB 3.4Å; D275-L278 PolarHBondContact O-N 3.22Å; D275-L278 PolarHBondContact OD2-N 3.1Å; D275-R281 IonicContact OD1-CZ 3Å; D275-R281 IonicContact OD1-NE 3.74Å; D275-R281 IonicContact OD1-NH2 3.86Å; D275-R281 PolarHBondContact OD1-NH2 2.81Å; D275-R281 IonicContact OD2-CZ 3.38Å; D275-R281 IonicContact OD2-NE 3.52Å; D275-R281 PolarHBondContact OD2-NE 2.91Å; D275-R281 IonicContact OD2-NH2 3.89Å
276	P	91.9	Very high	88.4	Confident	119 Å²	119	74.5 Å²	74.5	77%	0.773	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-21	177.5	-21.8	34.1	0	0	0	113.6	P274	P274-P276 WeakPolarHBondContact O-CD 3.42Å
277	L	92.3	Very high	89.3	Confident	53 Å²	53	71.1 Å²	71.1	28%	0.277	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.1	20.3	-178.6	-58.8	-179.8	0	0	0	112.8	P146 I147 D275 G279 L280 R281	P146-L277 HydrophobicContact CG-CD1 4.08Å; I147-L277 HydrophobicContact CG2-CD1 4.19Å; I147-L277 HydrophobicContact CG2-CD2 4.31Å; D275-L277 PolarHBondContact O-N 2.81Å; D275-L277 VanDerWaalsContact O-N 3.17Å; D275-L277 PolarHBondContact OD1-N 3.48Å; L277-G279 PolarHBondContact O-N 3.18Å; L277-L280 HydrophobicContact CD2-CD1 4.32Å; L277-L280 PolarHBondContact O-N 2.97Å; L277-R281 HydrophobicContact CB-CG 4.04Å
278	L	90.8	Very high	90.1	Very high	112 Å²	112	64.8 Å²	64.8	59%	0.586	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	124.9	178.8	-175.5	66.8	0	0	0	110.3	D275 L280 L317	D275-L278 HydrophobicContact CB-CB 4.31Å; D275-L278 WeakPolarHBondContact O-CB 3.4Å; D275-L278 PolarHBondContact O-N 3.22Å; D275-L278 PolarHBondContact OD2-N 3.1Å; L278-L280 VanDerWaalsContact C-N 3.26Å; L278-L280 PolarHBondContact O-N 3.47Å; L278-L317 HydrophobicContact CD1-CD1 3.84Å; L278-L317 HydrophobicContact CG-CD1 4.47Å
279	G	89.1	Confident	90.7	Very high	29 Å²	29	59.4 Å²	59.4	30%	0.299	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.9	-4.3	-177.7	0	0	0	0	0	115.2	Y191 L277	Y191-G279 WeakPolarHBondContact CD1-O 3.47Å; L277-G279 PolarHBondContact O-N 3.18Å
280	L	92.4	Very high	91.4	Very high	92 Å²	92	51.9 Å²	51.9	48%	0.482	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	-14.1	179.6	-60	178.4	0	0	0	113.3	I147 L277 L278 V282	I147-L280 WeakPolarHBondContact CA-O 3.43Å; I147-L280 HydrophobicContact CG2-CB 4.23Å; L277-L280 HydrophobicContact CD2-CD1 4.32Å; L277-L280 PolarHBondContact O-N 2.97Å; L278-L280 VanDerWaalsContact C-N 3.26Å; L278-L280 PolarHBondContact O-N 3.47Å; L280-V282 PolarHBondContact O-N 3.03Å
281	R	95.1	Very high	91.6	Very high	21 Å²	21	53 Å²	53	8%	0.079	31%	0.308	C	S	.	.			trans	-75.5	119.7	-178.2	-65.9	179	-176.8	-75.9	-5.4	110.6	P146 Y191 A192 D275 L277	P146-R281 WeakPolarHBondContact O-CA 3.43Å; Y191-R281 VanDerWaalsContact CA-O 3.3Å; Y191-R281 WeakPolarHBondContact CA-O 3.32Å; A192-R281 PolarHBondContact N-O 2.82Å; D275-R281 IonicContact OD1-CZ 3Å; D275-R281 IonicContact OD1-NE 3.74Å; D275-R281 IonicContact OD1-NH2 3.86Å; D275-R281 PolarHBondContact OD1-NH2 2.81Å; D275-R281 IonicContact OD2-CZ 3.38Å; D275-R281 IonicContact OD2-NE 3.52Å; D275-R281 PolarHBondContact OD2-NE 2.91Å; D275-R281 IonicContact OD2-NH2 3.89Å; L277-R281 HydrophobicContact CB-CG 4.04Å
282	V	95.9	Very high	92	Very high	10 Å²	10	47 Å²	47	6%	0.061	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	136.9	176.9	175.7	0	0	0	0	109.3	L143 P146 I147 P149 F168 G190 Y191 L280	L143-V282 HydrophobicContact CD1-CB 4.42Å; L143-V282 HydrophobicContact CD1-CG1 4.45Å; P146-V282 PolarHBondContact O-N 3.33Å; I147-V282 WeakPolarHBondContact O-CG2 3.5Å; P149-V282 HydrophobicContact CB-CG1 4.47Å; F168-V282 HydrophobicContact CE2-CG1 3.8Å; F168-V282 HydrophobicContact CZ-CG1 3.64Å; G190-V282 WeakPolarHBondContact O-CA 3.33Å; Y191-V282 HydrophobicContact CD1-CG2 4.39Å; Y191-V282 HydrophobicContact CE1-CG2 4.03Å; L280-V282 PolarHBondContact O-N 3.03Å
283	H	97.1	Very high	92.5	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	159	177.8	-164.1	52	0	0	0	110.5	C167 G190 A192 W285	C167-H283 WeakPolarHBondContact CB-CE1 3.48Å; C167-H283 WeakPolarHBondContact CB-ND1 3.37Å; C167-H283 PolarHBondContact SG-ND1 3.45Å; C167-H283 VanDerWaalsContact SG-ND1 3.43Å; G190-H283 PolarHBondContact N-O 2.81Å; G190-H283 PolarHBondContact O-N 2.78Å; A192-H283 HydrophobicContact CB-CB 3.71Å; H283-W285 HydrophobicContact CB-CE3 4.34Å; H283-W285 HydrophobicContact CB-CZ3 4.25Å; H283-W285 AromaticContact CD2-CE3 3.89Å
284	C	97.9	Very high	92.8	Very high	0 Å²	0	53 Å²	53	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	133.4	175.8	-170.9	0	0	0	0	110.4	C167 F168 S171 V188	C167-C284 PolarHBondContact SG-N 3.41Å; F168-C284 HydrophobicContact CB-CB 4.18Å; F168-C284 HydrophobicContact CD1-CB 3.55Å; F168-C284 HydrophobicContact CD2-CB 3.67Å; F168-C284 HydrophobicContact CE1-CB 3.71Å; F168-C284 HydrophobicContact CE2-CB 3.81Å; F168-C284 HydrophobicContact CG-CB 3.52Å; F168-C284 HydrophobicContact CZ-CB 3.83Å; S171-C284 WeakPolarHBondContact CB-SG 3.5Å; S171-C284 PolarHBondContact OG-O 3.01Å; S171-C284 PolarHBondContact OG-SG 3.28Å; S171-C284 VanDerWaalsContact OG-SG 3.4Å; V188-C284 WeakPolarHBondContact O-CA 3.42Å; V188-C284 PolarHBondContact O-SG 2.92Å
285	W	98.2	Very high	93.1	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	-178.9	178.9	64.6	94.5	0	0	0	110.8	S171 V188 H283 F300 I301 F316 G318 I319	S171-W285 WeakPolarHBondContact OG-CA 3.45Å; S171-W285 PolarHBondContact OG-N 3.22Å; V188-W285 HydrophobicContact CB-CD2 4.01Å; V188-W285 HydrophobicContact CB-CG 4.15Å; V188-W285 HydrophobicContact CB-CZ2 4.32Å; V188-W285 HydrophobicContact CG1-CD2 3.99Å; V188-W285 HydrophobicContact CG1-CH2 4.03Å; V188-W285 HydrophobicContact CG1-CZ2 3.42Å; V188-W285 VanDerWaalsContact CG1-CZ2 3.42Å; V188-W285 PolarHBondContact N-O 3.17Å; V188-W285 PolarHBondContact O-N 3.45Å; H283-W285 HydrophobicContact CB-CE3 4.34Å; H283-W285 HydrophobicContact CB-CZ3 4.25Å; H283-W285 AromaticContact CD2-CE3 3.89Å; W285-F300 AromaticContact CD1-CD1 3.58Å; W285-F300 AromaticContact CD1-CG 3.7Å; W285-F300 AromaticContact NE1-CD1 3.25Å; W285-F300 AromaticContact NE1-CD2 3.8Å; W285-F300 AromaticContact NE1-CE1 3.46Å; W285-F300 AromaticContact NE1-CE2 3.98Å; W285-F300 AromaticContact NE1-CG 3.45Å; W285-F300 AromaticContact NE1-CZ 3.83Å; W285-I301 WeakPolarHBondContact CB-O 3.3Å; W285-F316 HydrophobicContact CB-CE1 4.33Å; W285-F316 AromaticContact CD1-CE1 3.88Å; W285-F316 AromaticContact CD2-CD1 3.75Å; W285-F316 HydrophobicContact CD2-CD1 3.75Å; W285-F316 AromaticContact CD2-CE1 3.68Å; W285-F316 HydrophobicContact CD2-CE1 3.68Å; W285-F316 AromaticContact CE2-CD1 3.51Å; W285-F316 AromaticContact CE2-CE1 3.78Å; W285-F316 HydrophobicContact CE3-CD1 4.1Å; W285-F316 HydrophobicContact CE3-CE1 4.24Å; W285-F316 HydrophobicContact CG-CD1 4.28Å; W285-F316 AromaticContact CG-CE1 3.74Å; W285-F316 HydrophobicContact CG-CE1 3.74Å; W285-F316 HydrophobicContact CH2-CD1 4.01Å; W285-F316 HydrophobicContact CZ2-CB 4.24Å; W285-F316 AromaticContact CZ2-CD1 3.63Å; W285-F316 HydrophobicContact CZ2-CD1 3.63Å; W285-F316 HydrophobicContact CZ2-CE1 4.36Å; W285-F316 HydrophobicContact CZ2-CG 4.24Å; W285-F316 HydrophobicContact CZ3-CD1 4.23Å; W285-F316 AromaticContact NE1-CD1 3.93Å; W285-F316 AromaticContact NE1-CE1 3.88Å; W285-G318 WeakPolarHBondContact CH2-O 3.34Å; W285-I319 HydrophobicContact CH2-CG1 4.14Å; W285-I319 HydrophobicContact CZ2-CD1 4.1Å; W285-I319 HydrophobicContact CZ2-CG1 3.66Å
286	V	98.4	Very high	93.2	Very high	0 Å²	0	52 Å²	52	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	133.9	-179.4	178.9	0	0	0	0	110.7	L174 C175 L178 A185 Y186 F300 I301	L174-V286 HydrophobicContact CB-CG2 4.17Å; L174-V286 HydrophobicContact CD2-CB 4.24Å; L174-V286 HydrophobicContact CD2-CG2 3.82Å; L174-V286 HydrophobicContact CG-CG2 4.04Å; C175-V286 HydrophobicContact CB-CG2 4.25Å; L178-V286 HydrophobicContact CD1-CG1 3.81Å; A185-V286 HydrophobicContact CB-CG1 4.22Å; Y186-V286 CarbonylContact O-C 3.53Å; Y186-V286 VanDerWaalsContact O-CA 3.29Å; Y186-V286 WeakPolarHBondContact O-CA 3.49Å; V286-F300 CarbonylContact O-C 3.5Å; V286-F300 WeakPolarHBondContact O-CA 3.35Å; V286-I301 HydrophobicContact CB-CB 4.42Å; V286-I301 PolarHBondContact N-O 3.47Å; V286-I301 VanDerWaalsContact N-O 3.11Å; V286-I301 PolarHBondContact O-N 2.57Å
287	L	98.1	Very high	93.3	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	132.4	169.3	167.1	64.6	0	0	0	109.2	A185 Y186 V188 L289 N298 F300 T311 I322 F344	A185-L287 CarbonylContact C-O 3.58Å; A185-L287 WeakPolarHBondContact CA-O 3.46Å; Y186-L287 PolarHBondContact N-O 3.03Å; Y186-L287 PolarHBondContact O-N 2.85Å; V188-L287 HydrophobicContact CG2-CB 3.46Å; V188-L287 VanDerWaalsContact CG2-CB 3.46Å; L287-L289 HydrophobicContact CD1-CD2 4.19Å; L287-L289 HydrophobicContact CD2-CD2 3.94Å; L287-L289 HydrophobicContact CD2-CG 4.49Å; L287-L289 HydrophobicContact CG-CD2 4.12Å; L287-L289 HydrophobicContact CG-CG 4.49Å; L287-N298 HydrophobicContact CD1-CB 4.4Å; L287-F300 HydrophobicContact CB-CD1 3.94Å; L287-F300 HydrophobicContact CB-CE1 3.95Å; L287-F300 HydrophobicContact CD1-CD1 3.82Å; L287-F300 HydrophobicContact CD1-CE1 3.63Å; L287-F300 HydrophobicContact CD2-CE1 4.49Å; L287-F300 HydrophobicContact CG-CD1 4.46Å; L287-F300 HydrophobicContact CG-CE1 4.22Å; L287-T311 HydrophobicContact CD1-CG2 4.36Å; L287-I322 HydrophobicContact CD2-CD1 4.4Å; L287-F344 HydrophobicContact CD1-CD1 4.35Å; L287-F344 HydrophobicContact CD1-CE1 4.39Å; L287-F344 HydrophobicContact CD2-CD1 3.59Å; L287-F344 HydrophobicContact CD2-CE1 3.95Å
288	I	97.8	Very high	93.4	Very high	0 Å²	0	52 Å²	52	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	123.6	167.5	-61.7	-172.2	0	0	0	108.2	W127 L178 Y183 V295 N298 F299 I301	W127-I288 HydrophobicContact CB-CD1 4.01Å; W127-I288 HydrophobicContact CG-CD1 4.42Å; L178-I288 HydrophobicContact CD1-CD1 4.09Å; L178-I288 HydrophobicContact CD2-CD1 4.34Å; Y183-I288 HydrophobicContact CD1-CD1 4.42Å; Y183-I288 HydrophobicContact CD1-CG2 4.42Å; I288-V295 HydrophobicContact CG2-CG1 4.12Å; I288-V295 HydrophobicContact CG2-CG2 4.12Å; I288-N298 WeakPolarHBondContact O-CA 3.46Å; I288-F299 HydrophobicContact CB-CD1 4.32Å; I288-F299 HydrophobicContact CB-CE1 3.94Å; I288-F299 HydrophobicContact CB-CE2 4.47Å; I288-F299 HydrophobicContact CB-CZ 4.05Å; I288-F299 HydrophobicContact CD1-CE1 4.31Å; I288-F299 HydrophobicContact CD1-CE2 3.97Å; I288-F299 HydrophobicContact CD1-CZ 3.6Å; I288-F299 HydrophobicContact CG1-CE2 4.46Å; I288-F299 HydrophobicContact CG1-CZ 4.25Å; I288-F299 HydrophobicContact CG2-CE1 3.95Å; I288-F299 HydrophobicContact CG2-CZ 4.28Å; I288-F299 PolarHBondContact N-O 2.79Å; I288-F299 PolarHBondContact O-N 2.91Å; I288-F299 VanDerWaalsContact O-N 3.16Å; I288-I301 HydrophobicContact CD1-CD1 3.43Å; I288-I301 VanDerWaalsContact CD1-CD1 3.43Å; I288-I301 HydrophobicContact CD1-CG1 4.39Å; I288-I301 HydrophobicContact CG1-CD1 4.09Å
289	L	95.8	Very high	93.7	Very high	17 Å²	17	47.8 Å²	47.8	9%	0.089	27%	0.265	C	S	.	.			trans	-86.5	144.1	172.6	-64.9	-178.1	0	0	0	111.1	N184 Y186 L287 N298 F344 L346	N184-L289 HydrophobicContact CB-CB 4.27Å; N184-L289 PolarHBondContact O-N 3.07Å; Y186-L289 HydrophobicContact CD2-CD1 4.24Å; Y186-L289 HydrophobicContact CD2-CG 4.19Å; Y186-L289 HydrophobicContact CE2-CD1 3.47Å; Y186-L289 VanDerWaalsContact CE2-CD1 3.47Å; Y186-L289 HydrophobicContact CE2-CG 3.79Å; L287-L289 HydrophobicContact CD1-CD2 4.19Å; L287-L289 HydrophobicContact CD2-CD2 3.94Å; L287-L289 HydrophobicContact CD2-CG 4.49Å; L287-L289 HydrophobicContact CG-CD2 4.12Å; L287-L289 HydrophobicContact CG-CG 4.49Å; L289-N298 WeakPolarHBondContact CA-OD1 3.5Å; L289-F344 HydrophobicContact CD2-CB 3.88Å; L289-L346 HydrophobicContact CD1-CD1 4.08Å; L289-L346 HydrophobicContact CD1-CG 4.38Å
290	S	93.7	Very high	94.1	Very high	54 Å²	54	46.4 Å²	46.4	38%	0.378	25%	0.251	S	S	.	.	S	Bend	trans	-62	156.2	176	60.4	0	0	0	0	112.6	V295 N298	S290-V295 WeakPolarHBondContact CA-O 3.29Å; S290-V295 WeakPolarHBondContact CB-O 3.43Å; S290-N298 PolarHBondContact N-OD1 2.85Å; S290-N298 PolarHBondContact OG-OD1 2.81Å
291	G	86.8	Confident	94.4	Very high	58 Å²	58	42 Å²	42	60%	0.598	23%	0.228	S	C	*	.	S	Bend	trans	114.4	-57.8	173.1	0	0	0	0	0	113.4	V295	G291-V295 PolarHBondContact N-O 3Å
292	N	88.3	Confident	94.5	Very high	83 Å²	83	41.4 Å²	41.4	44%	0.444	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-74.5	148	177.8	-69.4	24.2	0	0	0	110.7	N184 E294 V295	N184-N292 HydrophobicContact CB-CB 4.24Å; N292-E294 PolarHBondContact O-N 2.78Å; N292-V295 WeakPolarHBondContact O-CG2 3.4Å; N292-V295 PolarHBondContact O-N 3.09Å
293	R	87.8	Confident	94.4	Very high	122 Å²	122	40.9 Å²	40.9	46%	0.46	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	55.5	32.6	175.6	-73.9	-86.5	-179.3	151.9	-5.2	113.9	Y125 A181 Y183 V295	Y125-R293 PolarHBondContact O-NH1 3.34Å; A181-R293 PolarHBondContact O-NE 3.03Å; A181-R293 PolarHBondContact O-NH2 2.81Å; Y183-R293 HydrophobicContact CD1-CB 3.76Å; Y183-R293 HydrophobicContact CD1-CG 4.08Å; Y183-R293 HydrophobicContact CD2-CG 4.47Å; Y183-R293 HydrophobicContact CE1-CB 3.57Å; Y183-R293 HydrophobicContact CE1-CG 4.04Å; Y183-R293 HydrophobicContact CE2-CG 4.43Å; Y183-R293 HydrophobicContact CG-CB 4.46Å; Y183-R293 HydrophobicContact CG-CG 4.29Å; R293-V295 PolarHBondContact O-N 2.81Å
294	E	87.4	Confident	94.4	Very high	190 Å²	190	41 Å²	41	89%	0.888	22%	0.223	S	C	*	.	G	3₁₀ helix	trans	59.4	23.3	179.8	-56.9	178.9	-179.3	0	0	114.4	N292 P296	N292-E294 PolarHBondContact O-N 2.78Å; E294-P296 WeakPolarHBondContact O-CD 3.47Å
295	V	91.6	Very high	94.1	Very high	11 Å²	11	42.1 Å²	42.1	7%	0.067	23%	0.23	C	C	.	.			trans	-70.6	118.4	176.3	175.9	0	0	0	0	109.8	Y183 I288 S290 G291 N292 R293 E297 F299	Y183-V295 HydrophobicContact CD1-CG2 4.02Å; Y183-V295 HydrophobicContact CE1-CG2 4.03Å; I288-V295 HydrophobicContact CG2-CG1 4.12Å; I288-V295 HydrophobicContact CG2-CG2 4.12Å; S290-V295 WeakPolarHBondContact CA-O 3.29Å; S290-V295 WeakPolarHBondContact CB-O 3.43Å; G291-V295 PolarHBondContact N-O 3Å; N292-V295 WeakPolarHBondContact O-CG2 3.4Å; N292-V295 PolarHBondContact O-N 3.09Å; R293-V295 PolarHBondContact O-N 2.81Å; V295-E297 VanDerWaalsContact CG1-O 3.23Å; V295-E297 WeakPolarHBondContact CG1-O 3.35Å; V295-F299 HydrophobicContact CG1-CD1 4.1Å; V295-F299 HydrophobicContact CG1-CE1 3.7Å
296	P	90.6	Very high	93.9	Very high	121 Å²	121	42.9 Å²	42.9	79%	0.786	24%	0.238	S	C	*	.			trans	-79.6	-33.6	-171.3	29.9	-34.3	0	0	0	113.5	E294	E294-P296 WeakPolarHBondContact O-CD 3.47Å
297	E	93.8	Very high	93.7	Very high	133 Å²	133	46.1 Å²	46.1	62%	0.621	25%	0.252	S	S	*	.	S	Bend	trans	-141.9	158	-176.5	63.7	179.6	175.8	0	0	111	V295	V295-E297 VanDerWaalsContact CG1-O 3.23Å; V295-E297 WeakPolarHBondContact CG1-O 3.35Å
298	N	95.5	Very high	93.5	Very high	39 Å²	39	48.8 Å²	48.8	21%	0.209	27%	0.271	C	S	.	.			trans	-69.5	137.3	175.9	-60	-17.3	0	0	0	109.9	L287 I288 L289 S290 T311	L287-N298 HydrophobicContact CD1-CB 4.4Å; I288-N298 WeakPolarHBondContact O-CA 3.46Å; L289-N298 WeakPolarHBondContact CA-OD1 3.5Å; S290-N298 PolarHBondContact N-OD1 2.85Å; S290-N298 PolarHBondContact OG-OD1 2.81Å; N298-T311 HydrophobicContact CB-CG2 3.99Å
299	F	97	Very high	93.4	Very high	24 Å²	24	50.8 Å²	50.8	11%	0.105	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	158.7	175.3	67.9	-86.6	0	0	0	111.9	W127 I288 V295 I301	W127-F299 AromaticContact CD2-CE2 3.92Å; W127-F299 HydrophobicContact CD2-CE2 3.92Å; W127-F299 AromaticContact CD2-CZ 3.82Å; W127-F299 HydrophobicContact CD2-CZ 3.82Å; W127-F299 AromaticContact CE2-CZ 3.84Å; W127-F299 HydrophobicContact CE3-CE2 4.03Å; W127-F299 HydrophobicContact CE3-CZ 4.4Å; W127-F299 HydrophobicContact CG-CE2 4.5Å; W127-F299 HydrophobicContact CG-CZ 4.01Å; W127-F299 HydrophobicContact CH2-CE2 4.5Å; W127-F299 HydrophobicContact CZ2-CE2 4.36Å; W127-F299 HydrophobicContact CZ2-CZ 4.45Å; W127-F299 HydrophobicContact CZ3-CE2 4.33Å; W127-F299 AromaticContact NE1-CZ 4Å; I288-F299 HydrophobicContact CB-CD1 4.32Å; I288-F299 HydrophobicContact CB-CE1 3.94Å; I288-F299 HydrophobicContact CB-CE2 4.47Å; I288-F299 HydrophobicContact CB-CZ 4.05Å; I288-F299 HydrophobicContact CD1-CE1 4.31Å; I288-F299 HydrophobicContact CD1-CE2 3.97Å; I288-F299 HydrophobicContact CD1-CZ 3.6Å; I288-F299 HydrophobicContact CG1-CE2 4.46Å; I288-F299 HydrophobicContact CG1-CZ 4.25Å; I288-F299 HydrophobicContact CG2-CE1 3.95Å; I288-F299 HydrophobicContact CG2-CZ 4.28Å; I288-F299 PolarHBondContact N-O 2.79Å; I288-F299 PolarHBondContact O-N 2.91Å; I288-F299 VanDerWaalsContact O-N 3.16Å; V295-F299 HydrophobicContact CG1-CD1 4.1Å; V295-F299 HydrophobicContact CG1-CE1 3.7Å; F299-I301 HydrophobicContact CD2-CG1 4Å; F299-I301 HydrophobicContact CE2-CD1 3.89Å; F299-I301 HydrophobicContact CE2-CG1 3.58Å
300	F	97.7	Very high	93.3	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	146.4	173.6	-64	-42.2	0	0	0	110.8	W285 V286 L287 S308 L309 T311 F316 I319 C339 F344	W285-F300 AromaticContact CD1-CD1 3.58Å; W285-F300 AromaticContact CD1-CG 3.7Å; W285-F300 AromaticContact NE1-CD1 3.25Å; W285-F300 AromaticContact NE1-CD2 3.8Å; W285-F300 AromaticContact NE1-CE1 3.46Å; W285-F300 AromaticContact NE1-CE2 3.98Å; W285-F300 AromaticContact NE1-CG 3.45Å; W285-F300 AromaticContact NE1-CZ 3.83Å; V286-F300 CarbonylContact O-C 3.5Å; V286-F300 WeakPolarHBondContact O-CA 3.35Å; L287-F300 HydrophobicContact CB-CD1 3.94Å; L287-F300 HydrophobicContact CB-CE1 3.95Å; L287-F300 HydrophobicContact CD1-CD1 3.82Å; L287-F300 HydrophobicContact CD1-CE1 3.63Å; L287-F300 HydrophobicContact CD2-CE1 4.49Å; L287-F300 HydrophobicContact CG-CD1 4.46Å; L287-F300 HydrophobicContact CG-CE1 4.22Å; F300-S308 CarbonylContact O-C 3.56Å; F300-S308 VanDerWaalsContact O-CA 3.3Å; F300-S308 WeakPolarHBondContact O-CA 3.41Å; F300-L309 PolarHBondContact N-O 2.86Å; F300-L309 PolarHBondContact O-N 2.95Å; F300-T311 HydrophobicContact CD1-CG2 4.41Å; F300-T311 HydrophobicContact CD2-CG2 4.36Å; F300-T311 HydrophobicContact CE1-CG2 4.18Å; F300-T311 HydrophobicContact CE2-CG2 4.14Å; F300-T311 HydrophobicContact CG-CG2 4.49Å; F300-T311 HydrophobicContact CZ-CG2 4.02Å; F300-F316 HydrophobicContact CB-CE1 4.48Å; F300-F316 HydrophobicContact CB-CE2 3.91Å; F300-F316 HydrophobicContact CB-CZ 3.76Å; F300-F316 HydrophobicContact CD2-CD1 4.41Å; F300-F316 AromaticContact CD2-CD2 3.52Å; F300-F316 HydrophobicContact CD2-CD2 3.52Å; F300-F316 HydrophobicContact CD2-CE1 4.42Å; F300-F316 AromaticContact CD2-CE2 3.54Å; F300-F316 HydrophobicContact CD2-CE2 3.54Å; F300-F316 AromaticContact CD2-CG 3.97Å; F300-F316 HydrophobicContact CD2-CG 3.97Å; F300-F316 AromaticContact CD2-CZ 4Å; F300-F316 HydrophobicContact CD2-CZ 4Å; F300-F316 HydrophobicContact CE2-CB 4.45Å; F300-F316 HydrophobicContact CE2-CD2 4.06Å; F300-F316 HydrophobicContact CE2-CE2 4.5Å; F300-F316 HydrophobicContact CE2-CG 4.21Å; F300-F316 HydrophobicContact CG-CE2 4.17Å; F300-F316 HydrophobicContact CG-CZ 4.24Å; F300-I319 HydrophobicContact CE1-CD1 4.21Å; F300-I319 HydrophobicContact CZ-CD1 3.76Å; F300-C339 HydrophobicContact CE2-CB 4.07Å; F300-C339 HydrophobicContact CZ-CB 4.41Å; F300-F344 HydrophobicContact CE1-CE1 4.12Å; F300-F344 HydrophobicContact CE1-CZ 4.23Å; F300-F344 AromaticContact CZ-CE1 3.95Å; F300-F344 HydrophobicContact CZ-CE1 3.95Å; F300-F344 AromaticContact CZ-CZ 3.69Å; F300-F344 HydrophobicContact CZ-CZ 3.69Å
301	I	97.9	Very high	93.3	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	122.5	166.8	-58.9	170.4	0	0	0	107.5	W127 A131 L174 L178 W285 V286 I288 F299 P303	W127-I301 HydrophobicContact CB-CD1 4.39Å; W127-I301 HydrophobicContact CD2-CD1 4.3Å; W127-I301 HydrophobicContact CE3-CD1 3.64Å; W127-I301 HydrophobicContact CE3-CG1 4.05Å; W127-I301 HydrophobicContact CZ3-CD1 4.41Å; W127-I301 HydrophobicContact CZ3-CG1 4.36Å; A131-I301 HydrophobicContact CB-CG2 3.79Å; L174-I301 HydrophobicContact CD2-CB 4.29Å; L174-I301 HydrophobicContact CD2-CG2 3.72Å; L178-I301 HydrophobicContact CD1-CD1 4.06Å; W285-I301 WeakPolarHBondContact CB-O 3.3Å; V286-I301 HydrophobicContact CB-CB 4.42Å; V286-I301 PolarHBondContact N-O 3.47Å; V286-I301 VanDerWaalsContact N-O 3.11Å; V286-I301 PolarHBondContact O-N 2.57Å; I288-I301 HydrophobicContact CD1-CD1 3.43Å; I288-I301 VanDerWaalsContact CD1-CD1 3.43Å; I288-I301 HydrophobicContact CD1-CG1 4.39Å; I288-I301 HydrophobicContact CG1-CD1 4.09Å; F299-I301 HydrophobicContact CD2-CG1 4Å; F299-I301 HydrophobicContact CE2-CD1 3.89Å; F299-I301 HydrophobicContact CE2-CG1 3.58Å; I301-P303 VanDerWaalsContact O-CD 3.25Å; I301-P303 WeakPolarHBondContact O-CD 3.46Å
302	N	96.4	Very high	93.6	Very high	7 Å²	7	51.8 Å²	51.8	4%	0.037	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	107.4	166.2	174.4	0.9	0	0	0	108.4	L304 T305 G306 K307 L309	N302-L304 PolarHBondContact O-N 2.85Å; N302-L304 WeakPolarHBondContact OD1-CB 3.47Å; N302-L304 PolarHBondContact OD1-N 2.8Å; N302-T305 PolarHBondContact ND2-OG1 2.89Å; N302-T305 VanDerWaalsContact ND2-OG1 3.16Å; N302-T305 PolarHBondContact O-N 2.92Å; N302-T305 PolarHBondContact O-OG1 2.88Å; N302-G306 PolarHBondContact O-N 2.89Å; N302-K307 PolarHBondContact N-O 3.27Å; N302-L309 HydrophobicContact CB-CD1 4.25Å
303	P	95.8	Very high	93.9	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-21.2	-172.3	34.5	-41.1	0	0	0	112.5	S135 F170 S171 L174 I301	S135-P303 WeakPolarHBondContact CA-O 3.25Å; S135-P303 WeakPolarHBondContact CB-O 3.36Å; F170-P303 HydrophobicContact CB-CB 3.97Å; F170-P303 HydrophobicContact CB-CG 4.03Å; S171-P303 WeakPolarHBondContact OG-CG 3.33Å; L174-P303 HydrophobicContact CD2-CB 3.78Å; I301-P303 VanDerWaalsContact O-CD 3.25Å; I301-P303 WeakPolarHBondContact O-CD 3.46Å
304	L	95.5	Very high	94	Very high	1 Å²	1	53.4 Å²	53.4	1%	0.005	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72	-30.4	178.3	-56.6	-174.3	0	0	0	112.6	L140 C167 F170 L199 N302	L140-L304 HydrophobicContact CD1-CD1 4.11Å; L140-L304 HydrophobicContact CD1-CD2 3.84Å; L140-L304 HydrophobicContact CD2-CD1 4.03Å; C167-L304 HydrophobicContact CB-CD2 4.44Å; F170-L304 HydrophobicContact CB-CD2 4.18Å; F170-L304 HydrophobicContact CD1-CD2 3.54Å; F170-L304 HydrophobicContact CD2-CD2 3.97Å; F170-L304 HydrophobicContact CE1-CD2 3.67Å; F170-L304 HydrophobicContact CE2-CD2 4.08Å; F170-L304 HydrophobicContact CG-CD2 3.65Å; F170-L304 HydrophobicContact CZ-CD2 3.91Å; L199-L304 HydrophobicContact CB-CD1 4.36Å; L199-L304 HydrophobicContact CD1-CB 3.86Å; L199-L304 HydrophobicContact CD2-CB 4.33Å; L199-L304 HydrophobicContact CG-CB 4.5Å; N302-L304 PolarHBondContact O-N 2.85Å; N302-L304 WeakPolarHBondContact OD1-CB 3.47Å; N302-L304 PolarHBondContact OD1-N 2.8Å
305	T	92.9	Very high	94.2	Very high	25 Å²	25	46.3 Å²	46.3	15%	0.153	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.9	-15.4	-179.1	57.7	0	0	0	0	113.4	L199 Q201 N302 K307	L199-T305 HydrophobicContact CD1-CG2 3.46Å; L199-T305 VanDerWaalsContact CD1-CG2 3.46Å; Q201-T305 HydrophobicContact CG-CG2 4.47Å; N302-T305 PolarHBondContact ND2-OG1 2.89Å; N302-T305 VanDerWaalsContact ND2-OG1 3.16Å; N302-T305 PolarHBondContact O-N 2.92Å; N302-T305 PolarHBondContact O-OG1 2.88Å; T305-K307 PolarHBondContact O-N 2.88Å
306	G	93.6	Very high	94.4	Very high	15 Å²	15	45.9 Å²	45.9	16%	0.155	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.7	8.7	-174.9	0	0	0	0	0	114.2	N302	N302-G306 PolarHBondContact O-N 2.89Å
307	K	93.4	Very high	94.5	Very high	69 Å²	69	42.2 Å²	42.2	30%	0.3	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	138.5	-176.6	-65.4	179.3	-177.7	173	0	111.3	N302 T305	N302-K307 PolarHBondContact N-O 3.27Å; T305-K307 PolarHBondContact O-N 2.88Å
308	S	94.9	Very high	94.6	Very high	56 Å²	56	36 Å²	36	39%	0.392	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	145	164.1	57.3	0	0	0	0	111	W127 F300	W127-S308 WeakPolarHBondContact CH2-OG 3.34Å; F300-S308 CarbonylContact O-C 3.56Å; F300-S308 VanDerWaalsContact O-CA 3.3Å; F300-S308 WeakPolarHBondContact O-CA 3.41Å
309	L	94.5	Very high	94.6	Very high	41 Å²	41	34.1 Å²	34.1	22%	0.215	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	142.2	-179.6	-62.9	168.5	0	0	0	108	M196 F300 N302 N313 F316	M196-L309 HydrophobicContact CE-CD1 3.7Å; F300-L309 PolarHBondContact N-O 2.86Å; F300-L309 PolarHBondContact O-N 2.95Å; N302-L309 HydrophobicContact CB-CD1 4.25Å; L309-N313 HydrophobicContact CB-CB 4.39Å; L309-F316 HydrophobicContact CB-CE2 3.82Å; L309-F316 HydrophobicContact CB-CZ 4.29Å; L309-F316 HydrophobicContact CD1-CE2 3.7Å; L309-F316 HydrophobicContact CD1-CZ 3.63Å; L309-F316 HydrophobicContact CG-CE2 4.41Å
310	S	95.3	Very high	94.5	Very high	55 Å²	55	34.7 Å²	34.7	39%	0.385	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	147.2	172.3	177.5	0	0	0	0	110.6	T312 N313	S310-T312 PolarHBondContact O-N 2.77Å; S310-T312 VanDerWaalsContact O-N 3.12Å; S310-T312 PolarHBondContact OG-N 3.44Å; S310-T312 PolarHBondContact OG-OG1 2.83Å; S310-N313 WeakPolarHBondContact O-CB 3.44Å; S310-N313 PolarHBondContact O-N 3.09Å
311	T	93.1	Very high	94.4	Very high	20 Å²	20	34.8 Å²	34.8	12%	0.123	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-22	172.8	49.7	0	0	0	0	113.1	L287 N298 F300 N313 C339 F344	L287-T311 HydrophobicContact CD1-CG2 4.36Å; N298-T311 HydrophobicContact CB-CG2 3.99Å; F300-T311 HydrophobicContact CD1-CG2 4.41Å; F300-T311 HydrophobicContact CD2-CG2 4.36Å; F300-T311 HydrophobicContact CE1-CG2 4.18Å; F300-T311 HydrophobicContact CE2-CG2 4.14Å; F300-T311 HydrophobicContact CG-CG2 4.49Å; F300-T311 HydrophobicContact CZ-CG2 4.02Å; T311-N313 VanDerWaalsContact C-N 3.34Å; T311-C339 VanDerWaalsContact O-CB 3.23Å; T311-C339 WeakPolarHBondContact O-CB 3.31Å; T311-F344 HydrophobicContact CG2-CE2 3.85Å; T311-F344 HydrophobicContact CG2-CZ 4.02Å
312	T	93.5	Very high	94.4	Very high	76 Å²	76	34.8 Å²	34.8	47%	0.466	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	3.4	178.3	64.2	0	0	0	0	114.3	S310 K314	S310-T312 PolarHBondContact O-N 2.77Å; S310-T312 VanDerWaalsContact O-N 3.12Å; S310-T312 PolarHBondContact OG-N 3.44Å; S310-T312 PolarHBondContact OG-OG1 2.83Å; T312-K314 PolarHBondContact O-N 3.41Å
313	N	92.8	Very high	94.4	Very high	47 Å²	47	34.4 Å²	34.4	25%	0.251	19%	0.19	S	C	.	.			trans	-67.2	130.1	-175.6	-169.3	-52.4	0	0	0	111.9	L309 S310 T311 C315 F316	L309-N313 HydrophobicContact CB-CB 4.39Å; S310-N313 WeakPolarHBondContact O-CB 3.44Å; S310-N313 PolarHBondContact O-N 3.09Å; T311-N313 VanDerWaalsContact C-N 3.34Å; N313-C315 PolarHBondContact O-N 3.02Å; N313-C315 WeakPolarHBondContact OD1-CB 3.33Å; N313-C315 PolarHBondContact OD1-N 3.31Å; N313-C315 PolarHBondContact OD1-SG 3.08Å; N313-C315 VanDerWaalsContact OD1-SG 3.34Å; N313-F316 HydrophobicContact CB-CD2 4Å; N313-F316 HydrophobicContact CB-CE2 4.14Å; N313-F316 PolarHBondContact O-N 2.65Å; N313-F316 VanDerWaalsContact O-N 3.15Å
314	K	91.6	Very high	94.5	Very high	191 Å²	191	34.5 Å²	34.5	83%	0.83	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.3	-15.4	-177.1	-61.2	-178	-179.3	179.7	0	114.7	T312 F316	T312-K314 PolarHBondContact O-N 3.41Å; K314-F316 PolarHBondContact O-N 3.12Å
315	C	91.8	Very high	94.4	Very high	42 Å²	42	37.6 Å²	37.6	28%	0.284	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-21	176.2	-66	0	0	0	0	113.2	A192 V193 M196 N313	A192-C315 WeakPolarHBondContact CA-O 3.3Å; V193-C315 HydrophobicContact CG2-CB 3.89Å; V193-C315 PolarHBondContact N-O 3.22Å; V193-C315 VanDerWaalsContact N-O 3.1Å; M196-C315 HydrophobicContact CE-CB 3.46Å; M196-C315 VanDerWaalsContact CE-CB 3.46Å; M196-C315 HydrophobicContact SD-CB 4.44Å; N313-C315 PolarHBondContact O-N 3.02Å; N313-C315 WeakPolarHBondContact OD1-CB 3.33Å; N313-C315 PolarHBondContact OD1-N 3.31Å; N313-C315 PolarHBondContact OD1-SG 3.08Å; N313-C315 VanDerWaalsContact OD1-SG 3.34Å
316	F	94.3	Very high	94.4	Very high	1 Å²	1	41.4 Å²	41.4	0%	0.004	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	110.7	177.2	-55.2	-75.2	0	0	0	109.9	M196 W285 F300 L309 N313 K314	M196-F316 HydrophobicContact CE-CE1 4.06Å; M196-F316 HydrophobicContact CE-CE2 4.46Å; M196-F316 HydrophobicContact CE-CZ 3.95Å; M196-F316 HydrophobicContact SD-CD1 4.08Å; M196-F316 HydrophobicContact SD-CE1 3.58Å; M196-F316 VanDerWaalsContact SD-CE1 3.58Å; M196-F316 HydrophobicContact SD-CZ 4.08Å; W285-F316 HydrophobicContact CB-CE1 4.33Å; W285-F316 AromaticContact CD1-CE1 3.88Å; W285-F316 AromaticContact CD2-CD1 3.75Å; W285-F316 HydrophobicContact CD2-CD1 3.75Å; W285-F316 AromaticContact CD2-CE1 3.68Å; W285-F316 HydrophobicContact CD2-CE1 3.68Å; W285-F316 AromaticContact CE2-CD1 3.51Å; W285-F316 AromaticContact CE2-CE1 3.78Å; W285-F316 HydrophobicContact CE3-CD1 4.1Å; W285-F316 HydrophobicContact CE3-CE1 4.24Å; W285-F316 HydrophobicContact CG-CD1 4.28Å; W285-F316 AromaticContact CG-CE1 3.74Å; W285-F316 HydrophobicContact CG-CE1 3.74Å; W285-F316 HydrophobicContact CH2-CD1 4.01Å; W285-F316 HydrophobicContact CZ2-CB 4.24Å; W285-F316 AromaticContact CZ2-CD1 3.63Å; W285-F316 HydrophobicContact CZ2-CD1 3.63Å; W285-F316 HydrophobicContact CZ2-CE1 4.36Å; W285-F316 HydrophobicContact CZ2-CG 4.24Å; W285-F316 HydrophobicContact CZ3-CD1 4.23Å; W285-F316 AromaticContact NE1-CD1 3.93Å; W285-F316 AromaticContact NE1-CE1 3.88Å; F300-F316 HydrophobicContact CB-CE1 4.48Å; F300-F316 HydrophobicContact CB-CE2 3.91Å; F300-F316 HydrophobicContact CB-CZ 3.76Å; F300-F316 HydrophobicContact CD2-CD1 4.41Å; F300-F316 AromaticContact CD2-CD2 3.52Å; F300-F316 HydrophobicContact CD2-CD2 3.52Å; F300-F316 HydrophobicContact CD2-CE1 4.42Å; F300-F316 AromaticContact CD2-CE2 3.54Å; F300-F316 HydrophobicContact CD2-CE2 3.54Å; F300-F316 AromaticContact CD2-CG 3.97Å; F300-F316 HydrophobicContact CD2-CG 3.97Å; F300-F316 AromaticContact CD2-CZ 4Å; F300-F316 HydrophobicContact CD2-CZ 4Å; F300-F316 HydrophobicContact CE2-CB 4.45Å; F300-F316 HydrophobicContact CE2-CD2 4.06Å; F300-F316 HydrophobicContact CE2-CE2 4.5Å; F300-F316 HydrophobicContact CE2-CG 4.21Å; F300-F316 HydrophobicContact CG-CE2 4.17Å; F300-F316 HydrophobicContact CG-CZ 4.24Å; L309-F316 HydrophobicContact CB-CE2 3.82Å; L309-F316 HydrophobicContact CB-CZ 4.29Å; L309-F316 HydrophobicContact CD1-CE2 3.7Å; L309-F316 HydrophobicContact CD1-CZ 3.63Å; L309-F316 HydrophobicContact CG-CE2 4.41Å; N313-F316 HydrophobicContact CB-CD2 4Å; N313-F316 HydrophobicContact CB-CE2 4.14Å; N313-F316 PolarHBondContact O-N 2.65Å; N313-F316 VanDerWaalsContact O-N 3.15Å; K314-F316 PolarHBondContact O-N 3.12Å
317	L	94.3	Very high	94.4	Very high	45 Å²	45	41.3 Å²	41.3	24%	0.236	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-12	-168.9	-56.8	178	0	0	0	113.4	Y191 V193 L278 G338	Y191-L317 PolarHBondContact O-N 3.07Å; V193-L317 HydrophobicContact CG1-CD1 4.19Å; V193-L317 HydrophobicContact CG1-CD2 4.09Å; V193-L317 HydrophobicContact CG1-CG 4.26Å; L278-L317 HydrophobicContact CD1-CD1 3.84Å; L278-L317 HydrophobicContact CG-CD1 4.47Å; L317-G338 WeakPolarHBondContact O-CA 3.39Å
318	G	94.4	Very high	94.5	Very high	2 Å²	2	38 Å²	38	2%	0.021	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	163.4	162.5	175.2	0	0	0	0	0	112.2	G190 Y191 W285	G190-G318 CarbonylContact C-O 3.52Å; G190-G318 VanDerWaalsContact CA-O 3.26Å; G190-G318 WeakPolarHBondContact CA-O 2.99Å; Y191-G318 PolarHBondContact N-O 3.34Å; W285-G318 WeakPolarHBondContact CH2-O 3.34Å
319	I	95.7	Very high	94.5	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	130.6	179.6	-65.6	174.5	0	0	0	108.8	V188 W285 F300 I322 N331 M342 F344 W352	V188-I319 HydrophobicContact CG1-CB 4.31Å; V188-I319 HydrophobicContact CG1-CD1 3.7Å; V188-I319 HydrophobicContact CG1-CG1 3.64Å; V188-I319 HydrophobicContact CG1-CG2 3.81Å; W285-I319 HydrophobicContact CH2-CG1 4.14Å; W285-I319 HydrophobicContact CZ2-CD1 4.1Å; W285-I319 HydrophobicContact CZ2-CG1 3.66Å; F300-I319 HydrophobicContact CE1-CD1 4.21Å; F300-I319 HydrophobicContact CZ-CD1 3.76Å; I319-I322 HydrophobicContact CG2-CG2 3.87Å; I319-N331 HydrophobicContact CG2-CB 4.46Å; I319-N331 WeakPolarHBondContact O-CB 3.43Å; I319-N331 PolarHBondContact O-ND2 2.78Å; I319-M342 HydrophobicContact CB-CE 3.86Å; I319-M342 HydrophobicContact CB-SD 4.15Å; I319-M342 HydrophobicContact CD1-CE 4.06Å; I319-M342 HydrophobicContact CD1-SD 3.89Å; I319-M342 HydrophobicContact CG1-CE 4.45Å; I319-M342 HydrophobicContact CG1-SD 4.3Å; I319-M342 HydrophobicContact CG2-CE 4.15Å; I319-F344 HydrophobicContact CD1-CE1 4.09Å; I319-W352 HydrophobicContact CG2-CH2 4.17Å
320	E	94.7	Very high	94.6	Very high	36 Å²	36	34.2 Å²	34.2	17%	0.168	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	-44.4	174.3	-72.8	-62.2	142.2	0	0	111.1	R93 S189 Y191 N331	R93-E320 IonicContact CZ-OE2 3.55Å; R93-E320 IonicContact NE-OE2 3.59Å; R93-E320 PolarHBondContact NE-OE2 2.79Å; R93-E320 IonicContact NH2-OE2 2.74Å; R93-E320 PolarHBondContact NH2-OE2 2.82Å; S189-E320 PolarHBondContact O-N 3.38Å; Y191-E320 HydrophobicContact CE2-CG 3.69Å; Y191-E320 VanDerWaalsContact CE2-OE1 3.29Å; Y191-E320 WeakPolarHBondContact CE2-OE1 3.05Å; E320-N331 PolarHBondContact O-N 2.88Å
321	S	96.4	Very high	94.6	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.007	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	155.4	-175.9	63.9	0	0	0	0	112.2	S189 Y328 W329	S189-S321 PolarHBondContact N-O 3.19Å; S189-S321 PolarHBondContact O-N 3.03Å; S321-Y328 VanDerWaalsContact CB-CZ 3.47Å; S321-Y328 WeakPolarHBondContact CB-OH 3.16Å; S321-Y328 PolarHBondContact OG-OH 3.31Å; S321-W329 CarbonylContact C-O 3.59Å; S321-W329 VanDerWaalsContact CA-O 3.23Å; S321-W329 WeakPolarHBondContact CA-O 3.43Å; S321-W329 WeakPolarHBondContact CB-O 3.23Å
322	I	97.6	Very high	94.6	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	153.1	170.4	69.2	173.9	0	0	0	110.6	Y186 C187 V188 L287 I319 W329 L346 W352	Y186-I322 HydrophobicContact CD1-CD1 4.14Å; Y186-I322 HydrophobicContact CD1-CG1 4.47Å; Y186-I322 HydrophobicContact CG-CD1 4.37Å; C187-I322 CarbonylContact O-C 3.58Å; C187-I322 WeakPolarHBondContact O-CA 3.15Å; V188-I322 HydrophobicContact CB-CG2 4.18Å; V188-I322 HydrophobicContact CG1-CG2 3.99Å; V188-I322 HydrophobicContact CG2-CG2 3.84Å; L287-I322 HydrophobicContact CD2-CD1 4.4Å; I319-I322 HydrophobicContact CG2-CG2 3.87Å; I322-W329 HydrophobicContact CG1-CB 3.85Å; I322-W329 HydrophobicContact CG1-CE3 4.34Å; I322-W329 PolarHBondContact N-O 3.23Å; I322-W329 PolarHBondContact O-N 2.97Å; I322-L346 HydrophobicContact CD1-CD1 3.72Å; I322-L346 HydrophobicContact CD1-CD2 3.43Å; I322-L346 VanDerWaalsContact CD1-CD2 3.43Å; I322-L346 HydrophobicContact CD1-CG 4.21Å; I322-W352 HydrophobicContact CD1-CE3 4.46Å; I322-W352 HydrophobicContact CD1-CH2 3.92Å; I322-W352 HydrophobicContact CD1-CZ2 4.4Å; I322-W352 HydrophobicContact CD1-CZ3 3.97Å; I322-W352 HydrophobicContact CG1-CE3 4.36Å; I322-W352 HydrophobicContact CG1-CH2 4.15Å; I322-W352 HydrophobicContact CG1-CZ3 3.79Å; I322-W352 HydrophobicContact CG2-CH2 3.93Å; I322-W352 HydrophobicContact CG2-CZ3 4.08Å
323	W	97.4	Very high	94.6	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	156.2	176.2	66	97	0	0	0	112.4	V110 F168 Y186 C187 N327 Y328	V110-W323 HydrophobicContact CB-CD2 4.48Å; V110-W323 HydrophobicContact CB-CZ2 4.45Å; V110-W323 HydrophobicContact CG2-CD2 3.98Å; V110-W323 HydrophobicContact CG2-CG 3.92Å; F168-W323 HydrophobicContact CD1-CH2 4.05Å; F168-W323 HydrophobicContact CD1-CZ2 4.5Å; F168-W323 HydrophobicContact CE1-CH2 4.06Å; Y186-W323 CarbonylContact C-O 3.51Å; Y186-W323 VanDerWaalsContact CA-O 3.31Å; Y186-W323 WeakPolarHBondContact CA-O 3.25Å; C187-W323 HydrophobicContact CB-CD2 3.77Å; C187-W323 HydrophobicContact CB-CE3 4.26Å; C187-W323 HydrophobicContact CB-CG 4.31Å; C187-W323 HydrophobicContact CB-CH2 3.91Å; C187-W323 HydrophobicContact CB-CZ2 3.4Å; C187-W323 VanDerWaalsContact CB-CZ2 3.4Å; C187-W323 HydrophobicContact CB-CZ3 4.3Å; C187-W323 PolarHBondContact N-O 3.07Å; C187-W323 PolarHBondContact O-N 3.15Å; W323-N327 WeakPolarHBondContact CA-O 3.27Å; W323-N327 WeakPolarHBondContact CB-O 3.31Å; W323-Y328 HydrophobicContact CB-CD2 3.58Å; W323-Y328 HydrophobicContact CB-CE2 4.29Å; W323-Y328 HydrophobicContact CB-CG 4.21Å; W323-Y328 HydrophobicContact CD2-CD2 4.32Å; W323-Y328 HydrophobicContact CD2-CE2 4.22Å; W323-Y328 HydrophobicContact CE3-CD2 4.29Å; W323-Y328 AromaticContact CE3-CE2 3.83Å; W323-Y328 HydrophobicContact CE3-CE2 3.83Å; W323-Y328 HydrophobicContact CG-CD2 4.06Å; W323-Y328 HydrophobicContact CG-CE2 4.43Å
324	N	96.1	Very high	94.4	Very high	2 Å²	2	34.5 Å²	34.5	1%	0.011	17%	0.168	C	C	.	.			trans	-133.5	-167.5	171.5	70.9	5	0	0	0	109.4	S111 L114 A185 Y186 Q326 N327 W329	S111-N324 WeakPolarHBondContact CB-O 3.47Å; S111-N324 PolarHBondContact OG-O 3.03Å; L114-N324 VanDerWaalsContact CD1-C 3.4Å; A185-N324 WeakPolarHBondContact O-CB 3.41Å; Y186-N324 HydrophobicContact CD1-CB 3.73Å; Y186-N324 HydrophobicContact CE1-CB 3.89Å; Y186-N324 VanDerWaalsContact CE1-ND2 3.26Å; Y186-N324 WeakPolarHBondContact CE1-ND2 3.28Å; Y186-N324 HydrophobicContact CG-CB 4.37Å; N324-Q326 PolarHBondContact O-N 2.87Å; N324-Q326 WeakPolarHBondContact OD1-CA 3.36Å; N324-Q326 WeakPolarHBondContact OD1-CB 3.42Å; N324-Q326 PolarHBondContact OD1-N 3.34Å; N324-N327 PolarHBondContact N-O 2.78Å; N324-N327 VanDerWaalsContact N-O 3.09Å; N324-N327 PolarHBondContact OD1-N 2.91Å; N324-W329 WeakPolarHBondContact OD1-CZ3 2.83Å
325	H	94.6	Very high	94.2	Very high	66 Å²	66	26.9 Å²	26.9	31%	0.306	14%	0.138	S	C	.	.	S	Bend	trans	-70.8	-4.6	179.6	68.3	-74.1	0	0	0	114.4	L114 P116 L179	L114-H325 HydrophobicContact CB-CB 4.28Å; P116-H325 HydrophobicContact CG-CB 3.86Å; L179-H325 HydrophobicContact CD1-CB 4.16Å; L179-H325 WeakPolarHBondContact CD1-ND1 3.23Å; L179-H325 WeakPolarHBondContact CD2-ND1 3.2Å
326	Q	92.3	Very high	93.9	Very high	104 Å²	104	34.7 Å²	34.7	49%	0.486	16%	0.162	S	C	.	.	S	Bend	trans	-111.5	-36.6	-174.4	-59.8	179.2	-24.1	0	0	112.7	N324 M392	N324-Q326 PolarHBondContact O-N 2.87Å; N324-Q326 WeakPolarHBondContact OD1-CA 3.36Å; N324-Q326 WeakPolarHBondContact OD1-CB 3.42Å; N324-Q326 PolarHBondContact OD1-N 3.34Å; Q326-M392 WeakPolarHBondContact O-CB 3.36Å; Q326-M392 WeakPolarHBondContact O-CE 3.33Å
327	N	93.6	Very high	93.4	Very high	13 Å²	13	42.1 Å²	42.1	7%	0.07	19%	0.194	C	C	.	.			trans	-158.6	176.1	-176.4	-149.3	-11.3	0	0	0	112.7	S111 W323 N324 W329 L356	S111-N327 PolarHBondContact OG-O 2.78Å; W323-N327 WeakPolarHBondContact CA-O 3.27Å; W323-N327 WeakPolarHBondContact CB-O 3.31Å; N324-N327 PolarHBondContact N-O 2.78Å; N324-N327 VanDerWaalsContact N-O 3.09Å; N324-N327 PolarHBondContact OD1-N 2.91Å; N327-W329 VanDerWaalsContact C-CZ3 3.47Å; N327-W329 HydrophobicContact CB-CD2 4.44Å; N327-W329 HydrophobicContact CB-CE3 4.21Å; N327-W329 HydrophobicContact CB-CH2 3.39Å; N327-W329 HydrophobicContact CB-CZ2 3.63Å; N327-W329 HydrophobicContact CB-CZ3 3.69Å; N327-W329 WeakPolarHBondContact O-CZ3 3.1Å; N327-L356 PolarHBondContact ND2-O 2.75Å; N327-L356 WeakPolarHBondContact OD1-CB 3.21Å; N327-L356 PolarHBondContact OD1-N 2.79Å
328	Y	95.3	Very high	93.1	Very high	1 Å²	1	40.7 Å²	40.7	0%	0.004	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	133.4	175	-171.8	-81	0	0	0	109.5	L96 L97 L98 F109 V110 S321 W323 V330 Y354 L355	L96-Y328 HydrophobicContact CD1-CE1 4.41Å; L97-Y328 WeakPolarHBondContact O-CE2 3.36Å; L97-Y328 PolarHBondContact O-OH 3.1Å; L98-Y328 HydrophobicContact CD2-CD1 3.74Å; L98-Y328 HydrophobicContact CD2-CD2 4.03Å; L98-Y328 HydrophobicContact CD2-CE1 3.46Å; L98-Y328 VanDerWaalsContact CD2-CE1 3.46Å; L98-Y328 HydrophobicContact CD2-CE2 3.8Å; L98-Y328 HydrophobicContact CD2-CG 4Å; L98-Y328 VanDerWaalsContact CD2-CZ 3.47Å; F109-Y328 HydrophobicContact CZ-CD2 4.22Å; F109-Y328 HydrophobicContact CZ-CG 4.17Å; V110-Y328 HydrophobicContact CG2-CD2 3.62Å; V110-Y328 HydrophobicContact CG2-CE2 3.69Å; S321-Y328 VanDerWaalsContact CB-CZ 3.47Å; S321-Y328 WeakPolarHBondContact CB-OH 3.16Å; S321-Y328 PolarHBondContact OG-OH 3.31Å; W323-Y328 HydrophobicContact CB-CD2 3.58Å; W323-Y328 HydrophobicContact CB-CE2 4.29Å; W323-Y328 HydrophobicContact CB-CG 4.21Å; W323-Y328 HydrophobicContact CD2-CD2 4.32Å; W323-Y328 HydrophobicContact CD2-CE2 4.22Å; W323-Y328 HydrophobicContact CE3-CD2 4.29Å; W323-Y328 AromaticContact CE3-CE2 3.83Å; W323-Y328 HydrophobicContact CE3-CE2 3.83Å; W323-Y328 HydrophobicContact CG-CD2 4.06Å; W323-Y328 HydrophobicContact CG-CE2 4.43Å; Y328-V330 HydrophobicContact CD1-CG2 4.24Å; Y328-V330 HydrophobicContact CE1-CG2 3.85Å; Y328-Y354 WeakPolarHBondContact O-CA 3.38Å; Y328-L355 PolarHBondContact O-N 2.81Å
329	W	96.1	Very high	92.9	Very high	16 Å²	16	40.8 Å²	40.8	6%	0.061	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	134.7	-179.9	-63.1	-99.9	0	0	0	110.9	Y186 S321 I322 N324 N327 L346 W352 E353	Y186-W329 HydrophobicContact CD1-CE3 4.29Å; Y186-W329 AromaticContact CD1-CZ3 3.9Å; Y186-W329 HydrophobicContact CD1-CZ3 3.9Å; Y186-W329 HydrophobicContact CE1-CE3 4.18Å; Y186-W329 AromaticContact CE1-CH2 3.79Å; Y186-W329 HydrophobicContact CE1-CH2 3.79Å; Y186-W329 AromaticContact CE1-CZ3 3.54Å; Y186-W329 HydrophobicContact CE1-CZ3 3.54Å; S321-W329 CarbonylContact C-O 3.59Å; S321-W329 VanDerWaalsContact CA-O 3.23Å; S321-W329 WeakPolarHBondContact CA-O 3.43Å; S321-W329 WeakPolarHBondContact CB-O 3.23Å; I322-W329 HydrophobicContact CG1-CB 3.85Å; I322-W329 HydrophobicContact CG1-CE3 4.34Å; I322-W329 PolarHBondContact N-O 3.23Å; I322-W329 PolarHBondContact O-N 2.97Å; N324-W329 WeakPolarHBondContact OD1-CZ3 2.83Å; N327-W329 VanDerWaalsContact C-CZ3 3.47Å; N327-W329 HydrophobicContact CB-CD2 4.44Å; N327-W329 HydrophobicContact CB-CE3 4.21Å; N327-W329 HydrophobicContact CB-CH2 3.39Å; N327-W329 HydrophobicContact CB-CZ2 3.63Å; N327-W329 HydrophobicContact CB-CZ3 3.69Å; N327-W329 WeakPolarHBondContact O-CZ3 3.1Å; W329-L346 HydrophobicContact CD2-CD1 4.26Å; W329-L346 HydrophobicContact CZ2-CD1 4.42Å; W329-W352 HydrophobicContact CB-CE3 3.93Å; W329-E353 CarbonylContact C-O 3.53Å; W329-E353 VanDerWaalsContact CA-O 3.29Å; W329-E353 WeakPolarHBondContact CA-O 3.44Å
330	V	95.8	Very high	92.5	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	133	174.2	-176.8	0	0	0	0	108.7	F82 Y86 L96 Y328 M332 W352 E353	F82-V330 HydrophobicContact CE1-CG2 3.72Å; F82-V330 HydrophobicContact CZ-CG2 3.79Å; Y86-V330 HydrophobicContact CD2-CG1 4.36Å; Y86-V330 HydrophobicContact CE2-CG1 3.75Å; L96-V330 HydrophobicContact CD1-CG1 4.31Å; L96-V330 HydrophobicContact CD1-CG2 3.51Å; L96-V330 HydrophobicContact CD2-CG1 4.38Å; L96-V330 HydrophobicContact CD2-CG2 4.49Å; Y328-V330 HydrophobicContact CD1-CG2 4.24Å; Y328-V330 HydrophobicContact CE1-CG2 3.85Å; V330-M332 HydrophobicContact CB-SD 4.41Å; V330-M332 HydrophobicContact CG1-SD 3.87Å; V330-W352 WeakPolarHBondContact O-CA 3.42Å; V330-E353 HydrophobicContact CB-CB 4.45Å; V330-E353 PolarHBondContact N-O 2.84Å; V330-E353 PolarHBondContact O-N 2.78Å
331	N	95.2	Very high	92.2	Very high	3 Å²	3	49.2 Å²	49.2	2%	0.016	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	129.1	174.3	-179.4	32	0	0	0	110.3	R93 I319 E320 Q333 C335 M342 W352	R93-N331 PolarHBondContact NH1-O 3.14Å; R93-N331 PolarHBondContact NH2-O 2.76Å; I319-N331 HydrophobicContact CG2-CB 4.46Å; I319-N331 WeakPolarHBondContact O-CB 3.43Å; I319-N331 PolarHBondContact O-ND2 2.78Å; E320-N331 PolarHBondContact O-N 2.88Å; N331-Q333 VanDerWaalsContact OD1-CB 3.25Å; N331-Q333 WeakPolarHBondContact OD1-CB 3.46Å; N331-Q333 WeakPolarHBondContact OD1-CG 3.47Å; N331-Q333 PolarHBondContact OD1-N 3.01Å; N331-Q333 PolarHBondContact OD1-NE2 3.16Å; N331-C335 PolarHBondContact ND2-SG 3.39Å; N331-M342 HydrophobicContact CB-CE 4.07Å; N331-M342 WeakPolarHBondContact ND2-CE 3.31Å; N331-M342 WeakPolarHBondContact OD1-CE 3.35Å; N331-W352 HydrophobicContact CB-CE3 4.17Å; N331-W352 HydrophobicContact CB-CH2 4.15Å; N331-W352 HydrophobicContact CB-CZ3 3.71Å
332	M	93.4	Very high	91.9	Very high	51 Å²	51	50.2 Å²	50.2	25%	0.251	24%	0.244	S	C	.	.			trans	-109.7	0.9	177.3	-53.5	-49.9	-72.2	0	0	112.7	Y90 V330 V350 K351 E353	Y90-M332 HydrophobicContact CE1-CE 4.15Å; Y90-M332 HydrophobicContact CE2-CE 3.78Å; Y90-M332 WeakPolarHBondContact OH-CE 3.3Å; V330-M332 HydrophobicContact CB-SD 4.41Å; V330-M332 HydrophobicContact CG1-SD 3.87Å; M332-V350 WeakPolarHBondContact CB-O 3.43Å; M332-K351 PolarHBondContact N-O 3.34Å; M332-E353 HydrophobicContact CG-CB 3.98Å; M332-E353 HydrophobicContact SD-CB 4.21Å
333	Q	93.3	Very high	91.6	Very high	39 Å²	39	53.2 Å²	53.2	18%	0.182	26%	0.26	C	S	.	.	S	Bend	trans	-85.1	158.4	-178.8	-56.9	170.4	84.1	0	0	112.2	N331 N343 K351	N331-Q333 VanDerWaalsContact OD1-CB 3.25Å; N331-Q333 WeakPolarHBondContact OD1-CB 3.46Å; N331-Q333 WeakPolarHBondContact OD1-CG 3.47Å; N331-Q333 PolarHBondContact OD1-N 3.01Å; N331-Q333 PolarHBondContact OD1-NE2 3.16Å; Q333-N343 PolarHBondContact NE2-O 3.17Å; Q333-K351 HydrophobicContact CG-CB 3.7Å; Q333-K351 HydrophobicContact CG-CD 4.21Å; Q333-K351 HydrophobicContact CG-CG 3.92Å
334	D	88.3	Confident	91.4	Very high	112 Å²	112	54 Å²	54	60%	0.599	26%	0.264	S	S	*	.			trans	-77.8	124.8	174.5	-170.4	-0.9	0	0	0	111.4	R336	D334-R336 WeakPolarHBondContact OD1-CG 3.41Å; D334-R336 PolarHBondContact OD1-N 3.03Å; D334-R336 VanDerWaalsContact OD1-N 3.09Å; D334-R336 IonicContact OD1-NE 3.13Å; D334-R336 WeakPolarHBondContact OD2-CD 3.26Å; D334-R336 IonicContact OD2-CZ 3.8Å; D334-R336 IonicContact OD2-NE 3.71Å; D334-R336 PolarHBondContact OD2-NE 3.32Å; D334-R336 VanDerWaalsContact OD2-NE 3.12Å
335	C	87.1	Confident	91.1	Very high	30 Å²	30	58.4 Å²	58.4	20%	0.203	29%	0.287	C	S	.	.			trans	-104.1	16.5	-179.3	-68.9	0	0	0	0	114.3	N331 F337 G338	N331-C335 PolarHBondContact ND2-SG 3.39Å; C335-F337 PolarHBondContact O-N 2.77Å; C335-F337 VanDerWaalsContact O-N 3.07Å; C335-G338 PolarHBondContact O-N 2.88Å
336	R	85.5	Confident	90.9	Very high	207 Å²	207	55.9 Å²	55.9	78%	0.781	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.8	-31.2	179.9	-78.9	167.6	-158.2	-168.5	2.6	115	D334	D334-R336 WeakPolarHBondContact OD1-CG 3.41Å; D334-R336 PolarHBondContact OD1-N 3.03Å; D334-R336 VanDerWaalsContact OD1-N 3.09Å; D334-R336 IonicContact OD1-NE 3.13Å; D334-R336 WeakPolarHBondContact OD2-CD 3.26Å; D334-R336 IonicContact OD2-CZ 3.8Å; D334-R336 IonicContact OD2-NE 3.71Å; D334-R336 PolarHBondContact OD2-NE 3.32Å; D334-R336 VanDerWaalsContact OD2-NE 3.12Å
337	F	85	Confident	90.5	Very high	156 Å²	156	52.6 Å²	52.6	68%	0.684	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.2	25.5	178.2	-58	-67.7	0	0	0	112.7	C335	C335-F337 PolarHBondContact O-N 2.77Å; C335-F337 VanDerWaalsContact O-N 3.07Å
338	G	87.7	Confident	90.3	Very high	16 Å²	16	54 Å²	54	17%	0.165	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	71.3	-140.3	-174.9	0	0	0	0	0	111.8	L317 C335	L317-G338 WeakPolarHBondContact O-CA 3.39Å; C335-G338 PolarHBondContact O-N 2.88Å
339	C	90.1	Very high	89.8	Confident	3 Å²	3	56.8 Å²	56.8	2%	0.02	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	4.4	-178.1	-56.5	0	0	0	0	113.7	F300 T311 E341 M342	F300-C339 HydrophobicContact CE2-CB 4.07Å; F300-C339 HydrophobicContact CZ-CB 4.41Å; T311-C339 VanDerWaalsContact O-CB 3.23Å; T311-C339 WeakPolarHBondContact O-CB 3.31Å; C339-E341 PolarHBondContact O-N 2.84Å; C339-M342 WeakPolarHBondContact O-CB 3.47Å; C339-M342 PolarHBondContact O-N 2.84Å
340	A	87.6	Confident	89.5	Confident	51 Å²	51	61.8 Å²	61.8	42%	0.421	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-33.8	-169.4	0	0	0	0	0	114.5
341	E	87.6	Confident	89.3	Confident	162 Å²	162	64.6 Å²	64.6	76%	0.757	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.7	12.8	-177.9	-61.9	-177.9	173.3	0	0	112.4	C339	C339-E341 PolarHBondContact O-N 2.84Å
342	M	90.2	Very high	89.2	Confident	22 Å²	22	64.4 Å²	64.4	11%	0.108	35%	0.345	C	S	.	.			trans	-81.8	137.5	-172.4	-167.3	161.1	174.1	0	0	112	I319 N331 C339 F344 W352	I319-M342 HydrophobicContact CB-CE 3.86Å; I319-M342 HydrophobicContact CB-SD 4.15Å; I319-M342 HydrophobicContact CD1-CE 4.06Å; I319-M342 HydrophobicContact CD1-SD 3.89Å; I319-M342 HydrophobicContact CG1-CE 4.45Å; I319-M342 HydrophobicContact CG1-SD 4.3Å; I319-M342 HydrophobicContact CG2-CE 4.15Å; N331-M342 HydrophobicContact CB-CE 4.07Å; N331-M342 WeakPolarHBondContact ND2-CE 3.31Å; N331-M342 WeakPolarHBondContact OD1-CE 3.35Å; C339-M342 WeakPolarHBondContact O-CB 3.47Å; C339-M342 PolarHBondContact O-N 2.84Å; M342-F344 HydrophobicContact CB-CE2 4.27Å; M342-F344 HydrophobicContact CB-CZ 4.21Å; M342-F344 HydrophobicContact CG-CE1 4.47Å; M342-F344 HydrophobicContact CG-CZ 4.23Å; M342-F344 HydrophobicContact SD-CE1 4.49Å; M342-F344 HydrophobicContact SD-CZ 4.46Å; M342-W352 HydrophobicContact CE-CH2 3.24Å; M342-W352 HydrophobicContact CE-CZ2 3.22Å; M342-W352 HydrophobicContact CE-CZ3 4.25Å
343	N	92.1	Very high	89.1	Confident	64 Å²	64	65.3 Å²	65.3	34%	0.342	35%	0.348	S	S	.	.			trans	-96.2	133.8	174.3	-169.7	-25.8	0	0	0	110.2	Q333 D345 K351 W352	Q333-N343 PolarHBondContact NE2-O 3.17Å; N343-D345 WeakPolarHBondContact OD1-CB 3.33Å; N343-D345 PolarHBondContact OD1-N 3.17Å; N343-K351 HydrophobicContact CB-CD 3.66Å; N343-K351 PolarHBondContact ND2-NZ 3.19Å; N343-W352 PolarHBondContact O-NE1 3.32Å
344	F	92.9	Very high	88.9	Confident	17 Å²	17	65.6 Å²	65.6	8%	0.075	35%	0.348	C	S	.	.			trans	-107	15.7	-176.7	-64.4	-80.3	0	0	0	113.6	L287 L289 F300 T311 I319 M342 L346 W352	L287-F344 HydrophobicContact CD1-CD1 4.35Å; L287-F344 HydrophobicContact CD1-CE1 4.39Å; L287-F344 HydrophobicContact CD2-CD1 3.59Å; L287-F344 HydrophobicContact CD2-CE1 3.95Å; L289-F344 HydrophobicContact CD2-CB 3.88Å; F300-F344 HydrophobicContact CE1-CE1 4.12Å; F300-F344 HydrophobicContact CE1-CZ 4.23Å; F300-F344 AromaticContact CZ-CE1 3.95Å; F300-F344 HydrophobicContact CZ-CE1 3.95Å; F300-F344 AromaticContact CZ-CZ 3.69Å; F300-F344 HydrophobicContact CZ-CZ 3.69Å; T311-F344 HydrophobicContact CG2-CE2 3.85Å; T311-F344 HydrophobicContact CG2-CZ 4.02Å; I319-F344 HydrophobicContact CD1-CE1 4.09Å; M342-F344 HydrophobicContact CB-CE2 4.27Å; M342-F344 HydrophobicContact CB-CZ 4.21Å; M342-F344 HydrophobicContact CG-CE1 4.47Å; M342-F344 HydrophobicContact CG-CZ 4.23Å; M342-F344 HydrophobicContact SD-CE1 4.49Å; M342-F344 HydrophobicContact SD-CZ 4.46Å; F344-L346 PolarHBondContact O-N 3.45Å; F344-L346 VanDerWaalsContact O-N 3.15Å; F344-W352 HydrophobicContact CD1-CZ2 4.29Å
345	D	90.4	Very high	89	Confident	93 Å²	93	60.9 Å²	60.9	50%	0.497	32%	0.323	S	S	.	.			trans	-74.3	97.6	168.9	-175	3.2	0	0	0	110.4	N343 G347 D348 W352	N343-D345 WeakPolarHBondContact OD1-CB 3.33Å; N343-D345 PolarHBondContact OD1-N 3.17Å; D345-G347 PolarHBondContact O-N 2.83Å; D345-G347 VanDerWaalsContact O-N 3.16Å; D345-G347 PolarHBondContact OD1-N 2.91Å; D345-D348 PolarHBondContact O-N 3.28Å; D345-W352 VanDerWaalsContact O-CD1 3.27Å
346	L	90.1	Very high	88.9	Confident	13 Å²	13	60 Å²	60	7%	0.068	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-1.1	-179.2	-50	-175	0	0	0	113.4	Y186 L289 I322 W329 F344 W352 Q362	Y186-L346 HydrophobicContact CD1-CD1 4.17Å; Y186-L346 HydrophobicContact CE1-CD1 3.52Å; Y186-L346 HydrophobicContact CE2-CD1 4.39Å; L289-L346 HydrophobicContact CD1-CD1 4.08Å; L289-L346 HydrophobicContact CD1-CG 4.38Å; I322-L346 HydrophobicContact CD1-CD1 3.72Å; I322-L346 HydrophobicContact CD1-CD2 3.43Å; I322-L346 VanDerWaalsContact CD1-CD2 3.43Å; I322-L346 HydrophobicContact CD1-CG 4.21Å; W329-L346 HydrophobicContact CD2-CD1 4.26Å; W329-L346 HydrophobicContact CZ2-CD1 4.42Å; F344-L346 PolarHBondContact O-N 3.45Å; F344-L346 VanDerWaalsContact O-N 3.15Å; L346-W352 HydrophobicContact CD2-CD2 3.69Å; L346-W352 HydrophobicContact CD2-CE3 4.29Å; L346-W352 HydrophobicContact CD2-CG 3.83Å; L346-W352 HydrophobicContact CD2-CZ2 4.07Å; L346-Q362 PolarHBondContact O-NE2 3.4Å
347	G	84.3	Confident	88.2	Confident	36 Å²	36	58.2 Å²	58.2	37%	0.371	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-15.9	169.7	0	0	0	0	0	114.7	D345 A349 Q362	D345-G347 PolarHBondContact O-N 2.83Å; D345-G347 VanDerWaalsContact O-N 3.16Å; D345-G347 PolarHBondContact OD1-N 2.91Å; G347-A349 PolarHBondContact O-N 3.31Å; G347-Q362 VanDerWaalsContact CA-NE2 3.29Å
348	D	87.8	Confident	86.8	Confident	41 Å²	41	53.2 Å²	53.2	22%	0.219	30%	0.302	C	S	.	.			trans	-84.4	96.5	-179	-171.7	-14.7	0	0	0	110.8	D345 V350 K351 W352	D345-D348 PolarHBondContact O-N 3.28Å; D348-V350 PolarHBondContact O-N 3.16Å; D348-V350 VanDerWaalsContact O-N 3.1Å; D348-V350 WeakPolarHBondContact OD1-CB 3.47Å; D348-V350 PolarHBondContact OD1-N 2.85Å; D348-V350 VanDerWaalsContact OD1-N 3.1Å; D348-K351 HydrophobicContact CB-CB 4.25Å; D348-K351 HydrophobicContact CB-CG 4.39Å; D348-K351 PolarHBondContact O-N 3.41Å; D348-K351 WeakPolarHBondContact OD2-CD 3.49Å; D348-K351 WeakPolarHBondContact OD2-CE 3.46Å; D348-K351 WeakPolarHBondContact OD2-CG 3.43Å; D348-K351 IonicContact OD2-NZ 3.48Å; D348-K351 PolarHBondContact OD2-NZ 3.01Å; D348-W352 PolarHBondContact O-N 2.93Å
349	A	84.9	Confident	84.9	Confident	61 Å²	61	57.6 Å²	57.6	50%	0.504	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-18.2	-179.4	0	0	0	0	0	114.3	G347 W352	G347-A349 PolarHBondContact O-N 3.31Å; A349-W352 WeakPolarHBondContact CA-O 3.47Å
350	V	89.4	Confident	82.7	Confident	121 Å²	121	63.2 Å²	63.2	73%	0.733	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.4	-31.1	174.9	-178.4	0	0	0	0	110.8	M332 D348	M332-V350 WeakPolarHBondContact CB-O 3.43Å; D348-V350 PolarHBondContact O-N 3.16Å; D348-V350 VanDerWaalsContact O-N 3.1Å; D348-V350 WeakPolarHBondContact OD1-CB 3.47Å; D348-V350 PolarHBondContact OD1-N 2.85Å; D348-V350 VanDerWaalsContact OD1-N 3.1Å
351	K	91.6	Very high	80.6	Confident	58 Å²	58	64.6 Å²	64.6	25%	0.252	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-32.4	-175.8	-64.6	-168.6	-172.2	111.5	0	112.9	M332 Q333 N343 D348	M332-K351 PolarHBondContact N-O 3.34Å; Q333-K351 HydrophobicContact CG-CB 3.7Å; Q333-K351 HydrophobicContact CG-CD 4.21Å; Q333-K351 HydrophobicContact CG-CG 3.92Å; N343-K351 HydrophobicContact CB-CD 3.66Å; N343-K351 PolarHBondContact ND2-NZ 3.19Å; D348-K351 HydrophobicContact CB-CB 4.25Å; D348-K351 HydrophobicContact CB-CG 4.39Å; D348-K351 PolarHBondContact O-N 3.41Å; D348-K351 WeakPolarHBondContact OD2-CD 3.49Å; D348-K351 WeakPolarHBondContact OD2-CE 3.46Å; D348-K351 WeakPolarHBondContact OD2-CG 3.43Å; D348-K351 IonicContact OD2-NZ 3.48Å; D348-K351 PolarHBondContact OD2-NZ 3.01Å
352	W	93.4	Very high	78.6	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	113.5	-177.2	-66.9	100.4	0	0	0	110.2	I319 I322 W329 V330 N331 M342 N343 F344 D345 L346 D348 A349	I319-W352 HydrophobicContact CG2-CH2 4.17Å; I322-W352 HydrophobicContact CD1-CE3 4.46Å; I322-W352 HydrophobicContact CD1-CH2 3.92Å; I322-W352 HydrophobicContact CD1-CZ2 4.4Å; I322-W352 HydrophobicContact CD1-CZ3 3.97Å; I322-W352 HydrophobicContact CG1-CE3 4.36Å; I322-W352 HydrophobicContact CG1-CH2 4.15Å; I322-W352 HydrophobicContact CG1-CZ3 3.79Å; I322-W352 HydrophobicContact CG2-CH2 3.93Å; I322-W352 HydrophobicContact CG2-CZ3 4.08Å; W329-W352 HydrophobicContact CB-CE3 3.93Å; V330-W352 WeakPolarHBondContact O-CA 3.42Å; N331-W352 HydrophobicContact CB-CE3 4.17Å; N331-W352 HydrophobicContact CB-CH2 4.15Å; N331-W352 HydrophobicContact CB-CZ3 3.71Å; M342-W352 HydrophobicContact CE-CH2 3.24Å; M342-W352 HydrophobicContact CE-CZ2 3.22Å; M342-W352 HydrophobicContact CE-CZ3 4.25Å; N343-W352 PolarHBondContact O-NE1 3.32Å; F344-W352 HydrophobicContact CD1-CZ2 4.29Å; D345-W352 VanDerWaalsContact O-CD1 3.27Å; L346-W352 HydrophobicContact CD2-CD2 3.69Å; L346-W352 HydrophobicContact CD2-CE3 4.29Å; L346-W352 HydrophobicContact CD2-CG 3.83Å; L346-W352 HydrophobicContact CD2-CZ2 4.07Å; D348-W352 PolarHBondContact O-N 2.93Å; A349-W352 WeakPolarHBondContact CA-O 3.47Å
353	E	91.8	Very high	75.9	Confident	69 Å²	69	64.8 Å²	64.8	32%	0.322	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	128.5	173.1	-173.9	175.3	-177.7	0	0	108.9	F82 W329 V330 M332	F82-E353 HydrophobicContact CE2-CG 4.32Å; F82-E353 HydrophobicContact CZ-CG 4.39Å; W329-E353 CarbonylContact C-O 3.53Å; W329-E353 VanDerWaalsContact CA-O 3.29Å; W329-E353 WeakPolarHBondContact CA-O 3.44Å; V330-E353 HydrophobicContact CB-CB 4.45Å; V330-E353 PolarHBondContact N-O 2.84Å; V330-E353 PolarHBondContact O-N 2.78Å; M332-E353 HydrophobicContact CG-CB 3.98Å; M332-E353 HydrophobicContact SD-CB 4.21Å
354	Y	89.1	Confident	73.2	Confident	46 Å²	46	69.5 Å²	69.5	18%	0.18	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	149.9	-178	52.4	-100.6	0	0	0	111.9	Y328 L356 Y357	Y328-Y354 WeakPolarHBondContact O-CA 3.38Å; Y354-L356 WeakPolarHBondContact CD2-O 3.47Å; Y354-Y357 AromaticContact CE2-CD1 3.48Å; Y354-Y357 HydrophobicContact CE2-CD1 3.48Å; Y354-Y357 VanDerWaalsContact CE2-CD1 3.48Å; Y354-Y357 HydrophobicContact CE2-CD2 4.37Å; Y354-Y357 AromaticContact CE2-CE1 3.68Å; Y354-Y357 HydrophobicContact CE2-CE1 3.68Å; Y354-Y357 AromaticContact CE2-CG 3.84Å; Y354-Y357 HydrophobicContact CE2-CG 3.84Å; Y354-Y357 AromaticContact CZ-CD1 3.94Å; Y354-Y357 WeakPolarHBondContact OH-CD1 3.47Å; Y354-Y357 WeakPolarHBondContact OH-CE1 3.37Å
355	L	90.1	Very high	70.3	Confident	13 Å²	13	76.2 Å²	76.2	7%	0.068	45%	0.453	C	S	.	.	S	Bend	trans	-76.9	-45.5	-179.5	-174.4	72.4	0	0	0	112.5	L75 I78 A79 F82 F109 Y328	L75-L355 HydrophobicContact CD1-CD2 4.32Å; I78-L355 HydrophobicContact CG2-CD1 4.27Å; I78-L355 HydrophobicContact CG2-CG 4.42Å; A79-L355 HydrophobicContact CB-CD2 4.43Å; F82-L355 HydrophobicContact CB-CD1 3.43Å; F82-L355 VanDerWaalsContact CB-CD1 3.43Å; F82-L355 HydrophobicContact CD1-CD1 3.76Å; F82-L355 HydrophobicContact CD2-CD1 3.7Å; F82-L355 HydrophobicContact CE1-CD1 4.45Å; F82-L355 HydrophobicContact CE2-CD1 4.39Å; F82-L355 HydrophobicContact CG-CD1 3.33Å; F109-L355 HydrophobicContact CE1-CD2 4.2Å; F109-L355 HydrophobicContact CE2-CD2 3.6Å; F109-L355 HydrophobicContact CZ-CD2 3.3Å; Y328-L355 PolarHBondContact O-N 2.81Å
356	L	86.1	Confident	67.6	Low	11 Å²	11	79.1 Å²	79.1	6%	0.058	47%	0.467	C	S	.	.	S	Bend	trans	-107.7	133.3	-178.2	-55.8	-174.9	0	0	0	110.9	L75 N327 Y354 G358 F390 M392	L75-L356 HydrophobicContact CD1-CD2 4.2Å; N327-L356 PolarHBondContact ND2-O 2.75Å; N327-L356 WeakPolarHBondContact OD1-CB 3.21Å; N327-L356 PolarHBondContact OD1-N 2.79Å; Y354-L356 WeakPolarHBondContact CD2-O 3.47Å; L356-G358 PolarHBondContact O-N 2.91Å; L356-F390 HydrophobicContact CD1-CD1 4.26Å; L356-F390 HydrophobicContact CD2-CD1 3.8Å; L356-F390 HydrophobicContact CD2-CE1 4.36Å; L356-M392 HydrophobicContact CD1-CB 4.15Å; L356-M392 HydrophobicContact CD1-CE 3.51Å; L356-M392 HydrophobicContact CD1-SD 4.21Å; L356-M392 HydrophobicContact CG-CE 4.37Å
357	Y	69.4	Low	64.7	Low	170 Å²	170	86 Å²	86	67%	0.667	50%	0.503	S	S	*	.			trans	-73.7	106.6	172	-66.7	-94.9	0	0	0	108.1	Y354 V389	Y354-Y357 AromaticContact CE2-CD1 3.48Å; Y354-Y357 HydrophobicContact CE2-CD1 3.48Å; Y354-Y357 VanDerWaalsContact CE2-CD1 3.48Å; Y354-Y357 HydrophobicContact CE2-CD2 4.37Å; Y354-Y357 AromaticContact CE2-CE1 3.68Å; Y354-Y357 HydrophobicContact CE2-CE1 3.68Å; Y354-Y357 AromaticContact CE2-CG 3.84Å; Y354-Y357 HydrophobicContact CE2-CG 3.84Å; Y354-Y357 AromaticContact CZ-CD1 3.94Å; Y354-Y357 WeakPolarHBondContact OH-CD1 3.47Å; Y354-Y357 WeakPolarHBondContact OH-CE1 3.37Å; Y357-V389 WeakPolarHBondContact O-CG1 3.44Å
358	G	56.3	Low	62.1	Low	50 Å²	50	89.7 Å²	89.7	52%	0.515	52%	0.52	S	S	.	.			trans	-82.2	157.5	-174.8	0	0	0	0	0	114.3	L356 T360	L356-G358 PolarHBondContact O-N 2.91Å; G358-T360 VanDerWaalsContact C-N 3.29Å; G358-T360 PolarHBondContact O-N 2.86Å
359	T	47.2	Very low	59.5	Low	108 Å²	108	94.7 Å²	94.7	66%	0.663	55%	0.547	S	S	*	.	S	Bend	trans	-73.2	-17.2	174.6	-23	0	0	0	0	113.2	G361	T359-G361 PolarHBondContact O-N 2.79Å
360	T	43.5	Very low	57	Low	121 Å²	121	100.8 Å²	100.8	74%	0.742	57%	0.567	S	S	*	*	S	Bend	trans	-91.6	79.2	-178.1	31.3	0	0	0	0	112.4	G358 Q362	G358-T360 VanDerWaalsContact C-N 3.29Å; G358-T360 PolarHBondContact O-N 2.86Å; T360-Q362 PolarHBondContact O-N 2.73Å
361	G	45.3	Very low	54.3	Low	81 Å²	81	104.5 Å²	104.5	84%	0.835	57%	0.573	S	S	*	*	S	Bend	trans	71.4	23	143.9	0	0	0	0	0	119.7	T359	T359-G361 PolarHBondContact O-N 2.79Å
362	Q	44.9	Very low	51.5	Low	80 Å²	80	111.3 Å²	111.3	37%	0.374	60%	0.603	S	S	.	*			trans	-98.6	107.8	168.3	-67.2	179.9	9.1	0	0	109.2	L346 G347 T360	L346-Q362 PolarHBondContact O-NE2 3.4Å; G347-Q362 VanDerWaalsContact CA-NE2 3.29Å; T360-Q362 PolarHBondContact O-N 2.73Å
363	S	32.4	Very low	48.6	Very low	107 Å²	107	120 Å²	120	75%	0.748	64%	0.643	S	S	*	*			trans	-55.2	134.1	-170.6	-166.8	0	0	0	0	112.8	L365	S363-L365 PolarHBondContact O-N 3.1Å
364	L	35.4	Very low	45.7	Very low	163 Å²	163	126.2 Å²	126.2	85%	0.853	67%	0.672	S	S	*	*			trans	-41.8	92.9	160.4	-73.8	153.4	0	0	0	111.5	L366	L364-L366 PolarHBondContact O-N 3.35Å
365	L	32.4	Very low	43.1	Very low	159 Å²	159	133.2 Å²	133.2	83%	0.832	71%	0.707	S	S	*	*			trans	-85.2	92.1	154.7	-72.4	-179.9	0	0	0	107.4	S363 I367	S363-L365 PolarHBondContact O-N 3.1Å; L365-I367 PolarHBondContact O-N 3.11Å
366	L	33.5	Very low	40.4	Very low	154 Å²	154	136.8 Å²	136.8	81%	0.806	74%	0.738	S	S	*	*			trans	-19.7	116.2	156.2	-72.5	145.5	0	0	0	111.8	L364 P368	L364-L366 PolarHBondContact O-N 3.35Å; L366-P368 WeakPolarHBondContact O-CD 3.43Å
367	I	29.4	Very low	38.1	Very low	158 Å²	158	144.9 Å²	144.9	81%	0.81	78%	0.776	S	S	*	*			trans	-59.3	118.3	157.3	-61	172	0	0	0	105.9	L365 D369	L365-I367 PolarHBondContact O-N 3.11Å; I367-D369 PolarHBondContact O-N 2.97Å
368	P	30.8	Very low	36.4	Very low	112 Å²	112	144.5 Å²	144.5	73%	0.727	79%	0.785	S	S	*	*			trans	-67.8	119.4	178.4	-16.8	30.8	0	0	0	110.5	L366	L366-P368 WeakPolarHBondContact O-CD 3.43Å
369	D	32.9	Very low	35.9	Very low	147 Å²	147	150.2 Å²	150.2	79%	0.786	80%	0.804	S	S	*	*			trans	33	94.7	152.1	-72	-28.8	0	0	0	118.8	I367	I367-D369 PolarHBondContact O-N 2.97Å
370	M	31	Very low	35.5	Very low	188 Å²	188	153.1 Å²	153.1	93%	0.926	81%	0.81	S	S	*	*			trans	-114.8	55.8	143	-70.5	-130.1	80.3	0	0	110.6
371	K	33.8	Very low	35.3	Very low	199 Å²	199	157 Å²	157	87%	0.865	82%	0.82	S	S	*	*			trans	-131.3	85.5	158.8	-76.9	-169.6	179.2	-178.4	0	109.5
372	K	33.4	Very low	34.9	Very low	201 Å²	201	161 Å²	161	87%	0.874	82%	0.817	S	S	*	*			trans	-112.7	130.9	149.5	-97	-176.2	178.2	176.2	0	108.2
373	Q	32.1	Very low	34.6	Very low	183 Å²	183	166.2 Å²	166.2	86%	0.855	84%	0.841	S	S	*	*			trans	87.2	87.7	173.6	-57.6	175	-2.6	0	0	115.4
374	Q	31.5	Very low	35	Very low	199 Å²	199	167.4 Å²	167.4	93%	0.93	84%	0.843	S	S	*	*				-164.6	132.6	104.5	-101.6	160.1	-7.2	0	0	110
375	E	32.8	Very low	35.3	Very low	193 Å²	193	166.6 Å²	166.6	90%	0.902	84%	0.84	S	S	*	*			trans	-78.1	156.2	174.4	-70.7	175.4	152.9	0	0	110.9
376	A	34.2	Very low	35.9	Very low	88 Å²	88	167.1 Å²	167.1	73%	0.727	84%	0.838	S	S	*	*			trans	88.7	112.8	153.4	0	0	0	0	0	118.9
377	E	37.9	Very low	36.8	Very low	182 Å²	182	165.3 Å²	165.3	85%	0.85	84%	0.835	S	S	*	*			trans	57.9	101	136.8	-62.2	177.5	176.2	0	0	117.8
378	D	33.8	Very low	38.1	Very low	161 Å²	161	167.4 Å²	167.4	86%	0.861	84%	0.839	S	S	*	*				-170.7	140.3	110.4	-97.5	-26.2	0	0	0	110.4	E380	D378-E380 PolarHBondContact O-N 2.84Å
379	D	45.7	Very low	40	Very low	170 Å²	170	165.2 Å²	165.2	91%	0.909	82%	0.823	S	S	*	*			trans	-69.2	99.9	174.4	-74.5	-43.9	0	0	0	110.1
380	E	38.2	Very low	42.4	Very low	169 Å²	169	160.7 Å²	160.7	79%	0.79	80%	0.796	S	S	*	*			trans	-131.6	114.8	155.6	-71.1	-169.1	169.7	0	0	108.2	D378 E382	D378-E380 PolarHBondContact O-N 2.84Å; E380-E382 PolarHBondContact O-N 3.2Å
381	E	39.9	Very low	45	Very low	204 Å²	204	157.8 Å²	157.8	95%	0.953	78%	0.781	S	S	*	*			trans	-63.9	83.5	166.4	-70.9	177.8	161.6	0	0	108.3	E383	E381-E383 PolarHBondContact O-N 2.88Å; E381-E383 VanDerWaalsContact O-N 3.16Å
382	E	37.5	Very low	47.7	Very low	164 Å²	164	149.7 Å²	149.7	77%	0.766	75%	0.746	S	S	*	*			trans	-66.1	107.8	161.8	-78.5	-170.7	160.9	0	0	107.4	E380 V384	E380-E382 PolarHBondContact O-N 3.2Å; E382-V384 PolarHBondContact O-N 3.48Å
383	E	38.2	Very low	50.5	Low	190 Å²	190	140.4 Å²	140.4	89%	0.888	71%	0.707	S	S	*	*			trans	-49.2	108.1	159.2	-80.2	-174.5	152.5	0	0	107.7	E381 D385	E381-E383 PolarHBondContact O-N 2.88Å; E381-E383 VanDerWaalsContact O-N 3.16Å; E383-D385 VanDerWaalsContact C-N 3.27Å; E383-D385 PolarHBondContact O-N 3.36Å
384	V	41.1	Very low	53.4	Low	131 Å²	131	136.5 Å²	136.5	79%	0.794	70%	0.697	S	S	*	*			trans	-66	94.9	171.9	-178.8	0	0	0	0	106.5	E382 E386	E382-V384 PolarHBondContact O-N 3.48Å; V384-E386 PolarHBondContact O-N 2.94Å
385	D	41.1	Very low	56.4	Low	147 Å²	147	128 Å²	128	79%	0.786	66%	0.659	S	S	*	*			trans	-51.8	102.6	172.8	-135.7	-1.7	0	0	0	107.2	E383	E383-D385 VanDerWaalsContact C-N 3.27Å; E383-D385 PolarHBondContact O-N 3.36Å
386	E	46	Very low	59.4	Low	169 Å²	169	119.2 Å²	119.2	79%	0.79	62%	0.618	S	S	*	*			trans	-53.5	127.8	176.9	-76.4	-172.9	161.5	0	0	107.8	V384 K388	V384-E386 PolarHBondContact O-N 2.94Å; E386-K388 PolarHBondContact O-N 3.35Å
387	P	51.9	Low	62.3	Low	116 Å²	116	115.1 Å²	115.1	75%	0.753	58%	0.584	S	S	*	*			trans	-59.9	116.4	-175.3	22.5	-31.8	0	0	0	109.1	V389	P387-V389 PolarHBondContact O-N 2.93Å
388	K	56.3	Low	65	Low	203 Å²	203	109.8 Å²	109.8	88%	0.883	56%	0.561	S	S	*	*			trans	-53.3	103.3	174.7	-81.8	176	-179.3	162.8	0	109.4	E386 F390	E386-K388 PolarHBondContact O-N 3.35Å; K388-F390 PolarHBondContact O-N 2.98Å
389	V	71.3	Confident	67.8	Low	66 Å²	66	108.5 Å²	108.5	40%	0.4	55%	0.55	S	S	.	*			trans	-61	121.5	177.8	170.3	0	0	0	0	108.9	Y357 P387 E391	Y357-V389 WeakPolarHBondContact O-CG1 3.44Å; P387-V389 PolarHBondContact O-N 2.93Å; V389-E391 PolarHBondContact O-N 3.41Å
390	F	82.7	Confident	70.1	Confident	51 Å²	51	100.6 Å²	100.6	22%	0.224	51%	0.508	C	S	.	.			trans	-74.4	110.6	175.2	-178.4	-91.1	0	0	0	109.6	Q71 L74 L75 I78 L356 K388	Q71-F390 HydrophobicContact CG-CE2 3.92Å; Q71-F390 HydrophobicContact CG-CZ 3.92Å; L74-F390 HydrophobicContact CB-CE2 4.15Å; L74-F390 HydrophobicContact CB-CZ 4.45Å; L74-F390 HydrophobicContact CD2-CD2 3.86Å; L74-F390 HydrophobicContact CD2-CE2 3.55Å; L74-F390 HydrophobicContact CG-CD2 4.32Å; L74-F390 HydrophobicContact CG-CE2 3.77Å; L74-F390 HydrophobicContact CG-CZ 4.34Å; L75-F390 HydrophobicContact CB-CE1 3.93Å; L75-F390 HydrophobicContact CB-CZ 3.91Å; L75-F390 HydrophobicContact CD1-CE1 4.01Å; L75-F390 HydrophobicContact CG-CE1 4.49Å; I78-F390 HydrophobicContact CD1-CD1 3.99Å; I78-F390 HydrophobicContact CD1-CD2 4.4Å; I78-F390 HydrophobicContact CD1-CE1 4.16Å; I78-F390 HydrophobicContact CD1-CG 4.11Å; I78-F390 HydrophobicContact CD1-CZ 4.44Å; L356-F390 HydrophobicContact CD1-CD1 4.26Å; L356-F390 HydrophobicContact CD2-CD1 3.8Å; L356-F390 HydrophobicContact CD2-CE1 4.36Å; K388-F390 PolarHBondContact O-N 2.98Å
391	E	85	Confident	72.6	Confident	127 Å²	127	98.6 Å²	98.6	59%	0.593	50%	0.503	S	S	*	.	P	Polyproline II helix	trans	-83.8	146.8	178.8	-64.2	-174.8	167.6	0	0	112.4	Q71 V389	Q71-E391 PolarHBondContact NE2-O 3.48Å; V389-E391 PolarHBondContact O-N 3.41Å
392	M	90.8	Very high	75	Confident	30 Å²	30	89 Å²	89	15%	0.148	46%	0.458	C	S	.	.	P	Polyproline II helix	trans	-59.6	126.8	175.4	-171.9	64.7	71.2	0	0	110.4	L75 F109 T112 Q326 L356	L75-M392 HydrophobicContact CD2-SD 3.7Å; F109-M392 HydrophobicContact CD1-CE 4.18Å; F109-M392 HydrophobicContact CD1-SD 4.02Å; F109-M392 HydrophobicContact CE1-CE 3.73Å; F109-M392 HydrophobicContact CE1-SD 4.2Å; T112-M392 HydrophobicContact CG2-SD 4.02Å; Q326-M392 WeakPolarHBondContact O-CB 3.36Å; Q326-M392 WeakPolarHBondContact O-CE 3.33Å; L356-M392 HydrophobicContact CD1-CB 4.15Å; L356-M392 HydrophobicContact CD1-CE 3.51Å; L356-M392 HydrophobicContact CD1-SD 4.21Å; L356-M392 HydrophobicContact CG-CE 4.37Å
393	P	92.8	Very high	77.4	Confident	6 Å²	6	83.3 Å²	83.3	4%	0.039	44%	0.436	C	S	.	.	P	Polyproline II helix	trans	-59.8	152.1	174.6	-19	29.8	0	0	0	111.9	Q71 E72 L75 T112	Q71-P393 HydrophobicContact CB-CG 4.3Å; Q71-P393 HydrophobicContact CG-CB 4.42Å; Q71-P393 HydrophobicContact CG-CG 3.89Å; E72-P393 HydrophobicContact CG-CB 4.21Å; E72-P393 HydrophobicContact CG-CG 4.37Å; L75-P393 HydrophobicContact CB-CG 4.4Å; L75-P393 HydrophobicContact CD2-CG 3.94Å; T112-P393 HydrophobicContact CG2-CB 4.47Å
394	P	91.8	Very high	79.5	Confident	100 Å²	100	78.1 Å²	78.1	65%	0.649	41%	0.412	S	S	*	.	P	Polyproline II helix	trans	-62.5	150.6	173.4	28.3	-35	0	0	0	111.1	W396	P394-W396 PolarHBondContact O-N 3.4Å
395	S	95.7	Very high	81.5	Confident	20 Å²	20	78.6 Å²	78.6	14%	0.14	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-56.8	130.2	177.4	158.3	0	0	0	0	112.2	T112 L114 R115 V397	T112-S395 WeakPolarHBondContact O-CA 3.46Å; T112-S395 VanDerWaalsContact O-CB 3.3Å; T112-S395 WeakPolarHBondContact O-CB 3.24Å; T112-S395 PolarHBondContact O-OG 2.79Å; L114-S395 VanDerWaalsContact O-CB 3.31Å; L114-S395 WeakPolarHBondContact O-CB 3.44Å; R115-S395 WeakPolarHBondContact CD-OG 3.32Å; R115-S395 PolarHBondContact NH1-O 2.7Å; S395-V397 PolarHBondContact O-N 2.77Å; S395-V397 WeakPolarHBondContact OG-CB 3.1Å; S395-V397 PolarHBondContact OG-N 2.8Å; S395-V397 VanDerWaalsContact OG-N 3.16Å
396	W	95.4	Very high	83.7	Confident	10 Å²	10	73.3 Å²	73.3	4%	0.038	38%	0.377	C	S	.	.	S	Bend	trans	-71.5	-17.1	175.2	56.2	-89.5	0	0	0	113.3	S64 Y65 N102 K108 T112 T113 P394	S64-W396 PolarHBondContact OG-O 3.45Å; Y65-W396 AromaticContact CD1-CE3 3.77Å; Y65-W396 HydrophobicContact CD1-CE3 3.77Å; Y65-W396 AromaticContact CD1-CZ3 3.33Å; Y65-W396 HydrophobicContact CD1-CZ3 3.33Å; Y65-W396 HydrophobicContact CD2-CE3 4.19Å; Y65-W396 AromaticContact CE1-CE3 3.89Å; Y65-W396 HydrophobicContact CE1-CE3 3.89Å; Y65-W396 AromaticContact CE1-CZ3 3.45Å; Y65-W396 HydrophobicContact CE1-CZ3 3.45Å; Y65-W396 VanDerWaalsContact CE1-CZ3 3.45Å; Y65-W396 HydrophobicContact CE2-CE3 4.3Å; Y65-W396 WeakPolarHBondContact CE2-O 3.43Å; Y65-W396 AromaticContact CG-CE3 3.9Å; Y65-W396 HydrophobicContact CG-CE3 3.9Å; Y65-W396 AromaticContact CG-CZ3 3.93Å; Y65-W396 HydrophobicContact CG-CZ3 3.93Å; N102-W396 HydrophobicContact CB-CH2 3.52Å; N102-W396 HydrophobicContact CB-CZ2 4.06Å; N102-W396 HydrophobicContact CB-CZ3 4.16Å; K108-W396 HydrophobicContact CB-CZ2 3.97Å; K108-W396 HydrophobicContact CD-CD2 4.09Å; K108-W396 HydrophobicContact CD-CG 3.92Å; K108-W396 HydrophobicContact CG-CD2 4.05Å; K108-W396 HydrophobicContact CG-CG 4.37Å; K108-W396 HydrophobicContact CG-CZ2 3.84Å; T112-W396 PolarHBondContact O-N 3.18Å; T112-W396 PolarHBondContact O-NE1 3.16Å; T112-W396 VanDerWaalsContact OG1-CD1 3.3Å; T112-W396 PolarHBondContact OG1-NE1 3.38Å; T113-W396 HydrophobicContact CG2-CH2 4.46Å; T113-W396 HydrophobicContact CG2-CZ2 3.77Å; P394-W396 PolarHBondContact O-N 3.4Å
397	V	95.6	Very high	85.6	Confident	2 Å²	2	66.1 Å²	66.1	1%	0.012	34%	0.344	C	S	.	.	S	Bend	trans	-74.9	138.6	179.3	-172.3	0	0	0	0	111.3	Y65 T113 R115 P156 T157 S395	Y65-V397 WeakPolarHBondContact OH-CA 3.4Å; Y65-V397 WeakPolarHBondContact OH-CG1 3.4Å; T113-V397 HydrophobicContact CG2-CG2 4.3Å; R115-V397 HydrophobicContact CB-CB 4.23Å; R115-V397 HydrophobicContact CB-CG1 4.47Å; R115-V397 WeakPolarHBondContact CD-O 3.36Å; P156-V397 HydrophobicContact CB-CG1 4.37Å; P156-V397 HydrophobicContact CG-CG1 4.37Å; T157-V397 WeakPolarHBondContact OG1-CG1 3.38Å; S395-V397 PolarHBondContact O-N 2.77Å; S395-V397 WeakPolarHBondContact OG-CB 3.1Å; S395-V397 PolarHBondContact OG-N 2.8Å; S395-V397 VanDerWaalsContact OG-N 3.16Å
398	N	93.9	Very high	87	Confident	70 Å²	70	62.5 Å²	62.5	37%	0.374	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-61.4	157.2	171.4	-74	-23.2	0	0	0	112	P62 Y65 I400	P62-N398 WeakPolarHBondContact CG-ND2 3.23Å; Y65-N398 PolarHBondContact OH-N 2.86Å; N398-I400 PolarHBondContact O-N 3.09Å
399	Q	92.3	Very high	88.3	Confident	133 Å²	133	54.3 Å²	54.3	62%	0.621	28%	0.284	S	S	*	.	P	Polyproline II helix	trans	-57.8	132.5	175.3	-171.6	172.9	1.9	0	0	110.8	T117 N401	T117-Q399 HydrophobicContact CG2-CG 3.65Å; Q399-N401 PolarHBondContact O-N 2.69Å
400	I	94.1	Very high	88.8	Confident	5 Å²	5	54 Å²	54	3%	0.026	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-66.4	129.4	179.5	-55.8	169.7	0	0	0	108.1	T117 L119 P156 M160 L173 L177 N398 I402	T117-I400 HydrophobicContact CG2-CB 3.96Å; T117-I400 WeakPolarHBondContact CG2-O 3.43Å; L119-I400 VanDerWaalsContact CD2-O 3.31Å; L119-I400 WeakPolarHBondContact CD2-O 3.5Å; P156-I400 HydrophobicContact CB-CD1 3.82Å; P156-I400 HydrophobicContact CB-CG1 3.82Å; P156-I400 HydrophobicContact CG-CD1 4.32Å; M160-I400 HydrophobicContact CG-CG2 4.4Å; M160-I400 HydrophobicContact SD-CG2 4.43Å; L173-I400 HydrophobicContact CD1-CD1 4.12Å; L173-I400 HydrophobicContact CD1-CG2 4.44Å; L177-I400 HydrophobicContact CD2-CD1 4.26Å; L177-I400 HydrophobicContact CD2-CG2 4.39Å; N398-I400 PolarHBondContact O-N 3.09Å; I400-I402 HydrophobicContact CG2-CG1 4.45Å
401	N	90.9	Very high	88.7	Confident	127 Å²	127	51.9 Å²	51.9	68%	0.679	27%	0.267	S	S	*	.			trans	-128.9	129.6	175.2	-175	16.7	0	0	0	108.5	Q399	Q399-N401 PolarHBondContact O-N 2.69Å
402	I	90.5	Very high	88.3	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.005	25%	0.249	C	C	.	.			trans	-113.5	121.5	177.1	-48.7	-177.4	0	0	0	107	L119 Y121 L124 F133 M160 I400 D406 M407	L119-I402 HydrophobicContact CD1-CD1 3.26Å; L119-I402 HydrophobicContact CD1-CG1 3.66Å; L119-I402 HydrophobicContact CD2-CG1 4.39Å; Y121-I402 HydrophobicContact CE2-CB 4.27Å; Y121-I402 PolarHBondContact OH-O 3.34Å; L124-I402 HydrophobicContact CD1-CD1 3.81Å; F133-I402 HydrophobicContact CD1-CD1 4.18Å; F133-I402 HydrophobicContact CE1-CD1 3.52Å; F133-I402 HydrophobicContact CE2-CD1 4.29Å; F133-I402 HydrophobicContact CE2-CG2 4.1Å; F133-I402 HydrophobicContact CZ-CD1 3.6Å; F133-I402 HydrophobicContact CZ-CG1 4.4Å; F133-I402 HydrophobicContact CZ-CG2 3.8Å; M160-I402 HydrophobicContact SD-CG1 4.1Å; I400-I402 HydrophobicContact CG2-CG1 4.45Å; I402-D406 HydrophobicContact CG2-CB 3.77Å; I402-M407 HydrophobicContact CB-CG 4.35Å; I402-M407 HydrophobicContact CB-SD 4.31Å; I402-M407 HydrophobicContact CD1-SD 4.2Å; I402-M407 HydrophobicContact CG2-CG 3.64Å; I402-M407 HydrophobicContact CG2-SD 3.64Å
403	S	87.6	Confident	87.6	Confident	45 Å²	45	48.4 Å²	48.4	32%	0.315	27%	0.267	S	S	.	.			trans	-70.1	157.5	178	78.8	0	0	0	0	110.8	Q405 D406 M407	S403-Q405 PolarHBondContact O-N 2.92Å; S403-Q405 PolarHBondContact OG-N 2.92Å; S403-D406 WeakPolarHBondContact CB-OD2 3.43Å; S403-D406 PolarHBondContact O-N 2.97Å; S403-D406 VanDerWaalsContact O-N 3.16Å; S403-D406 WeakPolarHBondContact OG-CB 3.33Å; S403-D406 PolarHBondContact OG-N 2.86Å; S403-D406 PolarHBondContact OG-OD2 3.27Å; S403-M407 PolarHBondContact O-N 3.16Å
404	Q	83.2	Confident	87.2	Confident	81 Å²	81	48.2 Å²	48.2	38%	0.379	27%	0.266	S	S	.	.	H	α-helix	trans	-59.3	-34.9	172.7	-177.6	178.5	-8.1	0	0	111.5	Y121 M407 E408	Y121-Q404 PolarHBondContact OH-N 2.9Å; Q404-M407 PolarHBondContact O-N 2.93Å; Q404-E408 PolarHBondContact NE2-OE1 3.02Å; Q404-E408 VanDerWaalsContact NE2-OE1 3.14Å; Q404-E408 WeakPolarHBondContact O-CG 3.41Å; Q404-E408 PolarHBondContact O-N 2.99Å
405	Q	82.4	Confident	87	Confident	141 Å²	141	47.4 Å²	47.4	66%	0.659	26%	0.255	S	S	*	.	H	α-helix	trans	-63.1	-44.4	176.6	-177.3	176.4	-3.2	0	0	111.1	S403 E408 T409	S403-Q405 PolarHBondContact O-N 2.92Å; S403-Q405 PolarHBondContact OG-N 2.92Å; Q405-E408 PolarHBondContact O-N 3.04Å; Q405-T409 HydrophobicContact CG-CG2 4.22Å; Q405-T409 WeakPolarHBondContact O-CG2 3.38Å; Q405-T409 PolarHBondContact O-N 2.79Å; Q405-T409 PolarHBondContact O-OG1 2.78Å
406	D	86.8	Confident	86.7	Confident	37 Å²	37	48.4 Å²	48.4	20%	0.198	26%	0.257	C	S	.	.	H	α-helix	trans	-66.6	-36.9	179	-67.1	-40.4	0	0	0	112.7	F137 I402 S403 E408 T409 R410	F137-D406 HydrophobicContact CE2-CB 3.77Å; F137-D406 HydrophobicContact CZ-CB 4.47Å; I402-D406 HydrophobicContact CG2-CB 3.77Å; S403-D406 WeakPolarHBondContact CB-OD2 3.43Å; S403-D406 PolarHBondContact O-N 2.97Å; S403-D406 VanDerWaalsContact O-N 3.16Å; S403-D406 WeakPolarHBondContact OG-CB 3.33Å; S403-D406 PolarHBondContact OG-N 2.86Å; S403-D406 PolarHBondContact OG-OD2 3.27Å; D406-E408 VanDerWaalsContact C-N 3.33Å; D406-T409 WeakPolarHBondContact CA-OG1 3.25Å; D406-T409 PolarHBondContact O-OG1 2.96Å; D406-R410 PolarHBondContact O-N 2.78Å
407	M	86.8	Confident	86.6	Confident	18 Å²	18	51.2 Å²	51.2	9%	0.089	28%	0.275	C	S	.	.	H	α-helix	trans	-65.9	-34.5	172.6	-74	-57.8	-66.6	0	0	112.8	Y121 L124 F133 I402 S403 Q404 R410	Y121-M407 HydrophobicContact CD1-CE 4.23Å; Y121-M407 HydrophobicContact CD1-CG 4.12Å; Y121-M407 HydrophobicContact CD2-CE 4.28Å; Y121-M407 HydrophobicContact CD2-CG 3.94Å; Y121-M407 HydrophobicContact CD2-SD 4.09Å; Y121-M407 HydrophobicContact CE1-CB 4.39Å; Y121-M407 HydrophobicContact CE1-CG 3.79Å; Y121-M407 HydrophobicContact CE2-CG 3.61Å; Y121-M407 HydrophobicContact CE2-SD 4.28Å; Y121-M407 HydrophobicContact CG-CE 3.95Å; Y121-M407 HydrophobicContact CG-CG 4.2Å; Y121-M407 HydrophobicContact CG-SD 4.34Å; L124-M407 HydrophobicContact CD1-CE 4.04Å; L124-M407 HydrophobicContact CD1-SD 4Å; L124-M407 HydrophobicContact CD2-CE 4.35Å; L124-M407 HydrophobicContact CG-CE 4.14Å; F133-M407 HydrophobicContact CD2-CE 4.4Å; F133-M407 HydrophobicContact CD2-SD 3.78Å; F133-M407 HydrophobicContact CE2-SD 3.6Å; F133-M407 VanDerWaalsContact CE2-SD 3.6Å; F133-M407 HydrophobicContact CZ-SD 4.37Å; I402-M407 HydrophobicContact CB-CG 4.35Å; I402-M407 HydrophobicContact CB-SD 4.31Å; I402-M407 HydrophobicContact CD1-SD 4.2Å; I402-M407 HydrophobicContact CG2-CG 3.64Å; I402-M407 HydrophobicContact CG2-SD 3.64Å; S403-M407 PolarHBondContact O-N 3.16Å; Q404-M407 PolarHBondContact O-N 2.93Å; M407-R410 VanDerWaalsContact O-CG 3.24Å; M407-R410 WeakPolarHBondContact O-CG 3.39Å
408	E	82.2	Confident	86.4	Confident	40 Å²	40	52 Å²	52	19%	0.187	28%	0.278	C	S	.	.	H	α-helix	trans	-77.3	-44.9	176.9	-75.7	-176.6	-161.2	0	0	111.9	Q404 Q405 D406 P430 N700 R703	Q404-E408 PolarHBondContact NE2-OE1 3.02Å; Q404-E408 VanDerWaalsContact NE2-OE1 3.14Å; Q404-E408 WeakPolarHBondContact O-CG 3.41Å; Q404-E408 PolarHBondContact O-N 2.99Å; Q405-E408 PolarHBondContact O-N 3.04Å; D406-E408 VanDerWaalsContact C-N 3.33Å; E408-P430 WeakPolarHBondContact O-CD 3.45Å; E408-N700 PolarHBondContact OE1-ND2 2.77Å; E408-R703 IonicContact OE2-CZ 3.05Å; E408-R703 IonicContact OE2-NE 3.35Å; E408-R703 PolarHBondContact OE2-NE 2.86Å; E408-R703 VanDerWaalsContact OE2-NE 3.08Å; E408-R703 IonicContact OE2-NH2 2.68Å; E408-R703 PolarHBondContact OE2-NH2 2.87Å
409	T	83.1	Confident	86.3	Confident	31 Å²	31	54.3 Å²	54.3	19%	0.19	29%	0.287	C	S	.	.	H	α-helix	trans	-71.1	-33.5	-176.7	54.7	0	0	0	0	112.2	Q405 D406 C411 A429	Q405-T409 HydrophobicContact CG-CG2 4.22Å; Q405-T409 WeakPolarHBondContact O-CG2 3.38Å; Q405-T409 PolarHBondContact O-N 2.79Å; Q405-T409 PolarHBondContact O-OG1 2.78Å; D406-T409 WeakPolarHBondContact CA-OG1 3.25Å; D406-T409 PolarHBondContact O-OG1 2.96Å; T409-C411 PolarHBondContact O-N 2.7Å; T409-C411 PolarHBondContact O-SG 2.9Å; T409-C411 VanDerWaalsContact O-SG 3.33Å; T409-A429 WeakPolarHBondContact O-CB 3.42Å
410	R	82.1	Confident	86.4	Confident	58 Å²	58	48.7 Å²	48.7	22%	0.219	26%	0.26	C	S	.	.			trans	54.2	-18.3	179.3	-68.6	-148.3	-176.7	-148.9	-1.6	117.9	E123 E136 F137 D406 M407	E123-R410 IonicContact OE1-CZ 3.7Å; E123-R410 IonicContact OE1-NH1 3.63Å; E123-R410 PolarHBondContact OE1-NH1 3.22Å; E123-R410 IonicContact OE1-NH2 3.58Å; E123-R410 PolarHBondContact OE1-NH2 2.74Å; E123-R410 IonicContact OE2-CZ 2.85Å; E123-R410 IonicContact OE2-NH2 2.85Å; E123-R410 PolarHBondContact OE2-NH2 2.97Å; E136-R410 CarbonylContact C-O 3.43Å; E136-R410 HydrophobicContact CB-CB 4.36Å; E136-R410 WeakPolarHBondContact CB-O 3.4Å; E136-R410 WeakPolarHBondContact OE2-CD 3.48Å; E136-R410 IonicContact OE2-NH1 3.66Å; F137-R410 WeakPolarHBondContact CA-O 3.42Å; F137-R410 PolarHBondContact N-O 2.84Å; D406-R410 PolarHBondContact O-N 2.78Å; M407-R410 VanDerWaalsContact O-CG 3.24Å; M407-R410 WeakPolarHBondContact O-CG 3.39Å
411	C	79.4	Confident	86.2	Confident	7 Å²	7	51.4 Å²	51.4	5%	0.047	27%	0.27	C	S	.	.	S	Bend	trans	-145.6	154.2	-175.2	53.6	0	0	0	0	110.8	E136 T409 G413 G414 M415 K416	E136-C411 VanDerWaalsContact O-CA 3.3Å; E136-C411 WeakPolarHBondContact O-CA 3.3Å; E136-C411 VanDerWaalsContact O-CB 3.25Å; E136-C411 WeakPolarHBondContact O-CB 3.49Å; T409-C411 PolarHBondContact O-N 2.7Å; T409-C411 PolarHBondContact O-SG 2.9Å; T409-C411 VanDerWaalsContact O-SG 3.33Å; C411-G413 PolarHBondContact O-N 2.84Å; C411-G414 WeakPolarHBondContact O-CA 3.3Å; C411-G414 PolarHBondContact O-N 3.18Å; C411-G414 VanDerWaalsContact SG-CA 3.55Å; C411-M415 PolarHBondContact SG-N 2.86Å; C411-K416 HydrophobicContact CB-CB 4.23Å
412	P	77.6	Confident	86.3	Confident	34 Å²	34	48.4 Å²	48.4	22%	0.221	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-62.2	124.6	-178.2	-23.9	37.2	0	0	0	111.3	F137 Q163 G414	F137-P412 WeakPolarHBondContact O-CD 3.33Å; F137-P412 WeakPolarHBondContact O-CG 3.2Å; Q163-P412 HydrophobicContact CB-CB 4.3Å; Q163-P412 HydrophobicContact CB-CG 3.73Å; Q163-P412 VanDerWaalsContact OE1-CA 3.27Å; P412-G414 PolarHBondContact O-N 3.04Å
413	G	76	Confident	86.5	Confident	51 Å²	51	48.3 Å²	48.3	53%	0.526	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	69.8	6.6	-174.5	0	0	0	0	0	114.7	C411 M415	C411-G413 PolarHBondContact O-N 2.84Å; G413-M415 VanDerWaalsContact C-N 3.26Å; G413-M415 PolarHBondContact O-N 3.03Å
414	G	82.9	Confident	86.9	Confident	2 Å²	2	48.8 Å²	48.8	2%	0.021	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	73.1	9	177.3	0	0	0	0	0	115	C411 P412 F428 A429 L432	C411-G414 WeakPolarHBondContact O-CA 3.3Å; C411-G414 PolarHBondContact O-N 3.18Å; C411-G414 VanDerWaalsContact SG-CA 3.55Å; P412-G414 PolarHBondContact O-N 3.04Å; G414-F428 CarbonylContact O-C 3.59Å; G414-F428 WeakPolarHBondContact O-CA 3.43Å; G414-A429 PolarHBondContact O-N 3.05Å; G414-L432 WeakPolarHBondContact O-CD2 3.19Å
415	M	89.4	Confident	87.4	Confident	83 Å²	83	45.2 Å²	45.2	41%	0.409	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	138	176.7	-178.8	-175.4	69.9	0	0	111.3	C411 G413 K427 F428 L432	C411-M415 PolarHBondContact SG-N 2.86Å; G413-M415 VanDerWaalsContact C-N 3.26Å; G413-M415 PolarHBondContact O-N 3.03Å; M415-K427 CarbonylContact C-O 3.54Å; M415-K427 WeakPolarHBondContact CA-O 3.39Å; M415-F428 HydrophobicContact CB-CD1 4.09Å; M415-F428 HydrophobicContact CB-CE1 4.41Å; M415-F428 HydrophobicContact CG-CD1 3.7Å; M415-F428 HydrophobicContact CG-CE1 3.59Å; M415-F428 HydrophobicContact CG-CZ 4.49Å; M415-F428 HydrophobicContact SD-CD1 4.1Å; M415-F428 HydrophobicContact SD-CE1 3.46Å; M415-F428 WeakPolarHBondContact SD-CE1 3.35Å; M415-F428 HydrophobicContact SD-CZ 4.32Å; M415-L432 HydrophobicContact CB-CD2 4.41Å
416	K	89.1	Confident	88	Confident	41 Å²	41	39.6 Å²	39.6	18%	0.178	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	131.1	174.1	-169.5	170.2	-175	176.8	0	111.1	S135 C411 I418 E426 K427	S135-K416 PolarHBondContact O-NZ 2.92Å; C411-K416 HydrophobicContact CB-CB 4.23Å; K416-I418 HydrophobicContact CG-CG1 4.34Å; K416-E426 WeakPolarHBondContact O-CA 3.42Å; K416-K427 PolarHBondContact N-O 3.33Å; K416-K427 PolarHBondContact O-N 2.86Å
417	V	92	Very high	88.3	Confident	68 Å²	68	41 Å²	41	41%	0.412	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	130.8	176.8	-176.3	0	0	0	0	109.4	K424 L425 E426	V417-K424 HydrophobicContact CG1-CD 4.48Å; V417-K424 HydrophobicContact CG1-CG 4.09Å; V417-L425 CarbonylContact C-O 3.52Å; V417-L425 WeakPolarHBondContact CA-O 2.94Å; V417-E426 HydrophobicContact CG1-CG 4.26Å; V417-E426 HydrophobicContact CG2-CG 4.16Å
418	I	92	Very high	88.5	Confident	18 Å²	18	41.1 Å²	41.1	9%	0.092	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	125.4	180	-51.5	173.5	0	0	0	108.2	Q201 K416 Y420 L425	Q201-I418 HydrophobicContact CB-CG2 4.44Å; K416-I418 HydrophobicContact CG-CG1 4.34Å; I418-Y420 HydrophobicContact CB-CE2 3.96Å; I418-Y420 HydrophobicContact CG2-CD2 4.04Å; I418-Y420 HydrophobicContact CG2-CE1 4.22Å; I418-Y420 HydrophobicContact CG2-CE2 3.48Å; I418-Y420 VanDerWaalsContact CG2-CE2 3.48Å; I418-L425 HydrophobicContact CB-CB 4.44Å; I418-L425 PolarHBondContact N-O 3.05Å; I418-L425 PolarHBondContact O-N 3.28Å
419	Q	92.5	Very high	88.8	Confident	119 Å²	119	39.5 Å²	39.5	56%	0.556	20%	0.202	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-93.8	132	173	-67.4	-171.6	-18.2	0	0	110.2	Q201 S202	Q201-Q419 CarbonylContact C-O 3.57Å; Q201-Q419 WeakPolarHBondContact CB-O 3.41Å; S202-Q419 PolarHBondContact N-O 3.37Å
420	Y	93.4	Very high	88.9	Confident	16 Å²	16	39.7 Å²	39.7	6%	0.063	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	172.9	177.2	-71.2	-72.6	0	0	0	109.8	Q201 S202 Q204 C206 I418 K422 A423 L425	Q201-Y420 HydrophobicContact CB-CD1 4.19Å; Q201-Y420 HydrophobicContact CB-CE1 4.16Å; Q201-Y420 WeakPolarHBondContact O-CA 3.41Å; S202-Y420 CarbonylContact O-C 3.54Å; S202-Y420 VanDerWaalsContact O-C 3.23Å; Q204-Y420 HydrophobicContact CB-CD1 4.3Å; Q204-Y420 WeakPolarHBondContact O-CB 3.36Å; C206-Y420 HydrophobicContact CB-CD1 4.44Å; C206-Y420 HydrophobicContact CB-CD2 3.89Å; C206-Y420 HydrophobicContact CB-CG 3.83Å; I418-Y420 HydrophobicContact CB-CE2 3.96Å; I418-Y420 HydrophobicContact CG2-CD2 4.04Å; I418-Y420 HydrophobicContact CG2-CE1 4.22Å; I418-Y420 HydrophobicContact CG2-CE2 3.48Å; I418-Y420 VanDerWaalsContact CG2-CE2 3.48Å; Y420-K422 PolarHBondContact O-N 2.92Å; Y420-A423 CarbonylContact C-O 3.52Å; Y420-A423 WeakPolarHBondContact CA-O 3.29Å; Y420-A423 PolarHBondContact N-O 3.35Å; Y420-A423 PolarHBondContact O-N 3.38Å; Y420-A423 VanDerWaalsContact O-N 3.09Å; Y420-L425 HydrophobicContact CD2-CB 4.06Å; Y420-L425 HydrophobicContact CE2-CB 3.89Å; Y420-L425 HydrophobicContact CE2-CD2 3.83Å
421	R	90.8	Very high	89	Confident	61 Å²	61	38.7 Å²	38.7	23%	0.23	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	113	174.5	-173.5	177	175.9	-154.9	9.8	110	S202 Q204 E205 E270 A423 L447	S202-R421 WeakPolarHBondContact O-CA 3.26Å; S202-R421 PolarHBondContact O-N 3.46Å; Q204-R421 WeakPolarHBondContact O-CB 3.49Å; Q204-R421 PolarHBondContact O-N 2.77Å; E205-R421 IonicContact OE1-NH1 2.69Å; E205-R421 PolarHBondContact OE1-NH1 3.38Å; E270-R421 IonicContact OE1-CZ 2.71Å; E270-R421 VanDerWaalsContact OE1-CZ 3.28Å; E270-R421 IonicContact OE1-NE 2.75Å; E270-R421 PolarHBondContact OE1-NE 3.2Å; E270-R421 IonicContact OE1-NH2 3.09Å; E270-R421 PolarHBondContact OE1-NH2 3.21Å; E270-R421 IonicContact OE2-CZ 3.97Å; E270-R421 IonicContact OE2-NE 2.84Å; E270-R421 PolarHBondContact OE2-NE 2.81Å; E270-R421 VanDerWaalsContact OE2-NE 3.09Å; E270-R421 IonicContact OE2-NH2 3.72Å; E270-R421 PolarHBondContact OE2-NH2 2.71Å; R421-A423 PolarHBondContact O-N 3.16Å; R421-A423 VanDerWaalsContact O-N 3.14Å; R421-L447 HydrophobicContact CG-CD2 4.17Å
422	K	91.5	Very high	89.3	Confident	64 Å²	64	42.2 Å²	42.2	28%	0.278	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.5	28.1	-177.2	-52.9	-169.4	175.2	-165.4	0	113.7	Y420 S443 Y444 S445 L447	Y420-K422 PolarHBondContact O-N 2.92Å; K422-S443 CarbonylContact O-C 3.59Å; K422-Y444 PolarHBondContact O-N 2.96Å; K422-S445 PolarHBondContact NZ-O 2.93Å; K422-L447 HydrophobicContact CD-CD2 4.41Å; K422-L447 HydrophobicContact CG-CD2 3.79Å
423	A	95.3	Very high	89.8	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	141.3	-176.7	0	0	0	0	0	112.4	C206 L209 Y420 R421 L441 T442	C206-A423 HydrophobicContact CB-CB 4.07Å; L209-A423 HydrophobicContact CD1-CB 3.98Å; Y420-A423 CarbonylContact C-O 3.52Å; Y420-A423 WeakPolarHBondContact CA-O 3.29Å; Y420-A423 PolarHBondContact N-O 3.35Å; Y420-A423 PolarHBondContact O-N 3.38Å; Y420-A423 VanDerWaalsContact O-N 3.09Å; R421-A423 PolarHBondContact O-N 3.16Å; R421-A423 VanDerWaalsContact O-N 3.14Å; A423-L441 HydrophobicContact CB-CD1 4.13Å; A423-T442 CarbonylContact C-O 3.54Å; A423-T442 VanDerWaalsContact CA-O 3.25Å; A423-T442 WeakPolarHBondContact CA-O 3.48Å
424	K	95.8	Very high	90.4	Very high	55 Å²	55	45.4 Å²	45.4	24%	0.239	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	119.2	172.5	-177.7	-171.2	174.4	-155.1	0	108.2	V417 E426 L441 T442 Y444	V417-K424 HydrophobicContact CG1-CD 4.48Å; V417-K424 HydrophobicContact CG1-CG 4.09Å; K424-E426 HydrophobicContact CD-CG 4.43Å; K424-E426 VanDerWaalsContact CE-OE1 3.24Å; K424-E426 WeakPolarHBondContact CE-OE1 2.94Å; K424-E426 HydrophobicContact CG-CG 4.31Å; K424-E426 VanDerWaalsContact NZ-CD 3.28Å; K424-E426 IonicContact NZ-OE1 2.82Å; K424-E426 PolarHBondContact NZ-OE1 2.95Å; K424-E426 IonicContact NZ-OE2 3.51Å; K424-L441 WeakPolarHBondContact O-CA 3.29Å; K424-T442 PolarHBondContact N-O 3.22Å; K424-T442 PolarHBondContact O-N 2.73Å; K424-Y444 HydrophobicContact CB-CE2 3.71Å
425	L	95.1	Very high	90.7	Very high	5 Å²	5	47.1 Å²	47.1	3%	0.026	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	120.8	177	-178.9	64	0	0	0	109.7	L208 V417 I418 Y420 K427 T439 L441	L208-L425 HydrophobicContact CD1-CD1 3.69Å; L208-L425 HydrophobicContact CD1-CD2 4.39Å; V417-L425 CarbonylContact C-O 3.52Å; V417-L425 WeakPolarHBondContact CA-O 2.94Å; I418-L425 HydrophobicContact CB-CB 4.44Å; I418-L425 PolarHBondContact N-O 3.05Å; I418-L425 PolarHBondContact O-N 3.28Å; Y420-L425 HydrophobicContact CD2-CB 4.06Å; Y420-L425 HydrophobicContact CE2-CB 3.89Å; Y420-L425 HydrophobicContact CE2-CD2 3.83Å; L425-K427 HydrophobicContact CG-CG 4.46Å; L425-T439 HydrophobicContact CD1-CG2 3.54Å; L425-L441 HydrophobicContact CB-CD1 4.36Å; L425-L441 HydrophobicContact CD1-CB 4.24Å; L425-L441 HydrophobicContact CD1-CD1 4.28Å
426	E	94.2	Very high	90.7	Very high	23 Å²	23	43.2 Å²	43.2	11%	0.107	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	126.3	175.5	-55.2	178.5	110.6	0	0	107.7	K416 V417 K424 F428 T439 R440	K416-E426 WeakPolarHBondContact O-CA 3.42Å; V417-E426 HydrophobicContact CG1-CG 4.26Å; V417-E426 HydrophobicContact CG2-CG 4.16Å; K424-E426 HydrophobicContact CD-CG 4.43Å; K424-E426 VanDerWaalsContact CE-OE1 3.24Å; K424-E426 WeakPolarHBondContact CE-OE1 2.94Å; K424-E426 HydrophobicContact CG-CG 4.31Å; K424-E426 VanDerWaalsContact NZ-CD 3.28Å; K424-E426 IonicContact NZ-OE1 2.82Å; K424-E426 PolarHBondContact NZ-OE1 2.95Å; K424-E426 IonicContact NZ-OE2 3.51Å; E426-F428 HydrophobicContact CB-CE2 3.79Å; E426-F428 HydrophobicContact CB-CZ 3.88Å; E426-T439 CarbonylContact O-C 3.6Å; E426-T439 VanDerWaalsContact O-CA 3.29Å; E426-T439 WeakPolarHBondContact O-CA 3.27Å; E426-R440 HydrophobicContact CB-CB 4.31Å; E426-R440 PolarHBondContact N-O 2.79Å; E426-R440 PolarHBondContact O-N 3.17Å; E426-R440 WeakPolarHBondContact OE2-CD 3.45Å; E426-R440 IonicContact OE2-NH1 3.43Å
427	K	92.2	Very high	90.9	Very high	66 Å²	66	41.3 Å²	41.3	29%	0.287	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	136.9	175.7	-69.2	-177.6	168.1	-172.6	0	108.6	E136 M415 K416 L425	E136-K427 IonicContact OE1-NZ 3.12Å; E136-K427 PolarHBondContact OE1-NZ 2.85Å; M415-K427 CarbonylContact C-O 3.54Å; M415-K427 WeakPolarHBondContact CA-O 3.39Å; K416-K427 PolarHBondContact N-O 3.33Å; K416-K427 PolarHBondContact O-N 2.86Å; L425-K427 HydrophobicContact CG-CG 4.46Å
428	F	91.7	Very high	91	Very high	22 Å²	22	38.6 Å²	38.6	10%	0.096	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	141	178.1	-53	-88	0	0	0	109.1	G414 M415 E426 L432 L433 L437 V438 R440	G414-F428 CarbonylContact O-C 3.59Å; G414-F428 WeakPolarHBondContact O-CA 3.43Å; M415-F428 HydrophobicContact CB-CD1 4.09Å; M415-F428 HydrophobicContact CB-CE1 4.41Å; M415-F428 HydrophobicContact CG-CD1 3.7Å; M415-F428 HydrophobicContact CG-CE1 3.59Å; M415-F428 HydrophobicContact CG-CZ 4.49Å; M415-F428 HydrophobicContact SD-CD1 4.1Å; M415-F428 HydrophobicContact SD-CE1 3.46Å; M415-F428 WeakPolarHBondContact SD-CE1 3.35Å; M415-F428 HydrophobicContact SD-CZ 4.32Å; E426-F428 HydrophobicContact CB-CE2 3.79Å; E426-F428 HydrophobicContact CB-CZ 3.88Å; F428-L432 HydrophobicContact CD1-CD2 4.46Å; F428-L433 HydrophobicContact CB-CD1 4.25Å; F428-L433 HydrophobicContact CD1-CD1 3.59Å; F428-L433 HydrophobicContact CD1-CG 4.09Å; F428-L433 HydrophobicContact CD2-CD1 3.94Å; F428-L433 HydrophobicContact CE1-CD1 3.81Å; F428-L433 HydrophobicContact CE2-CD1 4.16Å; F428-L433 HydrophobicContact CG-CD1 3.65Å; F428-L433 HydrophobicContact CG-CG 4.32Å; F428-L433 HydrophobicContact CZ-CD1 4.1Å; F428-L437 WeakPolarHBondContact CB-O 3.1Å; F428-L437 HydrophobicContact CD2-CD2 4.14Å; F428-L437 HydrophobicContact CD2-CG 4.12Å; F428-L437 HydrophobicContact CE2-CD2 3.75Å; F428-L437 HydrophobicContact CE2-CG 4.2Å; F428-L437 HydrophobicContact CZ-CD2 4.43Å; F428-V438 PolarHBondContact N-O 3.43Å; F428-R440 HydrophobicContact CE2-CB 4.43Å
429	A	87.9	Confident	91.2	Very high	6 Å²	6	39.2 Å²	39.2	5%	0.05	20%	0.197	C	C	.	.			trans	-59.8	142.4	172.8	0	0	0	0	0	110.1	T409 G414 Y431 L432	T409-A429 WeakPolarHBondContact O-CB 3.42Å; G414-A429 PolarHBondContact O-N 3.05Å; A429-Y431 PolarHBondContact O-N 3.27Å; A429-L432 HydrophobicContact CB-CB 4.16Å; A429-L432 VanDerWaalsContact O-CB 3.27Å; A429-L432 WeakPolarHBondContact O-CB 3.33Å; A429-L432 PolarHBondContact O-N 2.92Å
430	P	85.6	Confident	91.4	Very high	35 Å²	35	36.9 Å²	36.9	23%	0.227	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.2	132.9	172.7	-27.2	35.5	0	0	0	111.1	E408 L432 R703	E408-P430 WeakPolarHBondContact O-CD 3.45Å; P430-L432 PolarHBondContact O-N 3.29Å; P430-R703 PolarHBondContact O-NH2 3.3Å
431	Y	84.1	Confident	91.5	Very high	36 Å²	36	36.2 Å²	36.2	14%	0.141	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.1	15.6	-179.4	-48.4	-89.7	0	0	0	115.4	A429 H461 L694 H695 I696 R703	A429-Y431 PolarHBondContact O-N 3.27Å; Y431-H461 HydrophobicContact CD1-CB 4.34Å; Y431-H461 HydrophobicContact CE1-CB 3.59Å; Y431-H461 AromaticContact CE1-CD2 3.87Å; Y431-H461 AromaticContact CE1-CG 3.73Å; Y431-H461 AromaticContact CE2-CD2 3.44Å; Y431-H461 VanDerWaalsContact CE2-CD2 3.44Å; Y431-H461 WeakPolarHBondContact CE2-CD2 3.14Å; Y431-H461 AromaticContact CE2-CG 3.98Å; Y431-H461 AromaticContact CE2-NE2 3.65Å; Y431-H461 AromaticContact CZ-CD2 3.35Å; Y431-H461 AromaticContact CZ-CG 3.38Å; Y431-H461 AromaticContact CZ-ND1 3.86Å; Y431-H461 AromaticContact CZ-NE2 3.82Å; Y431-H461 VanDerWaalsContact OH-CG 3.25Å; Y431-H461 PolarHBondContact OH-ND1 2.86Å; Y431-L694 HydrophobicContact CD1-CB 4.12Å; Y431-L694 HydrophobicContact CD1-CD1 3.89Å; Y431-L694 HydrophobicContact CE1-CB 4.24Å; Y431-H695 WeakPolarHBondContact CE1-O 3.24Å; Y431-H695 PolarHBondContact OH-O 2.68Å; Y431-I696 HydrophobicContact CE1-CG1 4.13Å; Y431-R703 VanDerWaalsContact CD2-CZ 3.46Å
432	L	86	Confident	91.8	Very high	81 Å²	81	33.9 Å²	33.9	42%	0.424	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-47.6	169.2	178.5	70.1	0	0	0	110.3	G414 M415 F428 A429 P430	G414-L432 WeakPolarHBondContact O-CD2 3.19Å; M415-L432 HydrophobicContact CB-CD2 4.41Å; F428-L432 HydrophobicContact CD1-CD2 4.46Å; A429-L432 HydrophobicContact CB-CB 4.16Å; A429-L432 VanDerWaalsContact O-CB 3.27Å; A429-L432 WeakPolarHBondContact O-CB 3.33Å; A429-L432 PolarHBondContact O-N 2.92Å; P430-L432 PolarHBondContact O-N 3.29Å
433	L	88.8	Confident	92	Very high	47 Å²	47	31.7 Å²	31.7	25%	0.246	17%	0.165	C	C	.	.	S	Bend	trans	-90.4	138.1	177.1	-62.5	176.3	0	0	0	110.1	F428 D435 G436 L437	F428-L433 HydrophobicContact CB-CD1 4.25Å; F428-L433 HydrophobicContact CD1-CD1 3.59Å; F428-L433 HydrophobicContact CD1-CG 4.09Å; F428-L433 HydrophobicContact CD2-CD1 3.94Å; F428-L433 HydrophobicContact CE1-CD1 3.81Å; F428-L433 HydrophobicContact CE2-CD1 4.16Å; F428-L433 HydrophobicContact CG-CD1 3.65Å; F428-L433 HydrophobicContact CG-CG 4.32Å; F428-L433 HydrophobicContact CZ-CD1 4.1Å; L433-D435 WeakPolarHBondContact CB-OD1 3.26Å; L433-D435 PolarHBondContact O-N 2.81Å; L433-G436 PolarHBondContact O-N 2.83Å; L433-L437 HydrophobicContact CD1-CB 3.84Å; L433-L437 HydrophobicContact CD1-CD2 3.88Å; L433-L437 HydrophobicContact CD1-CG 4.22Å
434	P	87.3	Confident	91.9	Very high	106 Å²	106	33.4 Å²	33.4	69%	0.688	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-22	-177.9	27.9	-35.1	0	0	0	112.8	G436	P434-G436 VanDerWaalsContact C-N 3.27Å; P434-G436 PolarHBondContact O-N 3.1Å
435	D	89.3	Confident	91.6	Very high	38 Å²	38	33.8 Å²	33.8	20%	0.203	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-5.5	178	66.7	-6.7	0	0	0	113.7	L433 L437 Y459 R462 I692	L433-D435 WeakPolarHBondContact CB-OD1 3.26Å; L433-D435 PolarHBondContact O-N 2.81Å; D435-L437 VanDerWaalsContact C-N 3.32Å; D435-L437 VanDerWaalsContact OD1-CB 3.26Å; D435-L437 WeakPolarHBondContact OD1-CB 3.42Å; D435-L437 PolarHBondContact OD1-N 3.23Å; D435-Y459 WeakPolarHBondContact O-CD1 3.17Å; D435-R462 WeakPolarHBondContact O-CD 3.29Å; D435-R462 WeakPolarHBondContact O-CG 3.5Å; D435-R462 PolarHBondContact O-NH1 3.18Å; D435-I692 HydrophobicContact CB-CD1 3.72Å
436	G	90.1	Very high	91.2	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.01	19%	0.188	C	C	.	.			trans	77.7	11.1	-178.8	0	0	0	0	0	114.4	L433 P434 V438 Y459 Q460	L433-G436 PolarHBondContact O-N 2.83Å; P434-G436 VanDerWaalsContact C-N 3.27Å; P434-G436 PolarHBondContact O-N 3.1Å; G436-V438 PolarHBondContact O-N 2.86Å; G436-Y459 CarbonylContact O-C 3.42Å; G436-Y459 VanDerWaalsContact O-CA 3.29Å; G436-Y459 WeakPolarHBondContact O-CA 3.42Å; G436-Q460 PolarHBondContact O-N 3.1Å
437	L	94.3	Very high	90.8	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	126.5	178.3	-178.8	72	0	0	0	110.4	F428 L433 D435 T439 R440 E457 Y459	F428-L437 WeakPolarHBondContact CB-O 3.1Å; F428-L437 HydrophobicContact CD2-CD2 4.14Å; F428-L437 HydrophobicContact CD2-CG 4.12Å; F428-L437 HydrophobicContact CE2-CD2 3.75Å; F428-L437 HydrophobicContact CE2-CG 4.2Å; F428-L437 HydrophobicContact CZ-CD2 4.43Å; L433-L437 HydrophobicContact CD1-CB 3.84Å; L433-L437 HydrophobicContact CD1-CD2 3.88Å; L433-L437 HydrophobicContact CD1-CG 4.22Å; D435-L437 VanDerWaalsContact C-N 3.32Å; D435-L437 VanDerWaalsContact OD1-CB 3.26Å; D435-L437 WeakPolarHBondContact OD1-CB 3.42Å; D435-L437 PolarHBondContact OD1-N 3.23Å; L437-T439 WeakPolarHBondContact CD1-O 3.49Å; L437-R440 HydrophobicContact CD2-CB 4.4Å; L437-E457 HydrophobicContact CD1-CB 3.67Å; L437-E457 HydrophobicContact CD1-CG 3.99Å; L437-Y459 HydrophobicContact CB-CD1 4.01Å; L437-Y459 HydrophobicContact CB-CE1 3.91Å; L437-Y459 HydrophobicContact CD1-CD1 4.2Å; L437-Y459 HydrophobicContact CD1-CE1 3.85Å; L437-Y459 HydrophobicContact CG-CE1 4.49Å
438	V	93.4	Very high	90.4	Very high	11 Å²	11	40.2 Å²	40.2	7%	0.067	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	-24.7	177.9	-67.5	0	0	0	0	112.9	F428 G436 W458 Q460	F428-V438 PolarHBondContact N-O 3.43Å; G436-V438 PolarHBondContact O-N 2.86Å; V438-W458 HydrophobicContact CG2-CB 4.36Å; V438-W458 VanDerWaalsContact CG2-O 3.24Å; V438-W458 WeakPolarHBondContact CG2-O 3.39Å; V438-W458 PolarHBondContact N-O 2.66Å; V438-Q460 HydrophobicContact CB-CG 4.47Å; V438-Q460 HydrophobicContact CG1-CB 3.81Å; V438-Q460 HydrophobicContact CG1-CG 3.97Å; V438-Q460 HydrophobicContact CG2-CB 4.35Å; V438-Q460 HydrophobicContact CG2-CG 3.72Å
439	T	94.9	Very high	90.2	Very high	30 Å²	30	40.8 Å²	40.8	18%	0.184	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	134.9	178.8	-58.6	0	0	0	0	110.2	L208 L425 E426 L437 E457 W458	L208-T439 HydrophobicContact CD1-CG2 4.44Å; L425-T439 HydrophobicContact CD1-CG2 3.54Å; E426-T439 CarbonylContact O-C 3.6Å; E426-T439 VanDerWaalsContact O-CA 3.29Å; E426-T439 WeakPolarHBondContact O-CA 3.27Å; L437-T439 WeakPolarHBondContact CD1-O 3.49Å; T439-E457 CarbonylContact O-C 3.44Å; T439-E457 WeakPolarHBondContact O-CA 3.46Å; T439-W458 HydrophobicContact CG2-CE3 3.79Å; T439-W458 HydrophobicContact CG2-CZ3 4.08Å; T439-W458 PolarHBondContact N-O 3.04Å; T439-W458 PolarHBondContact O-N 2.88Å
440	R	96.9	Very high	90.2	Very high	70 Å²	70	45 Å²	45	26%	0.264	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	125.8	170.9	178.6	-176.1	-68.9	153.7	-2.9	109.4	E426 F428 L437 V455 K456 E457	E426-R440 HydrophobicContact CB-CB 4.31Å; E426-R440 PolarHBondContact N-O 2.79Å; E426-R440 PolarHBondContact O-N 3.17Å; E426-R440 WeakPolarHBondContact OE2-CD 3.45Å; E426-R440 IonicContact OE2-NH1 3.43Å; F428-R440 HydrophobicContact CE2-CB 4.43Å; L437-R440 HydrophobicContact CD2-CB 4.4Å; R440-V455 HydrophobicContact CG-CG1 4.04Å; R440-K456 CarbonylContact C-O 3.51Å; R440-K456 WeakPolarHBondContact CA-O 3.34Å; R440-E457 HydrophobicContact CB-CG 4.34Å; R440-E457 HydrophobicContact CG-CG 4Å; R440-E457 IonicContact CZ-OE1 3.52Å; R440-E457 IonicContact NE-OE1 3.54Å; R440-E457 PolarHBondContact NE-OE1 2.68Å; R440-E457 IonicContact NH2-OE1 2.72Å; R440-E457 PolarHBondContact NH2-OE1 3.42Å
441	L	97	Very high	90.4	Very high	3 Å²	3	49.2 Å²	49.2	2%	0.016	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	113.3	173.8	177.2	64.9	0	0	0	108.9	L208 L209 A423 K424 L425 K456 W458	L208-L441 HydrophobicContact CB-CD2 3.84Å; L208-L441 HydrophobicContact CD1-CD2 4.39Å; L209-L441 HydrophobicContact CD2-CD2 3.75Å; L209-L441 HydrophobicContact CG-CD2 4.11Å; A423-L441 HydrophobicContact CB-CD1 4.13Å; K424-L441 WeakPolarHBondContact O-CA 3.29Å; L425-L441 HydrophobicContact CB-CD1 4.36Å; L425-L441 HydrophobicContact CD1-CB 4.24Å; L425-L441 HydrophobicContact CD1-CD1 4.28Å; L441-K456 HydrophobicContact CB-CB 4.46Å; L441-K456 PolarHBondContact N-O 3.18Å; L441-K456 PolarHBondContact O-N 3.43Å; L441-W458 HydrophobicContact CB-CH2 4.05Å; L441-W458 HydrophobicContact CB-CZ3 3.67Å; L441-W458 HydrophobicContact CD2-CH2 4.17Å
442	T	96.7	Very high	90.8	Very high	12 Å²	12	50.2 Å²	50.2	7%	0.074	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	119.3	170.6	-55.1	0	0	0	0	108.6	A423 K424 Y444 P452 T454 V455	A423-T442 CarbonylContact C-O 3.54Å; A423-T442 VanDerWaalsContact CA-O 3.25Å; A423-T442 WeakPolarHBondContact CA-O 3.48Å; K424-T442 PolarHBondContact N-O 3.22Å; K424-T442 PolarHBondContact O-N 2.73Å; T442-Y444 HydrophobicContact CG2-CD2 4.32Å; T442-Y444 HydrophobicContact CG2-CE1 3.99Å; T442-Y444 HydrophobicContact CG2-CE2 3.66Å; T442-Y444 VanDerWaalsContact CG2-CZ 3.48Å; T442-Y444 WeakPolarHBondContact O-CE2 3.46Å; T442-P452 HydrophobicContact CG2-CB 3.78Å; T442-T454 CarbonylContact C-O 2.86Å; T442-T454 WeakPolarHBondContact CA-O 3.45Å; T442-V455 HydrophobicContact CG2-CG2 4.18Å
443	S	95.6	Very high	91.2	Very high	17 Å²	17	48 Å²	48	12%	0.119	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	145.8	171.5	-55.4	0	0	0	0	109.6	K422 P452 S453 T454	K422-S443 CarbonylContact O-C 3.59Å; S443-P452 CarbonylContact O-C 3.53Å; S443-P452 WeakPolarHBondContact O-CA 3.26Å; S443-S453 PolarHBondContact O-N 2.81Å; S443-S453 PolarHBondContact O-OG 2.83Å; S443-S453 VanDerWaalsContact O-OG 3.12Å; S443-T454 PolarHBondContact N-O 2.97Å; S443-T454 PolarHBondContact O-N 3.47Å
444	Y	93.3	Very high	91.5	Very high	37 Å²	37	47.4 Å²	47.4	15%	0.145	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	153.1	-176.4	-61.3	-94.4	0	0	0	110.8	K422 K424 T442 C449 Q451 P452	K422-Y444 PolarHBondContact O-N 2.96Å; K424-Y444 HydrophobicContact CB-CE2 3.71Å; T442-Y444 HydrophobicContact CG2-CD2 4.32Å; T442-Y444 HydrophobicContact CG2-CE1 3.99Å; T442-Y444 HydrophobicContact CG2-CE2 3.66Å; T442-Y444 VanDerWaalsContact CG2-CZ 3.48Å; T442-Y444 WeakPolarHBondContact O-CE2 3.46Å; Y444-C449 VanDerWaalsContact CD1-CA 3.44Å; Y444-C449 HydrophobicContact CD1-CB 3.89Å; Y444-C449 VanDerWaalsContact CD1-O 3.31Å; Y444-C449 WeakPolarHBondContact CD1-O 3.35Å; Y444-C449 HydrophobicContact CD2-CB 3.74Å; Y444-C449 VanDerWaalsContact CE1-C 3.47Å; Y444-C449 HydrophobicContact CE1-CB 3.97Å; Y444-C449 WeakPolarHBondContact CE1-O 3.38Å; Y444-C449 HydrophobicContact CE2-CB 3.83Å; Y444-C449 HydrophobicContact CG-CB 3.77Å; Y444-Q451 WeakPolarHBondContact CA-O 3.46Å; Y444-P452 HydrophobicContact CD1-CB 4.22Å; Y444-P452 HydrophobicContact CE1-CB 4.11Å
445	S	89.3	Confident	92	Very high	62 Å²	62	43.1 Å²	43.1	43%	0.434	24%	0.24	S	C	.	.	S	Bend	trans	-80.3	-31.7	175	62.9	0	0	0	0	112.1	K422 Q451	K422-S445 PolarHBondContact NZ-O 2.93Å; S445-Q451 PolarHBondContact N-O 2.79Å; S445-Q451 WeakPolarHBondContact OG-CB 3.36Å; S445-Q451 PolarHBondContact OG-O 2.77Å
446	D	87.7	Confident	92.4	Very high	29 Å²	29	43.8 Å²	43.8	16%	0.155	24%	0.241	C	C	.	.	S	Bend	trans	-103.4	161.3	-177.8	66.1	-56	0	0	0	112.9	D448 C449 T450 Q451	D446-D448 PolarHBondContact OD2-N 2.92Å; D446-C449 PolarHBondContact OD2-N 2.9Å; D446-C449 VanDerWaalsContact OD2-N 3.12Å; D446-T450 VanDerWaalsContact CG-OG1 3.28Å; D446-T450 PolarHBondContact OD1-N 3.13Å; D446-T450 WeakPolarHBondContact OD2-CB 3.24Å; D446-T450 PolarHBondContact OD2-N 3.38Å; D446-T450 PolarHBondContact OD2-OG1 3.29Å; D446-Q451 WeakPolarHBondContact OD1-CB 3.49Å; D446-Q451 PolarHBondContact OD1-N 2.75Å
447	L	84.4	Confident	92.8	Very high	59 Å²	59	44.8 Å²	44.8	31%	0.309	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-30.4	179	-71.2	168.2	0	0	0	112.5	E270 R421 K422 C449	E270-L447 HydrophobicContact CG-CD1 3.61Å; E270-L447 HydrophobicContact CG-CD2 4.15Å; R421-L447 HydrophobicContact CG-CD2 4.17Å; K422-L447 HydrophobicContact CD-CD2 4.41Å; K422-L447 HydrophobicContact CG-CD2 3.79Å; L447-C449 PolarHBondContact O-N 3.47Å
448	D	84.1	Confident	92.9	Very high	141 Å²	141	47.5 Å²	47.5	75%	0.754	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-1.6	-179.7	-57.6	-43.9	0	0	0	112.7	D446 T450	D446-D448 PolarHBondContact OD2-N 2.92Å; D448-T450 VanDerWaalsContact C-N 3.32Å; D448-T450 HydrophobicContact CB-CG2 4.02Å; D448-T450 PolarHBondContact O-N 3.31Å
449	C	87.1	Confident	93	Very high	34 Å²	34	47.4 Å²	47.4	23%	0.23	26%	0.255	C	S	.	.	S	Bend	trans	56.6	42.2	178.7	-58.3	0	0	0	0	113.3	Y444 D446 L447	Y444-C449 VanDerWaalsContact CD1-CA 3.44Å; Y444-C449 HydrophobicContact CD1-CB 3.89Å; Y444-C449 VanDerWaalsContact CD1-O 3.31Å; Y444-C449 WeakPolarHBondContact CD1-O 3.35Å; Y444-C449 HydrophobicContact CD2-CB 3.74Å; Y444-C449 VanDerWaalsContact CE1-C 3.47Å; Y444-C449 HydrophobicContact CE1-CB 3.97Å; Y444-C449 WeakPolarHBondContact CE1-O 3.38Å; Y444-C449 HydrophobicContact CE2-CB 3.83Å; Y444-C449 HydrophobicContact CG-CB 3.77Å; D446-C449 PolarHBondContact OD2-N 2.9Å; D446-C449 VanDerWaalsContact OD2-N 3.12Å; L447-C449 PolarHBondContact O-N 3.47Å
450	T	88.3	Confident	92.9	Very high	95 Å²	95	50 Å²	50	58%	0.583	27%	0.265	S	S	*	.			trans	-96.2	-31.2	179.3	62.4	0	0	0	0	112.9	D446 D448 P452	D446-T450 VanDerWaalsContact CG-OG1 3.28Å; D446-T450 PolarHBondContact OD1-N 3.13Å; D446-T450 WeakPolarHBondContact OD2-CB 3.24Å; D446-T450 PolarHBondContact OD2-N 3.38Å; D446-T450 PolarHBondContact OD2-OG1 3.29Å; D448-T450 VanDerWaalsContact C-N 3.32Å; D448-T450 HydrophobicContact CB-CG2 4.02Å; D448-T450 PolarHBondContact O-N 3.31Å; T450-P452 WeakPolarHBondContact O-CD 3.33Å
451	Q	90.1	Very high	92.6	Very high	124 Å²	124	49.4 Å²	49.4	58%	0.579	27%	0.265	S	S	*	.	S	Bend	trans	-114.6	95.2	-174.5	-64.7	-174.4	13.2	0	0	111.4	Y444 S445 D446 S453	Y444-Q451 WeakPolarHBondContact CA-O 3.46Å; S445-Q451 PolarHBondContact N-O 2.79Å; S445-Q451 WeakPolarHBondContact OG-CB 3.36Å; S445-Q451 PolarHBondContact OG-O 2.77Å; D446-Q451 WeakPolarHBondContact OD1-CB 3.49Å; D446-Q451 PolarHBondContact OD1-N 2.75Å; Q451-S453 PolarHBondContact O-N 3.48Å
452	P	93.1	Very high	92.3	Very high	56 Å²	56	49.6 Å²	49.6	36%	0.364	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	126.8	-178.4	28.5	-34.2	0	0	0	110.9	T442 S443 Y444 T450 K473	T442-P452 HydrophobicContact CG2-CB 3.78Å; S443-P452 CarbonylContact O-C 3.53Å; S443-P452 WeakPolarHBondContact O-CA 3.26Å; Y444-P452 HydrophobicContact CD1-CB 4.22Å; Y444-P452 HydrophobicContact CE1-CB 4.11Å; T450-P452 WeakPolarHBondContact O-CD 3.33Å; P452-K473 HydrophobicContact CB-CG 4.46Å; P452-K473 VanDerWaalsContact O-CB 3.3Å; P452-K473 WeakPolarHBondContact O-CB 3.43Å; P452-K473 WeakPolarHBondContact O-CG 2.97Å
453	S	93.9	Very high	92.1	Very high	34 Å²	34	54.4 Å²	54.4	24%	0.238	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	-42.9	177.4	66.2	0	0	0	0	112.2	S443 Q451 K473	S443-S453 PolarHBondContact O-N 2.81Å; S443-S453 PolarHBondContact O-OG 2.83Å; S443-S453 VanDerWaalsContact O-OG 3.12Å; Q451-S453 PolarHBondContact O-N 3.48Å; S453-K473 PolarHBondContact O-N 2.99Å
454	T	96	Very high	91.9	Very high	35 Å²	35	54.2 Å²	54.2	22%	0.215	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	134.2	-173.9	-48.8	0	0	0	0	109.6	T442 S443 E470 L471	T442-T454 CarbonylContact C-O 2.86Å; T442-T454 WeakPolarHBondContact CA-O 3.45Å; S443-T454 PolarHBondContact N-O 2.97Å; S443-T454 PolarHBondContact O-N 3.47Å; T454-E470 HydrophobicContact CG2-CG 3.69Å; T454-L471 WeakPolarHBondContact CA-O 3.47Å
455	V	97.3	Very high	91.9	Very high	17 Å²	17	55.1 Å²	55.1	10%	0.103	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	120.1	172.6	-176.8	0	0	0	0	107.4	R440 T442 E457 E470 L471	R440-V455 HydrophobicContact CG-CG1 4.04Å; T442-V455 HydrophobicContact CG2-CG2 4.18Å; V455-E457 HydrophobicContact CG1-CG 4.14Å; V455-E470 CarbonylContact O-C 3.56Å; V455-E470 WeakPolarHBondContact O-CA 3.26Å; V455-L471 HydrophobicContact CB-CB 4.41Å; V455-L471 PolarHBondContact N-O 3.06Å; V455-L471 PolarHBondContact O-N 3.32Å
456	K	97.3	Very high	92.2	Very high	51 Å²	51	52.1 Å²	52.1	22%	0.222	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	125.2	178.9	-168.5	168.9	-178.6	167.2	0	109.5	R440 L441 W458 E468 R469	R440-K456 CarbonylContact C-O 3.51Å; R440-K456 WeakPolarHBondContact CA-O 3.34Å; L441-K456 HydrophobicContact CB-CB 4.46Å; L441-K456 PolarHBondContact N-O 3.18Å; L441-K456 PolarHBondContact O-N 3.43Å; K456-W458 HydrophobicContact CB-CH2 3.98Å; K456-W458 HydrophobicContact CB-CZ3 4.08Å; K456-W458 HydrophobicContact CD-CH2 3.47Å; K456-W458 VanDerWaalsContact CD-CH2 3.47Å; K456-W458 HydrophobicContact CD-CZ2 3.4Å; K456-W458 HydrophobicContact CD-CZ3 4.33Å; K456-W458 HydrophobicContact CG-CE3 4.38Å; K456-W458 HydrophobicContact CG-CH2 3.53Å; K456-W458 HydrophobicContact CG-CZ2 3.7Å; K456-W458 HydrophobicContact CG-CZ3 3.87Å; K456-W458 WeakPolarHBondContact O-CZ3 3.39Å; K456-E468 WeakPolarHBondContact CE-OE1 3.48Å; K456-E468 VanDerWaalsContact CE-OE2 3.23Å; K456-E468 WeakPolarHBondContact CE-OE2 3.35Å; K456-E468 HydrophobicContact CG-CG 4.47Å; K456-E468 IonicContact NZ-OE1 3.01Å; K456-E468 PolarHBondContact NZ-OE1 3.18Å; K456-E468 IonicContact NZ-OE2 2.74Å; K456-E468 PolarHBondContact NZ-OE2 2.98Å; K456-R469 CarbonylContact C-O 3.5Å; K456-R469 WeakPolarHBondContact CA-O 3.46Å
457	E	97.5	Very high	92.6	Very high	23 Å²	23	54.6 Å²	54.6	11%	0.107	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	135.9	-173	-67.6	179.9	136.5	0	0	109.3	L437 T439 R440 V455 Y459 E468 R469	L437-E457 HydrophobicContact CD1-CB 3.67Å; L437-E457 HydrophobicContact CD1-CG 3.99Å; T439-E457 CarbonylContact O-C 3.44Å; T439-E457 WeakPolarHBondContact O-CA 3.46Å; R440-E457 HydrophobicContact CB-CG 4.34Å; R440-E457 HydrophobicContact CG-CG 4Å; R440-E457 IonicContact CZ-OE1 3.52Å; R440-E457 IonicContact NE-OE1 3.54Å; R440-E457 PolarHBondContact NE-OE1 2.68Å; R440-E457 IonicContact NH2-OE1 2.72Å; R440-E457 PolarHBondContact NH2-OE1 3.42Å; V455-E457 HydrophobicContact CG1-CG 4.14Å; E457-Y459 HydrophobicContact CB-CE2 3.78Å; E457-Y459 PolarHBondContact OE2-OH 3.44Å; E457-E468 CarbonylContact O-C 3.56Å; E457-E468 VanDerWaalsContact O-CA 3.26Å; E457-E468 WeakPolarHBondContact O-CA 3.34Å; E457-R469 HydrophobicContact CB-CB 4.35Å; E457-R469 PolarHBondContact N-O 3.34Å; E457-R469 PolarHBondContact O-N 2.86Å
458	W	97.4	Very high	93.2	Very high	57 Å²	57	53.6 Å²	53.6	22%	0.216	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	133.4	174.2	-66.3	-91	0	0	0	110.2	L208 V438 T439 L441 K456 E467 E468	L208-W458 HydrophobicContact CD1-CH2 4.12Å; L208-W458 HydrophobicContact CD1-CZ3 4.29Å; V438-W458 HydrophobicContact CG2-CB 4.36Å; V438-W458 VanDerWaalsContact CG2-O 3.24Å; V438-W458 WeakPolarHBondContact CG2-O 3.39Å; V438-W458 PolarHBondContact N-O 2.66Å; T439-W458 HydrophobicContact CG2-CE3 3.79Å; T439-W458 HydrophobicContact CG2-CZ3 4.08Å; T439-W458 PolarHBondContact N-O 3.04Å; T439-W458 PolarHBondContact O-N 2.88Å; L441-W458 HydrophobicContact CB-CH2 4.05Å; L441-W458 HydrophobicContact CB-CZ3 3.67Å; L441-W458 HydrophobicContact CD2-CH2 4.17Å; K456-W458 HydrophobicContact CB-CH2 3.98Å; K456-W458 HydrophobicContact CB-CZ3 4.08Å; K456-W458 HydrophobicContact CD-CH2 3.47Å; K456-W458 VanDerWaalsContact CD-CH2 3.47Å; K456-W458 HydrophobicContact CD-CZ2 3.4Å; K456-W458 HydrophobicContact CD-CZ3 4.33Å; K456-W458 HydrophobicContact CG-CE3 4.38Å; K456-W458 HydrophobicContact CG-CH2 3.53Å; K456-W458 HydrophobicContact CG-CZ2 3.7Å; K456-W458 HydrophobicContact CG-CZ3 3.87Å; K456-W458 WeakPolarHBondContact O-CZ3 3.39Å; W458-E467 CarbonylContact C-O 3.59Å; W458-E467 VanDerWaalsContact CA-O 3.26Å; W458-E467 WeakPolarHBondContact CA-O 3.5Å; W458-E468 PolarHBondContact NE1-OE2 3.1Å
459	Y	95.5	Very high	93.8	Very high	9 Å²	9	48.7 Å²	48.7	4%	0.035	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	147.5	-175.8	-57.4	-89.6	0	0	0	110.9	D435 G436 L437 E457 L466 E467 R469	D435-Y459 WeakPolarHBondContact O-CD1 3.17Å; G436-Y459 CarbonylContact O-C 3.42Å; G436-Y459 VanDerWaalsContact O-CA 3.29Å; G436-Y459 WeakPolarHBondContact O-CA 3.42Å; L437-Y459 HydrophobicContact CB-CD1 4.01Å; L437-Y459 HydrophobicContact CB-CE1 3.91Å; L437-Y459 HydrophobicContact CD1-CD1 4.2Å; L437-Y459 HydrophobicContact CD1-CE1 3.85Å; L437-Y459 HydrophobicContact CG-CE1 4.49Å; E457-Y459 HydrophobicContact CB-CE2 3.78Å; E457-Y459 PolarHBondContact OE2-OH 3.44Å; Y459-L466 WeakPolarHBondContact CB-O 3.02Å; Y459-L466 HydrophobicContact CD2-CD2 3.8Å; Y459-L466 HydrophobicContact CD2-CG 3.9Å; Y459-L466 HydrophobicContact CE2-CD2 3.74Å; Y459-L466 HydrophobicContact CE2-CG 4.26Å; Y459-L466 HydrophobicContact CG-CD2 4.35Å; Y459-E467 PolarHBondContact N-O 2.85Å; Y459-R469 HydrophobicContact CE2-CB 3.83Å
460	Q	92.4	Very high	94.3	Very high	85 Å²	85	49 Å²	49	40%	0.397	24%	0.242	S	C	.	.			trans	-128.3	154.6	172.4	-71.8	-179	8.8	0	0	110.6	G436 V438 R462	G436-Q460 PolarHBondContact O-N 3.1Å; V438-Q460 HydrophobicContact CB-CG 4.47Å; V438-Q460 HydrophobicContact CG1-CB 3.81Å; V438-Q460 HydrophobicContact CG1-CG 3.97Å; V438-Q460 HydrophobicContact CG2-CB 4.35Å; V438-Q460 HydrophobicContact CG2-CG 3.72Å; Q460-R462 PolarHBondContact O-N 3.23Å
461	H	90.1	Very high	94.7	Very high	58 Å²	58	46.4 Å²	46.4	27%	0.269	23%	0.225	S	C	.	.	S	Bend	trans	58.9	10.8	174.8	-51.3	-61.6	0	0	0	116.2	Y431 L694 H695	Y431-H461 HydrophobicContact CD1-CB 4.34Å; Y431-H461 HydrophobicContact CE1-CB 3.59Å; Y431-H461 AromaticContact CE1-CD2 3.87Å; Y431-H461 AromaticContact CE1-CG 3.73Å; Y431-H461 AromaticContact CE2-CD2 3.44Å; Y431-H461 VanDerWaalsContact CE2-CD2 3.44Å; Y431-H461 WeakPolarHBondContact CE2-CD2 3.14Å; Y431-H461 AromaticContact CE2-CG 3.98Å; Y431-H461 AromaticContact CE2-NE2 3.65Å; Y431-H461 AromaticContact CZ-CD2 3.35Å; Y431-H461 AromaticContact CZ-CG 3.38Å; Y431-H461 AromaticContact CZ-ND1 3.86Å; Y431-H461 AromaticContact CZ-NE2 3.82Å; Y431-H461 VanDerWaalsContact OH-CG 3.25Å; Y431-H461 PolarHBondContact OH-ND1 2.86Å; H461-L694 CarbonylContact O-C 3.51Å; H461-L694 VanDerWaalsContact O-CA 3.28Å; H461-L694 WeakPolarHBondContact O-CA 3.29Å; H461-H695 WeakPolarHBondContact O-CB 3.24Å; H461-H695 PolarHBondContact O-N 2.93Å
462	R	92.3	Very high	94.9	Very high	6 Å²	6	44.2 Å²	44.2	2%	0.023	21%	0.213	C	C	.	.	B	Isolated β-bridge	trans	-68.4	139.3	173.7	-61.6	178.7	58.9	119	-8.5	112	D435 Q460 D464 H465 E689 I692 L694	D435-R462 WeakPolarHBondContact O-CD 3.29Å; D435-R462 WeakPolarHBondContact O-CG 3.5Å; D435-R462 PolarHBondContact O-NH1 3.18Å; Q460-R462 PolarHBondContact O-N 3.23Å; R462-D464 VanDerWaalsContact C-N 3.32Å; R462-D464 WeakPolarHBondContact CB-OD1 3.21Å; R462-D464 IonicContact CZ-OD1 3.93Å; R462-D464 IonicContact CZ-OD2 2.69Å; R462-D464 IonicContact NE-OD1 2.76Å; R462-D464 PolarHBondContact NE-OD1 3.3Å; R462-D464 IonicContact NE-OD2 3.18Å; R462-D464 PolarHBondContact NE-OD2 2.8Å; R462-D464 IonicContact NH2-OD1 3.91Å; R462-D464 IonicContact NH2-OD2 2.77Å; R462-D464 PolarHBondContact NH2-OD2 3.04Å; R462-H465 PolarHBondContact O-N 2.94Å; R462-E689 IonicContact NH2-OE1 3.18Å; R462-E689 PolarHBondContact NH2-OE1 3.16Å; R462-I692 HydrophobicContact CG-CG2 4.43Å; R462-L694 HydrophobicContact CG-CD2 3.93Å
463	H	91.1	Very high	94.9	Very high	113 Å²	113	46 Å²	46	52%	0.523	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-29.6	179.9	-159.7	68.9	0	0	0	112.6	H465 E693	H463-H465 PolarHBondContact O-CD2 3.01Å; H463-H465 VanDerWaalsContact O-CD2 3.23Å; H463-H465 PolarHBondContact O-N 3.19Å; H463-E693 HydrophobicContact CB-CB 4.12Å; H463-E693 WeakPolarHBondContact CB-O 3.32Å; H463-E693 PolarHBondContact N-O 3.15Å
464	D	92.4	Very high	94.7	Very high	13 Å²	13	50.7 Å²	50.7	7%	0.07	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.7	0.8	175.6	69.4	-10.3	0	0	0	114.1	R462 L466 R685 E688	R462-D464 VanDerWaalsContact C-N 3.32Å; R462-D464 WeakPolarHBondContact CB-OD1 3.21Å; R462-D464 IonicContact CZ-OD1 3.93Å; R462-D464 IonicContact CZ-OD2 2.69Å; R462-D464 IonicContact NE-OD1 2.76Å; R462-D464 PolarHBondContact NE-OD1 3.3Å; R462-D464 IonicContact NE-OD2 3.18Å; R462-D464 PolarHBondContact NE-OD2 2.8Å; R462-D464 IonicContact NH2-OD1 3.91Å; R462-D464 IonicContact NH2-OD2 2.77Å; R462-D464 PolarHBondContact NH2-OD2 3.04Å; D464-L466 PolarHBondContact O-N 2.98Å; D464-L466 WeakPolarHBondContact OD1-CB 3.45Å; D464-L466 PolarHBondContact OD1-N 2.94Å; D464-L466 VanDerWaalsContact OD1-N 3.1Å; D464-R685 IonicContact OD2-NH1 2.75Å; D464-R685 PolarHBondContact OD2-NH1 3.31Å; D464-R685 VanDerWaalsContact OD2-NH1 3.13Å; D464-E688 HydrophobicContact CB-CB 4.21Å; D464-E688 VanDerWaalsContact CB-CD 3.48Å; D464-E688 HydrophobicContact CB-CG 3.84Å
465	H	93.8	Very high	94.5	Very high	56 Å²	56	51.6 Å²	51.6	26%	0.259	25%	0.251	S	S	.	.			trans	63.1	16.6	-179.3	-59.7	-82.7	0	0	0	115	R462 H463 E467 F482 R483 R486	R462-H465 PolarHBondContact O-N 2.94Å; H463-H465 PolarHBondContact O-CD2 3.01Å; H463-H465 VanDerWaalsContact O-CD2 3.23Å; H463-H465 PolarHBondContact O-N 3.19Å; H465-E467 PolarHBondContact O-N 3.21Å; H465-F482 CarbonylContact O-C 3.52Å; H465-F482 VanDerWaalsContact O-CA 3.27Å; H465-F482 WeakPolarHBondContact O-CA 3.36Å; H465-R483 HydrophobicContact CB-CB 4.08Å; H465-R483 PolarHBondContact O-N 3Å; H465-R486 HydrophobicContact CB-CB 4.23Å
466	L	95.4	Very high	94.3	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	125.7	172.6	-177.7	68.7	0	0	0	109.6	Y459 D464 E480 F482	Y459-L466 WeakPolarHBondContact CB-O 3.02Å; Y459-L466 HydrophobicContact CD2-CD2 3.8Å; Y459-L466 HydrophobicContact CD2-CG 3.9Å; Y459-L466 HydrophobicContact CE2-CD2 3.74Å; Y459-L466 HydrophobicContact CE2-CG 4.26Å; Y459-L466 HydrophobicContact CG-CD2 4.35Å; D464-L466 PolarHBondContact O-N 2.98Å; D464-L466 WeakPolarHBondContact OD1-CB 3.45Å; D464-L466 PolarHBondContact OD1-N 2.94Å; D464-L466 VanDerWaalsContact OD1-N 3.1Å; L466-E480 HydrophobicContact CD1-CB 3.88Å; L466-E480 HydrophobicContact CD1-CG 4.31Å; L466-F482 VanDerWaalsContact CA-CD1 3.5Å; L466-F482 HydrophobicContact CB-CD1 3.92Å; L466-F482 HydrophobicContact CB-CE1 3.74Å; L466-F482 HydrophobicContact CD1-CD1 3.91Å; L466-F482 HydrophobicContact CD1-CE1 3.35Å; L466-F482 HydrophobicContact CD1-CZ 3.8Å; L466-F482 HydrophobicContact CG-CE1 4.11Å
467	E	95.1	Very high	94.2	Very high	80 Å²	80	53.6 Å²	53.6	37%	0.374	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	-40.2	177.6	-82.3	-170.4	146.7	0	0	112.7	W458 Y459 H465 H481 R483	W458-E467 CarbonylContact C-O 3.59Å; W458-E467 VanDerWaalsContact CA-O 3.26Å; W458-E467 WeakPolarHBondContact CA-O 3.5Å; Y459-E467 PolarHBondContact N-O 2.85Å; H465-E467 PolarHBondContact O-N 3.21Å; E467-H481 PolarHBondContact N-O 2.86Å; E467-R483 HydrophobicContact CG-CG 3.6Å; E467-R483 VanDerWaalsContact CG-NE 3.34Å; E467-R483 WeakPolarHBondContact OE1-CD 3.16Å; E467-R483 WeakPolarHBondContact OE1-CG 3.17Å; E467-R483 IonicContact OE1-CZ 3.03Å; E467-R483 IonicContact OE1-NE 3.08Å; E467-R483 PolarHBondContact OE1-NE 2.88Å; E467-R483 WeakPolarHBondContact OE2-CG 3.25Å
468	E	96.9	Very high	94.2	Very high	38 Å²	38	53.4 Å²	53.4	18%	0.178	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	136.6	-170.5	-175	179.9	124.2	0	0	110.1	K456 E457 W458 E480 H481	K456-E468 WeakPolarHBondContact CE-OE1 3.48Å; K456-E468 VanDerWaalsContact CE-OE2 3.23Å; K456-E468 WeakPolarHBondContact CE-OE2 3.35Å; K456-E468 HydrophobicContact CG-CG 4.47Å; K456-E468 IonicContact NZ-OE1 3.01Å; K456-E468 PolarHBondContact NZ-OE1 3.18Å; K456-E468 IonicContact NZ-OE2 2.74Å; K456-E468 PolarHBondContact NZ-OE2 2.98Å; E457-E468 CarbonylContact O-C 3.56Å; E457-E468 VanDerWaalsContact O-CA 3.26Å; E457-E468 WeakPolarHBondContact O-CA 3.34Å; W458-E468 PolarHBondContact NE1-OE2 3.1Å; E468-E480 CarbonylContact O-C 3.5Å; E468-E480 WeakPolarHBondContact O-CA 3.33Å; E468-H481 HydrophobicContact CB-CB 4.23Å; E468-H481 PolarHBondContact N-O 3.3Å; E468-H481 PolarHBondContact O-N 2.95Å; E468-H481 IonicContact OE1-ND1 3.7Å
469	R	96.9	Very high	94.2	Very high	39 Å²	39	51.9 Å²	51.9	15%	0.147	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	128.5	170.7	179.5	-178.7	-74.5	167.4	-2.9	109.1	K456 E457 Y459 T478 I479 E480 E689	K456-R469 CarbonylContact C-O 3.5Å; K456-R469 WeakPolarHBondContact CA-O 3.46Å; E457-R469 HydrophobicContact CB-CB 4.35Å; E457-R469 PolarHBondContact N-O 3.34Å; E457-R469 PolarHBondContact O-N 2.86Å; Y459-R469 HydrophobicContact CE2-CB 3.83Å; R469-T478 HydrophobicContact CG-CG2 3.91Å; R469-I479 CarbonylContact C-O 3.58Å; R469-I479 WeakPolarHBondContact CA-O 3.24Å; R469-E480 HydrophobicContact CG-CG 4.38Å; R469-E480 IonicContact CZ-OE1 3.57Å; R469-E480 IonicContact NE-OE1 3.33Å; R469-E480 PolarHBondContact NE-OE1 3.43Å; R469-E480 VanDerWaalsContact NE-OE1 3.1Å; R469-E480 IonicContact NH2-OE1 2.77Å; R469-E480 PolarHBondContact NH2-OE1 3.43Å; R469-E689 IonicContact CZ-OE1 2.7Å; R469-E689 IonicContact CZ-OE2 3.17Å; R469-E689 IonicContact NH1-OE2 3.37Å; R469-E689 PolarHBondContact NH1-OE2 2.82Å; R469-E689 IonicContact NH2-OE1 2.71Å; R469-E689 PolarHBondContact NH2-OE1 3.43Å; R469-E689 IonicContact NH2-OE2 3.55Å; R469-E689 PolarHBondContact NH2-OE2 2.89Å
470	E	97.3	Very high	94.3	Very high	39 Å²	39	51.4 Å²	51.4	18%	0.182	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	120.8	174.2	-172.5	-171.9	146.8	0	0	109.6	T454 V455 K472 T478 I479	T454-E470 HydrophobicContact CG2-CG 3.69Å; V455-E470 CarbonylContact O-C 3.56Å; V455-E470 WeakPolarHBondContact O-CA 3.26Å; E470-K472 WeakPolarHBondContact OE1-CE 3.39Å; E470-K472 IonicContact OE1-NZ 2.74Å; E470-T478 CarbonylContact O-C 3.58Å; E470-T478 WeakPolarHBondContact O-CA 3.43Å; E470-I479 HydrophobicContact CB-CB 4.42Å; E470-I479 PolarHBondContact N-O 2.87Å; E470-I479 PolarHBondContact O-N 3.04Å
471	L	96.7	Very high	94.5	Very high	41 Å²	41	50.5 Å²	50.5	22%	0.215	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	116.3	174.1	174.7	63.5	0	0	0	109.9	T454 V455 K473	T454-L471 WeakPolarHBondContact CA-O 3.47Å; V455-L471 HydrophobicContact CB-CB 4.41Å; V455-L471 PolarHBondContact N-O 3.06Å; V455-L471 PolarHBondContact O-N 3.32Å; L471-K473 HydrophobicContact CD2-CD 4.03Å; L471-K473 HydrophobicContact CG-CD 4.32Å
472	K	95.3	Very high	94.8	Very high	79 Å²	79	47.9 Å²	47.9	34%	0.343	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	108.8	172.2	-65.4	-177.6	-178.7	-178.7	0	109.5	E470 T474 S475 N476 V477	E470-K472 WeakPolarHBondContact OE1-CE 3.39Å; E470-K472 IonicContact OE1-NZ 2.74Å; K472-T474 VanDerWaalsContact C-N 3.33Å; K472-T474 PolarHBondContact O-N 3.35Å; K472-S475 PolarHBondContact O-N 2.78Å; K472-N476 VanDerWaalsContact O-CA 3.29Å; K472-N476 WeakPolarHBondContact O-CA 3.49Å; K472-N476 PolarHBondContact O-N 2.93Å; K472-V477 PolarHBondContact N-O 2.86Å; K472-V477 PolarHBondContact O-N 3.19Å
473	K	92.1	Very high	94.9	Very high	92 Å²	92	51.4 Å²	51.4	40%	0.4	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-31.3	-174.1	-68.8	-68.4	-173	177.1	0	113.3	P452 S453 L471 S475 N476	P452-K473 HydrophobicContact CB-CG 4.46Å; P452-K473 VanDerWaalsContact O-CB 3.3Å; P452-K473 WeakPolarHBondContact O-CB 3.43Å; P452-K473 WeakPolarHBondContact O-CG 2.97Å; S453-K473 PolarHBondContact O-N 2.99Å; L471-K473 HydrophobicContact CD2-CD 4.03Å; L471-K473 HydrophobicContact CG-CD 4.32Å; K473-S475 VanDerWaalsContact C-N 3.34Å; K473-S475 PolarHBondContact O-N 3.06Å; K473-N476 PolarHBondContact O-OD1 2.85Å
474	T	89.7	Confident	95	Very high	133 Å²	133	49.7 Å²	49.7	82%	0.816	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-30.7	-179.9	53.7	0	0	0	0	113.6	K472	K472-T474 VanDerWaalsContact C-N 3.33Å; K472-T474 PolarHBondContact O-N 3.35Å
475	S	91.7	Very high	94.8	Very high	55 Å²	55	52.4 Å²	52.4	39%	0.385	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116	-2.4	-177.1	64.4	0	0	0	0	113.6	K472 K473 V477	K472-S475 PolarHBondContact O-N 2.78Å; K473-S475 VanDerWaalsContact C-N 3.34Å; K473-S475 PolarHBondContact O-N 3.06Å; S475-V477 PolarHBondContact O-N 3.27Å; S475-V477 VanDerWaalsContact O-N 3.13Å; S475-V477 WeakPolarHBondContact OG-CB 3.47Å; S475-V477 VanDerWaalsContact OG-CG2 3.28Å; S475-V477 WeakPolarHBondContact OG-CG2 3.06Å
476	N	93.6	Very high	94.7	Very high	100 Å²	100	50.6 Å²	50.6	54%	0.535	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.7	33.3	-169.8	-68.3	-30.6	0	0	0	113.8	K472 K473	K472-N476 VanDerWaalsContact O-CA 3.29Å; K472-N476 WeakPolarHBondContact O-CA 3.49Å; K472-N476 PolarHBondContact O-N 2.93Å; K473-N476 PolarHBondContact O-OD1 2.85Å
477	V	95.7	Very high	94.4	Very high	10 Å²	10	53.3 Å²	53.3	6%	0.061	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	125.3	177.3	172.9	0	0	0	0	108.3	K472 S475 I479 R494 I496	K472-V477 PolarHBondContact N-O 2.86Å; K472-V477 PolarHBondContact O-N 3.19Å; S475-V477 PolarHBondContact O-N 3.27Å; S475-V477 VanDerWaalsContact O-N 3.13Å; S475-V477 WeakPolarHBondContact OG-CB 3.47Å; S475-V477 VanDerWaalsContact OG-CG2 3.28Å; S475-V477 WeakPolarHBondContact OG-CG2 3.06Å; V477-I479 HydrophobicContact CG1-CG1 4.15Å; V477-R494 HydrophobicContact CG1-CG 3.82Å; V477-I496 HydrophobicContact CG2-CD1 4.47Å; V477-I496 HydrophobicContact CG2-CG1 3.95Å
478	T	97.1	Very high	94.3	Very high	18 Å²	18	53.9 Å²	53.9	11%	0.11	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	135.8	172.4	-56	0	0	0	0	109.3	R469 E470 E480 R494 Y495	R469-T478 HydrophobicContact CG-CG2 3.91Å; E470-T478 CarbonylContact O-C 3.58Å; E470-T478 WeakPolarHBondContact O-CA 3.43Å; T478-E480 HydrophobicContact CG2-CG 4.1Å; T478-R494 CarbonylContact O-C 3.58Å; T478-R494 VanDerWaalsContact O-CA 3.3Å; T478-R494 WeakPolarHBondContact O-CA 3.49Å; T478-Y495 HydrophobicContact CG2-CE1 4.04Å; T478-Y495 HydrophobicContact CG2-CE2 4.43Å; T478-Y495 PolarHBondContact N-O 3.25Å; T478-Y495 PolarHBondContact O-N 3.11Å
479	I	97.1	Very high	94.2	Very high	25 Å²	25	52.7 Å²	52.7	13%	0.128	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	117.4	175.1	-51.7	174.3	0	0	0	107.6	R469 E470 V477 H481 H493 R494	R469-I479 CarbonylContact C-O 3.58Å; R469-I479 WeakPolarHBondContact CA-O 3.24Å; E470-I479 HydrophobicContact CB-CB 4.42Å; E470-I479 PolarHBondContact N-O 2.87Å; E470-I479 PolarHBondContact O-N 3.04Å; V477-I479 HydrophobicContact CG1-CG1 4.15Å; I479-H481 VanDerWaalsContact CG2-CE1 3.48Å; I479-H481 WeakPolarHBondContact CG2-CE1 3.4Å; I479-H493 WeakPolarHBondContact CA-O 3.09Å; I479-R494 HydrophobicContact CG1-CB 4.32Å; I479-R494 HydrophobicContact CG1-CG 4.11Å
480	E	97.2	Very high	94.1	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	141.9	177	-58.1	-173.2	133.4	0	0	110.1	L466 E468 R469 T478 F482 S492 H493 Y495 R685	L466-E480 HydrophobicContact CD1-CB 3.88Å; L466-E480 HydrophobicContact CD1-CG 4.31Å; E468-E480 CarbonylContact O-C 3.5Å; E468-E480 WeakPolarHBondContact O-CA 3.33Å; R469-E480 HydrophobicContact CG-CG 4.38Å; R469-E480 IonicContact CZ-OE1 3.57Å; R469-E480 IonicContact NE-OE1 3.33Å; R469-E480 PolarHBondContact NE-OE1 3.43Å; R469-E480 VanDerWaalsContact NE-OE1 3.1Å; R469-E480 IonicContact NH2-OE1 2.77Å; R469-E480 PolarHBondContact NH2-OE1 3.43Å; T478-E480 HydrophobicContact CG2-CG 4.1Å; E480-F482 HydrophobicContact CB-CE2 3.75Å; E480-F482 HydrophobicContact CB-CZ 3.67Å; E480-F482 WeakPolarHBondContact OE2-CZ 3.47Å; E480-S492 CarbonylContact O-C 3.55Å; E480-S492 WeakPolarHBondContact O-CA 3.3Å; E480-S492 VanDerWaalsContact O-CB 3.28Å; E480-S492 WeakPolarHBondContact O-CB 3.35Å; E480-H493 HydrophobicContact CB-CB 4.5Å; E480-H493 PolarHBondContact N-O 2.87Å; E480-H493 PolarHBondContact O-N 2.58Å; E480-Y495 HydrophobicContact CG-CE1 3.98Å; E480-Y495 PolarHBondContact OE1-OH 2.98Å; E480-R685 IonicContact OE1-CZ 3.54Å; E480-R685 IonicContact OE1-NH2 3.03Å; E480-R685 PolarHBondContact OE1-NH2 3.4Å; E480-R685 IonicContact OE2-CZ 2.74Å; E480-R685 IonicContact OE2-NE 2.74Å; E480-R685 PolarHBondContact OE2-NE 3.06Å; E480-R685 VanDerWaalsContact OE2-NE 3.11Å; E480-R685 IonicContact OE2-NH2 3.71Å; E480-R685 PolarHBondContact OE2-NH2 3.46Å
481	H	97.2	Very high	94.1	Very high	66 Å²	66	53.5 Å²	53.5	31%	0.306	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	138.7	174.3	-62.4	90.9	0	0	0	111	E467 E468 I479	E467-H481 PolarHBondContact N-O 2.86Å; E468-H481 HydrophobicContact CB-CB 4.23Å; E468-H481 PolarHBondContact N-O 3.3Å; E468-H481 PolarHBondContact O-N 2.95Å; E468-H481 IonicContact OE1-ND1 3.7Å; I479-H481 VanDerWaalsContact CG2-CE1 3.48Å; I479-H481 WeakPolarHBondContact CG2-CE1 3.4Å
482	F	96.5	Very high	94.1	Very high	2 Å²	2	52.1 Å²	52.1	1%	0.009	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	145.5	-173.6	-54.8	-82.2	0	0	0	112.4	H465 L466 E480 L490 K491 H493 Y509	H465-F482 CarbonylContact O-C 3.52Å; H465-F482 VanDerWaalsContact O-CA 3.27Å; H465-F482 WeakPolarHBondContact O-CA 3.36Å; L466-F482 VanDerWaalsContact CA-CD1 3.5Å; L466-F482 HydrophobicContact CB-CD1 3.92Å; L466-F482 HydrophobicContact CB-CE1 3.74Å; L466-F482 HydrophobicContact CD1-CD1 3.91Å; L466-F482 HydrophobicContact CD1-CE1 3.35Å; L466-F482 HydrophobicContact CD1-CZ 3.8Å; L466-F482 HydrophobicContact CG-CE1 4.11Å; E480-F482 HydrophobicContact CB-CE2 3.75Å; E480-F482 HydrophobicContact CB-CZ 3.67Å; E480-F482 WeakPolarHBondContact OE2-CZ 3.47Å; F482-L490 HydrophobicContact CD2-CD2 4.15Å; F482-L490 HydrophobicContact CD2-CG 4.17Å; F482-L490 HydrophobicContact CE2-CD2 3.83Å; F482-L490 HydrophobicContact CE2-CG 4.29Å; F482-K491 PolarHBondContact N-O 3.25Å; F482-H493 HydrophobicContact CE2-CB 4.23Å; F482-Y509 PolarHBondContact O-OH 3.08Å
483	R	94.7	Very high	94.2	Very high	80 Å²	80	48.4 Å²	48.4	30%	0.302	27%	0.271	S	S	.	.			trans	-67.2	155.5	170.2	-75.9	-177.7	-114.6	146.3	10.1	112.2	H465 E467	H465-R483 HydrophobicContact CB-CB 4.08Å; H465-R483 PolarHBondContact O-N 3Å; E467-R483 HydrophobicContact CG-CG 3.6Å; E467-R483 VanDerWaalsContact CG-NE 3.34Å; E467-R483 WeakPolarHBondContact OE1-CD 3.16Å; E467-R483 WeakPolarHBondContact OE1-CG 3.17Å; E467-R483 IonicContact OE1-CZ 3.03Å; E467-R483 IonicContact OE1-NE 3.08Å; E467-R483 PolarHBondContact OE1-NE 2.88Å; E467-R483 WeakPolarHBondContact OE2-CG 3.25Å
484	P	93.4	Very high	94.5	Very high	78 Å²	78	48.4 Å²	48.4	51%	0.506	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	146.7	165.3	-19.6	31.1	0	0	0	111.7	Y509	P484-Y509 HydrophobicContact CB-CE2 4.27Å; P484-Y509 WeakPolarHBondContact CD-OH 3.35Å; P484-Y509 HydrophobicContact CG-CD1 4.48Å; P484-Y509 HydrophobicContact CG-CE1 3.87Å; P484-Y509 HydrophobicContact CG-CE2 4.06Å
485	G	87.6	Confident	94.8	Very high	69 Å²	69	43.1 Å²	43.1	71%	0.711	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	113.3	-11.5	174.3	0	0	0	0	0	115.5
486	R	91	Very high	94.8	Very high	19 Å²	19	44.2 Å²	44.2	7%	0.072	24%	0.235	C	C	.	.	S	Bend	trans	-77.5	164.9	176.7	72.3	167.6	-66.9	159.9	17	113.9	H465 A489 L490 E688	H465-R486 HydrophobicContact CB-CB 4.23Å; R486-A489 PolarHBondContact O-N 2.91Å; R486-L490 WeakPolarHBondContact CD-O 3.35Å; R486-E688 IonicContact CZ-OE1 2.96Å; R486-E688 IonicContact CZ-OE2 2.64Å; R486-E688 IonicContact NH1-OE2 3.51Å; R486-E688 IonicContact NH2-OE1 3.23Å; R486-E688 PolarHBondContact NH2-OE1 3.23Å; R486-E688 IonicContact NH2-OE2 2.73Å; R486-E688 PolarHBondContact NH2-OE2 3.08Å
487	S	89.4	Confident	94.7	Very high	56 Å²	56	42.1 Å²	42.1	39%	0.392	23%	0.226	S	C	.	.	G	3₁₀ helix	trans	-54.2	146.2	172.3	58.1	0	0	0	0	112.2	A489	S487-A489 PolarHBondContact O-N 3.47Å
488	Y	92.4	Very high	94.3	Very high	93 Å²	93	44.7 Å²	44.7	37%	0.365	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	59	4.4	-177.3	-53.5	-82.1	0	0	0	116	L490 F508 R513 E677 I681 V684	Y488-L490 PolarHBondContact O-N 3.12Å; Y488-F508 VanDerWaalsContact O-CD1 3.31Å; Y488-F508 WeakPolarHBondContact O-CD1 3.08Å; Y488-R513 PolarHBondContact O-NH1 3.19Å; Y488-E677 HydrophobicContact CD1-CG 3.99Å; Y488-E677 HydrophobicContact CE1-CG 4.17Å; Y488-I681 HydrophobicContact CD1-CD1 4.48Å; Y488-I681 HydrophobicContact CD1-CG1 4.13Å; Y488-I681 HydrophobicContact CD2-CG1 3.74Å; Y488-I681 HydrophobicContact CE2-CG1 4.25Å; Y488-I681 HydrophobicContact CG-CD1 4.18Å; Y488-I681 HydrophobicContact CG-CG1 3.67Å; Y488-V684 HydrophobicContact CE2-CG2 4.33Å
489	A	95.1	Very high	93.9	Very high	12 Å²	12	47.6 Å²	47.6	10%	0.099	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	54.7	30.3	-176.5	0	0	0	0	0	113.6	R486 S487 K491 F508 Y509 A512 R513	R486-A489 PolarHBondContact O-N 2.91Å; S487-A489 PolarHBondContact O-N 3.47Å; A489-K491 PolarHBondContact O-N 3.41Å; A489-F508 CarbonylContact O-C 3.5Å; A489-F508 VanDerWaalsContact O-CA 3.31Å; A489-F508 WeakPolarHBondContact O-CA 3.44Å; A489-Y509 PolarHBondContact O-N 3.28Å; A489-A512 HydrophobicContact CB-CB 3.89Å; A489-R513 HydrophobicContact CB-CG 3.81Å
490	L	96.2	Very high	93.4	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.005	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	125.8	178.5	-175	69.4	0	0	0	109.9	F482 R486 Y488 H493 M506 F508 I681	F482-L490 HydrophobicContact CD2-CD2 4.15Å; F482-L490 HydrophobicContact CD2-CG 4.17Å; F482-L490 HydrophobicContact CE2-CD2 3.83Å; F482-L490 HydrophobicContact CE2-CG 4.29Å; R486-L490 WeakPolarHBondContact CD-O 3.35Å; Y488-L490 PolarHBondContact O-N 3.12Å; L490-H493 HydrophobicContact CD2-CB 4.27Å; L490-M506 HydrophobicContact CD1-CB 3.8Å; L490-M506 HydrophobicContact CD1-CG 4.06Å; L490-F508 HydrophobicContact CB-CD1 4.4Å; L490-F508 HydrophobicContact CB-CE1 4.38Å; L490-F508 HydrophobicContact CD1-CD1 4.15Å; L490-F508 HydrophobicContact CD1-CE1 3.74Å; L490-F508 HydrophobicContact CD1-CZ 4.17Å; L490-I681 HydrophobicContact CD2-CG2 4.02Å
491	K	96.6	Very high	92.9	Very high	95 Å²	95	50.1 Å²	50.1	41%	0.413	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	-47.2	-178.5	174.1	179.3	178.3	-175.6	0	111.5	F482 A489 D507 Y509	F482-K491 PolarHBondContact N-O 3.25Å; A489-K491 PolarHBondContact O-N 3.41Å; K491-D507 WeakPolarHBondContact CA-O 3.21Å; K491-D507 WeakPolarHBondContact CB-O 3.25Å; K491-D507 PolarHBondContact N-O 3.1Å; K491-Y509 HydrophobicContact CB-CD1 4.44Å; K491-Y509 HydrophobicContact CB-CD2 3.8Å; K491-Y509 HydrophobicContact CB-CE1 4.29Å; K491-Y509 HydrophobicContact CB-CE2 3.61Å; K491-Y509 HydrophobicContact CB-CG 4.22Å; K491-Y509 HydrophobicContact CD-CD1 4.08Å; K491-Y509 HydrophobicContact CD-CE1 3.79Å; K491-Y509 HydrophobicContact CG-CD1 4.41Å; K491-Y509 HydrophobicContact CG-CD2 4.43Å; K491-Y509 HydrophobicContact CG-CE1 3.89Å; K491-Y509 HydrophobicContact CG-CE2 3.9Å
492	S	97.4	Very high	92.6	Very high	12 Å²	12	48.6 Å²	48.6	8%	0.084	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	150.1	175.3	48.3	0	0	0	0	111.9	E480 M506 D507	E480-S492 CarbonylContact O-C 3.55Å; E480-S492 WeakPolarHBondContact O-CA 3.3Å; E480-S492 VanDerWaalsContact O-CB 3.28Å; E480-S492 WeakPolarHBondContact O-CB 3.35Å; S492-M506 CarbonylContact O-C 3.6Å; S492-M506 WeakPolarHBondContact O-CA 3.33Å; S492-D507 PolarHBondContact N-O 3.45Å; S492-D507 VanDerWaalsContact N-O 3.14Å; S492-D507 PolarHBondContact O-N 3.24Å; S492-D507 WeakPolarHBondContact OG-CB 3.2Å; S492-D507 PolarHBondContact OG-OD2 3.34Å
493	H	97.2	Very high	92.4	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	113.1	179.2	-174.1	-151.1	0	0	0	109.7	I479 E480 F482 L490 Y495 Q505 M506	I479-H493 WeakPolarHBondContact CA-O 3.09Å; E480-H493 HydrophobicContact CB-CB 4.5Å; E480-H493 PolarHBondContact N-O 2.87Å; E480-H493 PolarHBondContact O-N 2.58Å; F482-H493 HydrophobicContact CE2-CB 4.23Å; L490-H493 HydrophobicContact CD2-CB 4.27Å; H493-Y495 HydrophobicContact CB-CD1 4.47Å; H493-Y495 AromaticContact CD2-CD1 3.9Å; H493-Y495 AromaticContact CE1-CD1 3.33Å; H493-Y495 WeakPolarHBondContact CE1-CD1 3.39Å; H493-Y495 AromaticContact CE1-CE1 3.86Å; H493-Y495 AromaticContact CE1-CG 3.83Å; H493-Y495 AromaticContact CG-CD1 3.67Å; H493-Y495 AromaticContact ND1-CD1 3.31Å; H493-Y495 VanDerWaalsContact ND1-CD1 3.31Å; H493-Y495 WeakPolarHBondContact ND1-CD1 3.15Å; H493-Y495 AromaticContact ND1-CE1 3.52Å; H493-Y495 AromaticContact NE2-CD1 3.72Å; H493-Q505 WeakPolarHBondContact CA-O 3.21Å; H493-M506 WeakPolarHBondContact NE2-CE 3.38Å
494	R	97.3	Very high	92.5	Very high	92 Å²	92	48.9 Å²	48.9	35%	0.347	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	122	174.8	172.9	178.1	179.6	-109.7	-9.3	109	V477 T478 I479 E503 R504 Q505	V477-R494 HydrophobicContact CG1-CG 3.82Å; T478-R494 CarbonylContact O-C 3.58Å; T478-R494 VanDerWaalsContact O-CA 3.3Å; T478-R494 WeakPolarHBondContact O-CA 3.49Å; I479-R494 HydrophobicContact CG1-CB 4.32Å; I479-R494 HydrophobicContact CG1-CG 4.11Å; R494-E503 IonicContact NH1-OE1 3.63Å; R494-R504 CarbonylContact O-C 3.53Å; R494-R504 WeakPolarHBondContact O-CA 3.32Å; R494-R504 WeakPolarHBondContact O-CB 3.49Å; R494-Q505 HydrophobicContact CB-CB 4.3Å; R494-Q505 PolarHBondContact N-O 3.18Å; R494-Q505 PolarHBondContact O-N 3.37Å
495	Y	95.6	Very high	92.7	Very high	23 Å²	23	47.4 Å²	47.4	9%	0.09	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	162.1	-176.9	62	-84.5	0	0	0	112	T478 E480 H493 M498	T478-Y495 HydrophobicContact CG2-CE1 4.04Å; T478-Y495 HydrophobicContact CG2-CE2 4.43Å; T478-Y495 PolarHBondContact N-O 3.25Å; T478-Y495 PolarHBondContact O-N 3.11Å; E480-Y495 HydrophobicContact CG-CE1 3.98Å; E480-Y495 PolarHBondContact OE1-OH 2.98Å; H493-Y495 HydrophobicContact CB-CD1 4.47Å; H493-Y495 AromaticContact CD2-CD1 3.9Å; H493-Y495 AromaticContact CE1-CD1 3.33Å; H493-Y495 WeakPolarHBondContact CE1-CD1 3.39Å; H493-Y495 AromaticContact CE1-CE1 3.86Å; H493-Y495 AromaticContact CE1-CG 3.83Å; H493-Y495 AromaticContact CG-CD1 3.67Å; H493-Y495 AromaticContact ND1-CD1 3.31Å; H493-Y495 VanDerWaalsContact ND1-CD1 3.31Å; H493-Y495 WeakPolarHBondContact ND1-CD1 3.15Å; H493-Y495 AromaticContact ND1-CE1 3.52Å; H493-Y495 AromaticContact NE2-CD1 3.72Å; Y495-M498 HydrophobicContact CD1-SD 4.34Å; Y495-M498 HydrophobicContact CD2-CG 4.26Å; Y495-M498 HydrophobicContact CD2-SD 3.8Å; Y495-M498 HydrophobicContact CE1-SD 4.03Å; Y495-M498 HydrophobicContact CE2-CG 3.78Å; Y495-M498 HydrophobicContact CE2-SD 3.44Å; Y495-M498 WeakPolarHBondContact CE2-SD 3.46Å; Y495-M498 HydrophobicContact CG-SD 4.23Å; Y495-M498 VanDerWaalsContact CZ-SD 3.57Å
496	I	93.4	Very high	93.1	Very high	78 Å²	78	44.2 Å²	44.2	40%	0.4	22%	0.224	S	C	.	.	S	Bend	trans	-100.7	-42.2	168.9	-59.7	171.5	0	0	0	109.8	V477	V477-I496 HydrophobicContact CG2-CD1 4.47Å; V477-I496 HydrophobicContact CG2-CG1 3.95Å
497	T	90.3	Very high	93.5	Very high	55 Å²	55	44.4 Å²	44.4	34%	0.337	23%	0.226	S	C	.	.			trans	-132.3	152.7	178.3	65.1	0	0	0	0	110.9	T499 T502	T497-T499 VanDerWaalsContact C-N 3.25Å; T497-T499 PolarHBondContact O-N 2.87Å; T497-T499 PolarHBondContact OG1-OG1 3.31Å; T497-T502 PolarHBondContact OG1-OG1 3.33Å
498	M	88.3	Confident	93.9	Very high	64 Å²	64	42 Å²	42	32%	0.315	21%	0.209	S	C	.	.	S	Bend	trans	-81.9	-0.8	176.1	-70.3	-61.6	-72.1	0	0	113.6	Y495 L682 R685	Y495-M498 HydrophobicContact CD1-SD 4.34Å; Y495-M498 HydrophobicContact CD2-CG 4.26Å; Y495-M498 HydrophobicContact CD2-SD 3.8Å; Y495-M498 HydrophobicContact CE1-SD 4.03Å; Y495-M498 HydrophobicContact CE2-CG 3.78Å; Y495-M498 HydrophobicContact CE2-SD 3.44Å; Y495-M498 WeakPolarHBondContact CE2-SD 3.46Å; Y495-M498 HydrophobicContact CG-SD 4.23Å; Y495-M498 VanDerWaalsContact CZ-SD 3.57Å; M498-L682 HydrophobicContact CE-CD2 3.79Å; M498-L682 VanDerWaalsContact O-CD1 3.3Å; M498-L682 WeakPolarHBondContact O-CD1 3.36Å; M498-L682 HydrophobicContact SD-CD2 4.22Å; M498-R685 HydrophobicContact CE-CB 3.41Å; M498-R685 VanDerWaalsContact CE-CB 3.41Å; M498-R685 HydrophobicContact CE-CG 4.16Å
499	T	88.3	Confident	94	Very high	79 Å²	79	39.6 Å²	39.6	49%	0.485	20%	0.199	S	C	.	.	S	Bend	trans	-75.7	130.6	179.1	54.6	0	0	0	0	110.9	T497 T502 R504	T497-T499 VanDerWaalsContact C-N 3.25Å; T497-T499 PolarHBondContact O-N 2.87Å; T497-T499 PolarHBondContact OG1-OG1 3.31Å; T499-T502 PolarHBondContact O-OG1 3.29Å; T499-T502 WeakPolarHBondContact OG1-CG2 3.11Å; T499-R504 PolarHBondContact O-NH2 2.97Å
500	P	85.8	Confident	94	Very high	45 Å²	45	39.9 Å²	39.9	29%	0.292	20%	0.2	S	C	.	.	S	Bend	trans	-57.6	163.1	-178.1	26	-34.9	0	0	0	114.1	T502 R679 L682	P500-T502 VanDerWaalsContact C-N 3.3Å; P500-T502 PolarHBondContact O-N 2.79Å; P500-R679 HydrophobicContact CB-CG 4.27Å; P500-L682 HydrophobicContact CB-CD1 4.08Å
501	E	88.1	Confident	93.8	Very high	34 Å²	34	47.1 Å²	47.1	16%	0.159	23%	0.234	C	C	.	.	S	Bend	trans	65.8	28.1	175.1	-50.3	170.5	-171.9	0	0	114	P524 R548	E501-P524 VanDerWaalsContact O-CA 3.32Å; E501-P524 WeakPolarHBondContact O-CA 3.37Å; E501-R548 IonicContact OE1-CZ 2.86Å; E501-R548 IonicContact OE1-NH1 3.69Å; E501-R548 IonicContact OE1-NH2 2.79Å; E501-R548 PolarHBondContact OE1-NH2 3.23Å; E501-R548 IonicContact OE2-CZ 2.73Å; E501-R548 IonicContact OE2-NH1 3.54Å; E501-R548 PolarHBondContact OE2-NH1 2.9Å; E501-R548 IonicContact OE2-NH2 3.47Å; E501-R548 PolarHBondContact OE2-NH2 3Å
502	T	89.8	Confident	93.6	Very high	34 Å²	34	45.8 Å²	45.8	21%	0.209	24%	0.241	C	C	.	.	S	Bend	trans	-117.1	164.9	174.7	62.7	0	0	0	0	111.3	T497 T499 P500 R504 E522	T497-T502 PolarHBondContact OG1-OG1 3.33Å; T499-T502 PolarHBondContact O-OG1 3.29Å; T499-T502 WeakPolarHBondContact OG1-CG2 3.11Å; P500-T502 VanDerWaalsContact C-N 3.3Å; P500-T502 PolarHBondContact O-N 2.79Å; T502-R504 PolarHBondContact O-N 2.84Å; T502-R504 VanDerWaalsContact O-N 3.09Å; T502-R504 PolarHBondContact O-NE 2.86Å; T502-R504 PolarHBondContact OG1-NH2 2.75Å; T502-E522 VanDerWaalsContact O-O 3.09Å
503	E	93.1	Very high	93.3	Very high	82 Å²	82	47 Å²	47	38%	0.383	24%	0.243	S	C	.	.	S	Bend	trans	-54.5	116.9	176.7	176.5	176.4	176	0	0	111	R494 E522 M523	R494-E503 IonicContact NH1-OE1 3.63Å; E503-E522 CarbonylContact C-O 3.51Å; E503-E522 WeakPolarHBondContact CA-O 3.42Å; E503-M523 HydrophobicContact CB-CE 4.21Å; E503-M523 HydrophobicContact CB-SD 3.84Å; E503-M523 HydrophobicContact CG-CE 4.1Å; E503-M523 HydrophobicContact CG-SD 3.64Å
504	R	95.3	Very high	93	Very high	5 Å²	5	52.6 Å²	52.6	2%	0.019	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	160.6	174.5	68.6	-166.7	62.7	178.4	-31	112.4	R494 T499 T502 V521 E522	R494-R504 CarbonylContact O-C 3.53Å; R494-R504 WeakPolarHBondContact O-CA 3.32Å; R494-R504 WeakPolarHBondContact O-CB 3.49Å; T499-R504 PolarHBondContact O-NH2 2.97Å; T502-R504 PolarHBondContact O-N 2.84Å; T502-R504 VanDerWaalsContact O-N 3.09Å; T502-R504 PolarHBondContact O-NE 2.86Å; T502-R504 PolarHBondContact OG1-NH2 2.75Å; R504-V521 WeakPolarHBondContact O-CA 3.3Å; R504-E522 VanDerWaalsContact CD-OE2 3.29Å; R504-E522 WeakPolarHBondContact CD-OE2 3.37Å; R504-E522 HydrophobicContact CG-CB 3.79Å; R504-E522 IonicContact CZ-OE2 3.18Å; R504-E522 PolarHBondContact N-O 3.39Å; R504-E522 IonicContact NE-OE2 3.8Å; R504-E522 PolarHBondContact NE-OE2 3.4Å; R504-E522 IonicContact NH1-OE2 2.7Å; R504-E522 PolarHBondContact NH1-OE2 3.12Å; R504-E522 PolarHBondContact O-N 3.41Å
505	Q	97.5	Very high	92.7	Very high	47 Å²	47	50.5 Å²	50.5	22%	0.22	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	129.1	170.5	174.8	-177.7	-29	0	0	109.4	H493 R494 D507 R519 R520 V521	H493-Q505 WeakPolarHBondContact CA-O 3.21Å; R494-Q505 HydrophobicContact CB-CB 4.3Å; R494-Q505 PolarHBondContact N-O 3.18Å; R494-Q505 PolarHBondContact O-N 3.37Å; Q505-D507 PolarHBondContact NE2-OD1 3.44Å; Q505-D507 PolarHBondContact NE2-OD2 3.46Å; Q505-R519 HydrophobicContact CG-CG 4.29Å; Q505-R520 CarbonylContact C-O 3.57Å; Q505-R520 WeakPolarHBondContact CA-O 3.46Å; Q505-V521 HydrophobicContact CB-CG2 4.32Å; Q505-V521 HydrophobicContact CG-CG2 4.09Å
506	M	97.9	Very high	92.6	Very high	2 Å²	2	49.8 Å²	49.8	1%	0.01	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	120.1	171.7	-66	176.2	177.9	0	0	108.1	L490 S492 H493 F508 R519 R520 V678 I681 L682	L490-M506 HydrophobicContact CD1-CB 3.8Å; L490-M506 HydrophobicContact CD1-CG 4.06Å; S492-M506 CarbonylContact O-C 3.6Å; S492-M506 WeakPolarHBondContact O-CA 3.33Å; H493-M506 WeakPolarHBondContact NE2-CE 3.38Å; M506-F508 HydrophobicContact CB-CE2 3.73Å; M506-F508 HydrophobicContact CB-CZ 3.65Å; M506-F508 HydrophobicContact SD-CZ 4.26Å; M506-R519 CarbonylContact O-C 3.52Å; M506-R519 WeakPolarHBondContact O-CA 3.43Å; M506-R520 PolarHBondContact N-O 2.93Å; M506-R520 PolarHBondContact O-N 2.93Å; M506-V678 HydrophobicContact CE-CG1 4.16Å; M506-I681 HydrophobicContact CE-CG2 4.01Å; M506-I681 HydrophobicContact SD-CD1 4.13Å; M506-I681 HydrophobicContact SD-CG2 4.27Å; M506-L682 HydrophobicContact CE-CD2 4.11Å; M506-L682 HydrophobicContact CE-CG 4.46Å
507	D	97.8	Very high	92.8	Very high	23 Å²	23	46.1 Å²	46.1	12%	0.123	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	147.3	169.3	-55.9	-78.1	0	0	0	109.1	K491 S492 Q505 A518 R519	K491-D507 WeakPolarHBondContact CA-O 3.21Å; K491-D507 WeakPolarHBondContact CB-O 3.25Å; K491-D507 PolarHBondContact N-O 3.1Å; S492-D507 PolarHBondContact N-O 3.45Å; S492-D507 VanDerWaalsContact N-O 3.14Å; S492-D507 PolarHBondContact O-N 3.24Å; S492-D507 WeakPolarHBondContact OG-CB 3.2Å; S492-D507 PolarHBondContact OG-OD2 3.34Å; Q505-D507 PolarHBondContact NE2-OD1 3.44Å; Q505-D507 PolarHBondContact NE2-OD2 3.46Å; D507-A518 WeakPolarHBondContact CA-O 3.23Å; D507-R519 WeakPolarHBondContact OD1-CG 3.31Å; D507-R519 IonicContact OD1-CZ 3.89Å; D507-R519 IonicContact OD1-NE 2.78Å; D507-R519 PolarHBondContact OD1-NE 2.81Å; D507-R519 IonicContact OD1-NH2 3.51Å
508	F	97.6	Very high	93.1	Very high	7 Å²	7	44 Å²	44	3%	0.031	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	155.9	-174	-58.9	-85.5	0	0	0	110.9	Y488 A489 L490 M506 S510 L517 A518 R520 I681	Y488-F508 VanDerWaalsContact O-CD1 3.31Å; Y488-F508 WeakPolarHBondContact O-CD1 3.08Å; A489-F508 CarbonylContact O-C 3.5Å; A489-F508 VanDerWaalsContact O-CA 3.31Å; A489-F508 WeakPolarHBondContact O-CA 3.44Å; L490-F508 HydrophobicContact CB-CD1 4.4Å; L490-F508 HydrophobicContact CB-CE1 4.38Å; L490-F508 HydrophobicContact CD1-CD1 4.15Å; L490-F508 HydrophobicContact CD1-CE1 3.74Å; L490-F508 HydrophobicContact CD1-CZ 4.17Å; M506-F508 HydrophobicContact CB-CE2 3.73Å; M506-F508 HydrophobicContact CB-CZ 3.65Å; M506-F508 HydrophobicContact SD-CZ 4.26Å; F508-S510 VanDerWaalsContact C-N 3.35Å; F508-S510 PolarHBondContact O-N 2.73Å; F508-S510 VanDerWaalsContact O-N 3.08Å; F508-L517 WeakPolarHBondContact CB-O 3.26Å; F508-L517 HydrophobicContact CD2-CD2 3.81Å; F508-L517 HydrophobicContact CD2-CG 3.91Å; F508-L517 HydrophobicContact CE2-CD2 3.64Å; F508-L517 HydrophobicContact CE2-CG 4.18Å; F508-L517 HydrophobicContact CZ-CD2 4.24Å; F508-A518 PolarHBondContact N-O 3.47Å; F508-R520 HydrophobicContact CE2-CB 4.01Å; F508-I681 HydrophobicContact CE1-CD1 3.93Å; F508-I681 HydrophobicContact CZ-CD1 4.09Å
509	Y	96	Very high	93.6	Very high	41 Å²	41	46.2 Å²	46.2	16%	0.161	26%	0.259	C	S	.	.			trans	-76	89.4	164.9	-65.4	-74.7	0	0	0	108.8	F482 P484 A489 K491 H511 A512	F482-Y509 PolarHBondContact O-OH 3.08Å; P484-Y509 HydrophobicContact CB-CE2 4.27Å; P484-Y509 WeakPolarHBondContact CD-OH 3.35Å; P484-Y509 HydrophobicContact CG-CD1 4.48Å; P484-Y509 HydrophobicContact CG-CE1 3.87Å; P484-Y509 HydrophobicContact CG-CE2 4.06Å; A489-Y509 PolarHBondContact O-N 3.28Å; K491-Y509 HydrophobicContact CB-CD1 4.44Å; K491-Y509 HydrophobicContact CB-CD2 3.8Å; K491-Y509 HydrophobicContact CB-CE1 4.29Å; K491-Y509 HydrophobicContact CB-CE2 3.61Å; K491-Y509 HydrophobicContact CB-CG 4.22Å; K491-Y509 HydrophobicContact CD-CD1 4.08Å; K491-Y509 HydrophobicContact CD-CE1 3.79Å; K491-Y509 HydrophobicContact CG-CD1 4.41Å; K491-Y509 HydrophobicContact CG-CD2 4.43Å; K491-Y509 HydrophobicContact CG-CE1 3.89Å; K491-Y509 HydrophobicContact CG-CE2 3.9Å; Y509-H511 VanDerWaalsContact C-N 3.29Å; Y509-H511 AromaticContact CD1-CE1 3.84Å; Y509-H511 PolarHBondContact O-N 3.24Å; Y509-A512 WeakPolarHBondContact O-CB 3.48Å; Y509-A512 PolarHBondContact O-N 2.88Å
510	S	94.4	Very high	94	Very high	18 Å²	18	42.7 Å²	42.7	13%	0.126	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-49	-45.4	-175.7	51.8	0	0	0	0	113.4	F508 A512 R513 E532	F508-S510 VanDerWaalsContact C-N 3.35Å; F508-S510 PolarHBondContact O-N 2.73Å; F508-S510 VanDerWaalsContact O-N 3.08Å; S510-A512 PolarHBondContact O-N 2.88Å; S510-R513 PolarHBondContact O-N 2.64Å; S510-E532 VanDerWaalsContact CB-OE2 3.32Å; S510-E532 WeakPolarHBondContact CB-OE2 3.45Å; S510-E532 PolarHBondContact OG-OE2 3Å
511	H	91.6	Very high	94.6	Very high	153 Å²	153	42.6 Å²	42.6	71%	0.708	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-62.4	-21.2	178.2	64.4	-87.5	0	0	0	115	Y509	Y509-H511 VanDerWaalsContact C-N 3.29Å; Y509-H511 AromaticContact CD1-CE1 3.84Å; Y509-H511 PolarHBondContact O-N 3.24Å
512	A	92.2	Very high	94.9	Very high	68 Å²	68	41.2 Å²	41.2	56%	0.562	23%	0.229	S	C	*	.	G	3₁₀ helix	trans	-89.2	-5.5	177.3	0	0	0	0	0	112.4	A489 Y509 S510	A489-A512 HydrophobicContact CB-CB 3.89Å; Y509-A512 WeakPolarHBondContact O-CB 3.48Å; Y509-A512 PolarHBondContact O-N 2.88Å; S510-A512 PolarHBondContact O-N 2.88Å
513	R	91.8	Very high	95	Very high	36 Å²	36	42.7 Å²	42.7	14%	0.136	24%	0.235	C	C	.	.	S	Bend	trans	-109.8	136.1	-179.4	-60.3	-174.8	57.1	105.5	-3.3	111.4	Y488 A489 S510 D515 G516 E677	Y488-R513 PolarHBondContact O-NH1 3.19Å; A489-R513 HydrophobicContact CB-CG 3.81Å; S510-R513 PolarHBondContact O-N 2.64Å; R513-D515 WeakPolarHBondContact CB-OD1 3.29Å; R513-D515 IonicContact CZ-OD1 3.76Å; R513-D515 IonicContact CZ-OD2 3.84Å; R513-D515 IonicContact NE-OD1 2.81Å; R513-D515 PolarHBondContact NE-OD1 3.05Å; R513-D515 IonicContact NE-OD2 3.7Å; R513-D515 IonicContact NH2-OD1 3.2Å; R513-D515 IonicContact NH2-OD2 3.3Å; R513-D515 PolarHBondContact NH2-OD2 3.26Å; R513-D515 PolarHBondContact O-N 2.76Å; R513-G516 PolarHBondContact O-N 3.24Å; R513-E677 IonicContact CZ-OE1 2.9Å; R513-E677 VanDerWaalsContact CZ-OE1 3.24Å; R513-E677 IonicContact NH1-OE1 2.68Å; R513-E677 PolarHBondContact NH1-OE1 3.11Å; R513-E677 IonicContact NH2-OE1 2.81Å; R513-E677 PolarHBondContact NH2-OE1 2.96Å; R513-E677 IonicContact NH2-OE2 3.33Å
514	A	90.3	Very high	94.9	Very high	118 Å²	118	41.6 Å²	41.6	98%	0.975	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-21.4	177.5	0	0	0	0	0	113.6
515	D	91.6	Very high	94.8	Very high	48 Å²	48	47.1 Å²	47.1	26%	0.257	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-5	-179	65	-1.7	0	0	0	114.1	R513 L517 R534	R513-D515 WeakPolarHBondContact CB-OD1 3.29Å; R513-D515 IonicContact CZ-OD1 3.76Å; R513-D515 IonicContact CZ-OD2 3.84Å; R513-D515 IonicContact NE-OD1 2.81Å; R513-D515 PolarHBondContact NE-OD1 3.05Å; R513-D515 IonicContact NE-OD2 3.7Å; R513-D515 IonicContact NH2-OD1 3.2Å; R513-D515 IonicContact NH2-OD2 3.3Å; R513-D515 PolarHBondContact NH2-OD2 3.26Å; R513-D515 PolarHBondContact O-N 2.76Å; D515-L517 PolarHBondContact O-N 2.99Å; D515-L517 WeakPolarHBondContact OD1-CB 3.38Å; D515-L517 PolarHBondContact OD1-N 2.94Å; D515-R534 VanDerWaalsContact O-CD 3.28Å; D515-R534 WeakPolarHBondContact O-CD 3.38Å; D515-R534 WeakPolarHBondContact O-CG 3.34Å; D515-R534 PolarHBondContact O-NH1 2.81Å
516	G	93.6	Very high	94.7	Very high	9 Å²	9	48.8 Å²	48.8	9%	0.093	27%	0.267	C	S	.	.			trans	67.5	15	-178.1	0	0	0	0	0	114.7	R513 A518 F531 E532	R513-G516 PolarHBondContact O-N 3.24Å; G516-A518 PolarHBondContact O-N 3.26Å; G516-F531 CarbonylContact O-C 3.51Å; G516-F531 VanDerWaalsContact O-CA 3.24Å; G516-F531 WeakPolarHBondContact O-CA 3.47Å; G516-E532 PolarHBondContact O-N 2.97Å
517	L	96.6	Very high	94.6	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	121.6	-179.1	-178.4	70.1	0	0	0	110.5	F508 D515 E529 F531	F508-L517 WeakPolarHBondContact CB-O 3.26Å; F508-L517 HydrophobicContact CD2-CD2 3.81Å; F508-L517 HydrophobicContact CD2-CG 3.91Å; F508-L517 HydrophobicContact CE2-CD2 3.64Å; F508-L517 HydrophobicContact CE2-CG 4.18Å; F508-L517 HydrophobicContact CZ-CD2 4.24Å; D515-L517 PolarHBondContact O-N 2.99Å; D515-L517 WeakPolarHBondContact OD1-CB 3.38Å; D515-L517 PolarHBondContact OD1-N 2.94Å; L517-E529 HydrophobicContact CD1-CB 3.82Å; L517-E529 HydrophobicContact CD1-CG 4Å; L517-F531 HydrophobicContact CB-CD1 4.03Å; L517-F531 HydrophobicContact CB-CE1 4Å; L517-F531 HydrophobicContact CD1-CD1 3.98Å; L517-F531 HydrophobicContact CD1-CE1 3.57Å; L517-F531 HydrophobicContact CD1-CZ 3.96Å; L517-F531 HydrophobicContact CG-CE1 4.38Å
518	A	97.1	Very high	94.6	Very high	10 Å²	10	49.2 Å²	49.2	8%	0.083	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	-36.3	-179.6	0	0	0	0	0	112.2	D507 F508 G516 T530 E532	D507-A518 WeakPolarHBondContact CA-O 3.23Å; F508-A518 PolarHBondContact N-O 3.47Å; G516-A518 PolarHBondContact O-N 3.26Å; A518-T530 PolarHBondContact N-O 3.39Å; A518-E532 HydrophobicContact CB-CB 4.39Å; A518-E532 HydrophobicContact CB-CG 3.73Å
519	R	98.1	Very high	94.7	Very high	111 Å²	111	48.9 Å²	48.9	42%	0.419	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	141.4	-178.1	178.9	-179.8	-64	146.6	6.4	111.2	Q505 M506 D507 V521 E529 T530	Q505-R519 HydrophobicContact CG-CG 4.29Å; M506-R519 CarbonylContact O-C 3.52Å; M506-R519 WeakPolarHBondContact O-CA 3.43Å; D507-R519 WeakPolarHBondContact OD1-CG 3.31Å; D507-R519 IonicContact OD1-CZ 3.89Å; D507-R519 IonicContact OD1-NE 2.78Å; D507-R519 PolarHBondContact OD1-NE 2.81Å; D507-R519 IonicContact OD1-NH2 3.51Å; R519-V521 HydrophobicContact CG-CG2 4.24Å; R519-E529 CarbonylContact O-C 3.56Å; R519-E529 VanDerWaalsContact O-CA 3.29Å; R519-E529 WeakPolarHBondContact O-CA 3.12Å; R519-T530 PolarHBondContact N-O 2.75Å; R519-T530 VanDerWaalsContact N-O 3.15Å; R519-T530 PolarHBondContact O-N 3.48Å
520	R	97.8	Very high	94.8	Very high	5 Å²	5	49 Å²	49	2%	0.019	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	125.7	168.4	-175.7	175.7	-70.8	149.4	0.3	109.6	Q505 M506 F508 M527 T528 E529 S674 E677	Q505-R520 CarbonylContact C-O 3.57Å; Q505-R520 WeakPolarHBondContact CA-O 3.46Å; M506-R520 PolarHBondContact N-O 2.93Å; M506-R520 PolarHBondContact O-N 2.93Å; F508-R520 HydrophobicContact CE2-CB 4.01Å; R520-M527 HydrophobicContact CG-CG 4.13Å; R520-M527 HydrophobicContact CG-SD 4.3Å; R520-T528 CarbonylContact C-O 3.58Å; R520-T528 WeakPolarHBondContact CA-O 3.47Å; R520-E529 HydrophobicContact CB-CG 4.11Å; R520-E529 HydrophobicContact CG-CG 3.79Å; R520-E529 IonicContact CZ-OE1 3.3Å; R520-E529 IonicContact NE-OE1 3.91Å; R520-E529 PolarHBondContact NE-OE1 2.84Å; R520-E529 IonicContact NH2-OE1 2.75Å; R520-E529 PolarHBondContact NH2-OE1 2.79Å; R520-S674 PolarHBondContact NH2-OG 3.37Å; R520-E677 IonicContact CZ-OE2 2.65Å; R520-E677 IonicContact NH1-OE2 3Å; R520-E677 PolarHBondContact NH1-OE2 2.94Å; R520-E677 IonicContact NH2-OE2 2.78Å; R520-E677 PolarHBondContact NH2-OE2 3.21Å
521	V	97.4	Very high	94.9	Very high	43 Å²	43	48.6 Å²	48.6	26%	0.261	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	118	171.5	-178.7	0	0	0	0	107.1	R504 Q505 R519 M527 T528	R504-V521 WeakPolarHBondContact O-CA 3.3Å; Q505-V521 HydrophobicContact CB-CG2 4.32Å; Q505-V521 HydrophobicContact CG-CG2 4.09Å; R519-V521 HydrophobicContact CG-CG2 4.24Å; V521-M527 CarbonylContact O-C 3.56Å; V521-M527 WeakPolarHBondContact O-CA 3.32Å; V521-T528 PolarHBondContact N-O 3.48Å; V521-T528 PolarHBondContact O-N 3.3Å
522	E	94.9	Very high	95.1	Very high	5 Å²	5	46 Å²	46	2%	0.023	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	133	175.6	171.6	178	-129.9	0	0	108.9	T502 E503 R504 R565 V678	T502-E522 VanDerWaalsContact O-O 3.09Å; E503-E522 CarbonylContact C-O 3.51Å; E503-E522 WeakPolarHBondContact CA-O 3.42Å; R504-E522 VanDerWaalsContact CD-OE2 3.29Å; R504-E522 WeakPolarHBondContact CD-OE2 3.37Å; R504-E522 HydrophobicContact CG-CB 3.79Å; R504-E522 IonicContact CZ-OE2 3.18Å; R504-E522 PolarHBondContact N-O 3.39Å; R504-E522 IonicContact NE-OE2 3.8Å; R504-E522 PolarHBondContact NE-OE2 3.4Å; R504-E522 IonicContact NH1-OE2 2.7Å; R504-E522 PolarHBondContact NH1-OE2 3.12Å; R504-E522 PolarHBondContact O-N 3.41Å; E522-R565 IonicContact OE1-CZ 2.71Å; E522-R565 IonicContact OE1-NH1 2.68Å; E522-R565 IonicContact OE1-NH2 3.95Å; E522-R565 PolarHBondContact OE1-NH2 2.71Å; E522-V678 WeakPolarHBondContact OE2-CG1 3.34Å
523	M	92.9	Very high	95	Very high	65 Å²	65	50.7 Å²	50.7	32%	0.32	27%	0.274	S	S	.	.			trans	-123.3	168.4	172.1	-59.4	-61.6	-79.9	0	0	108	E503 F525 E526 R565	E503-M523 HydrophobicContact CB-CE 4.21Å; E503-M523 HydrophobicContact CB-SD 3.84Å; E503-M523 HydrophobicContact CG-CE 4.1Å; E503-M523 HydrophobicContact CG-SD 3.64Å; M523-F525 VanDerWaalsContact C-N 3.28Å; M523-F525 PolarHBondContact O-N 3.1Å; M523-E526 CarbonylContact C-O 3.5Å; M523-E526 WeakPolarHBondContact CA-O 3.48Å; M523-E526 HydrophobicContact CB-CB 4.27Å; M523-E526 PolarHBondContact N-O 3.32Å; M523-E526 PolarHBondContact O-N 3.18Å; M523-R565 PolarHBondContact O-NH1 3.49Å
524	P	91	Very high	95	Very high	60 Å²	60	51.2 Å²	51.2	39%	0.39	28%	0.276	S	S	.	.	S	Bend	trans	-54.5	-41.1	-179.6	-29.4	36.6	0	0	0	114.4	E501 R565	E501-P524 VanDerWaalsContact O-CA 3.32Å; E501-P524 WeakPolarHBondContact O-CA 3.37Å; P524-R565 PolarHBondContact O-NH1 2.86Å
525	F	92.6	Very high	95.1	Very high	120 Å²	120	51.4 Å²	51.4	53%	0.526	27%	0.267	S	S	.	.	S	Bend	trans	-114.8	2.3	-176.9	-57.9	-70.7	0	0	0	114.1	M523 F545 K547	M523-F525 VanDerWaalsContact C-N 3.28Å; M523-F525 PolarHBondContact O-N 3.1Å; F525-F545 PolarHBondContact O-N 3.46Å; F525-K547 HydrophobicContact CE1-CG 4.48Å
526	E	95.1	Very high	95.1	Very high	83 Å²	83	51.9 Å²	51.9	39%	0.388	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	151.1	-174.4	-60	-177.5	159.2	0	0	111.4	M523 H542 V543 V544	M523-E526 CarbonylContact C-O 3.5Å; M523-E526 WeakPolarHBondContact CA-O 3.48Å; M523-E526 HydrophobicContact CB-CB 4.27Å; M523-E526 PolarHBondContact N-O 3.32Å; M523-E526 PolarHBondContact O-N 3.18Å; E526-H542 IonicContact OE2-NE2 3.84Å; E526-V543 CarbonylContact C-O 3.35Å; E526-V543 WeakPolarHBondContact CA-O 3.41Å; E526-V544 HydrophobicContact CG-CG2 4.4Å
527	M	96.8	Very high	95.1	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	126.2	170.5	-179.7	178.6	71.8	0	0	109.6	R520 V521 E529 H542 V543 F545 V671	R520-M527 HydrophobicContact CG-CG 4.13Å; R520-M527 HydrophobicContact CG-SD 4.3Å; V521-M527 CarbonylContact O-C 3.56Å; V521-M527 WeakPolarHBondContact O-CA 3.32Å; M527-E529 HydrophobicContact CG-CG 4.49Å; M527-H542 CarbonylContact O-C 3.55Å; M527-H542 WeakPolarHBondContact O-CA 3.44Å; M527-V543 HydrophobicContact CB-CB 4.38Å; M527-V543 HydrophobicContact CE-CG2 4.24Å; M527-V543 PolarHBondContact N-O 3.02Å; M527-V543 PolarHBondContact O-N 3.01Å; M527-F545 HydrophobicContact CB-CE2 3.81Å; M527-F545 HydrophobicContact CB-CZ 4.32Å; M527-V671 HydrophobicContact CE-CG1 4.2Å
528	T	98.1	Very high	95.1	Very high	34 Å²	34	55.7 Å²	55.7	21%	0.209	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	132.1	177.9	-54.4	0	0	0	0	109.9	R520 V521 R541 H542	R520-T528 CarbonylContact C-O 3.58Å; R520-T528 WeakPolarHBondContact CA-O 3.47Å; V521-T528 PolarHBondContact N-O 3.48Å; V521-T528 PolarHBondContact O-N 3.3Å; T528-R541 CarbonylContact C-O 3.56Å; T528-R541 WeakPolarHBondContact CA-O 3.4Å; T528-H542 PolarHBondContact OG1-CD2 3.01Å
529	E	98.1	Very high	95	Very high	0 Å²	0	59 Å²	59	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	135.9	177.3	-69.7	161	123.4	0	0	110.2	L517 R519 R520 M527 F531 H540 R541 S674	L517-E529 HydrophobicContact CD1-CB 3.82Å; L517-E529 HydrophobicContact CD1-CG 4Å; R519-E529 CarbonylContact O-C 3.56Å; R519-E529 VanDerWaalsContact O-CA 3.29Å; R519-E529 WeakPolarHBondContact O-CA 3.12Å; R520-E529 HydrophobicContact CB-CG 4.11Å; R520-E529 HydrophobicContact CG-CG 3.79Å; R520-E529 IonicContact CZ-OE1 3.3Å; R520-E529 IonicContact NE-OE1 3.91Å; R520-E529 PolarHBondContact NE-OE1 2.84Å; R520-E529 IonicContact NH2-OE1 2.75Å; R520-E529 PolarHBondContact NH2-OE1 2.79Å; M527-E529 HydrophobicContact CG-CG 4.49Å; E529-F531 HydrophobicContact CB-CE2 3.73Å; E529-F531 HydrophobicContact CB-CZ 3.75Å; E529-H540 CarbonylContact O-C 3.58Å; E529-H540 WeakPolarHBondContact O-CA 2.95Å; E529-R541 HydrophobicContact CB-CB 4.45Å; E529-R541 PolarHBondContact N-O 3.36Å; E529-R541 PolarHBondContact O-N 3.47Å; E529-R541 IonicContact OE1-NH2 3.57Å; E529-R541 PolarHBondContact OE1-NH2 3.32Å; E529-R541 IonicContact OE2-CZ 3.11Å; E529-R541 IonicContact OE2-NE 3.28Å; E529-R541 PolarHBondContact OE2-NE 3.49Å; E529-R541 IonicContact OE2-NH2 3.51Å; E529-R541 PolarHBondContact OE2-NH2 3.5Å; E529-S674 PolarHBondContact OE1-OG 2.99Å
530	T	98.2	Very high	95	Very high	43 Å²	43	55.4 Å²	55.4	26%	0.264	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	134.1	177.3	-49.1	0	0	0	0	108.5	A518 R519 Y539	A518-T530 PolarHBondContact N-O 3.39Å; R519-T530 PolarHBondContact N-O 2.75Å; R519-T530 VanDerWaalsContact N-O 3.15Å; R519-T530 PolarHBondContact O-N 3.48Å; T530-Y539 WeakPolarHBondContact CA-O 3.48Å
531	F	97.4	Very high	95	Very high	10 Å²	10	55.7 Å²	55.7	4%	0.044	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	149.5	-176.4	-54.3	-91.2	0	0	0	110.8	G516 L517 E529 R534 M538 Y539 R541	G516-F531 CarbonylContact O-C 3.51Å; G516-F531 VanDerWaalsContact O-CA 3.24Å; G516-F531 WeakPolarHBondContact O-CA 3.47Å; L517-F531 HydrophobicContact CB-CD1 4.03Å; L517-F531 HydrophobicContact CB-CE1 4Å; L517-F531 HydrophobicContact CD1-CD1 3.98Å; L517-F531 HydrophobicContact CD1-CE1 3.57Å; L517-F531 HydrophobicContact CD1-CZ 3.96Å; L517-F531 HydrophobicContact CG-CE1 4.38Å; E529-F531 HydrophobicContact CB-CE2 3.73Å; E529-F531 HydrophobicContact CB-CZ 3.75Å; F531-R534 HydrophobicContact CB-CG 3.96Å; F531-M538 WeakPolarHBondContact CB-O 3.34Å; F531-M538 HydrophobicContact CD2-CG 4.44Å; F531-M538 HydrophobicContact CD2-SD 4.45Å; F531-M538 HydrophobicContact CE2-SD 4.21Å; F531-Y539 PolarHBondContact N-O 2.89Å; F531-R541 HydrophobicContact CE2-CB 3.94Å
532	E	94.9	Very high	95	Very high	97 Å²	97	55.6 Å²	55.6	45%	0.453	28%	0.281	S	S	.	.			trans	-122.4	142.4	177.7	-70	174.2	171.9	0	0	109.6	S510 G516 A518 R534	S510-E532 VanDerWaalsContact CB-OE2 3.32Å; S510-E532 WeakPolarHBondContact CB-OE2 3.45Å; S510-E532 PolarHBondContact OG-OE2 3Å; G516-E532 PolarHBondContact O-N 2.97Å; A518-E532 HydrophobicContact CB-CB 4.39Å; A518-E532 HydrophobicContact CB-CG 3.73Å; E532-R534 PolarHBondContact O-N 3.45Å
533	D	89.8	Confident	95.2	Very high	168 Å²	168	55.4 Å²	55.4	90%	0.898	28%	0.28	S	S	*	.	S	Bend	trans	51.2	32.1	170.4	-57.7	-34.7	0	0	0	116.5
534	R	92.9	Very high	95.3	Very high	46 Å²	46	53.6 Å²	53.6	17%	0.174	27%	0.272	C	S	.	.			trans	-72.2	142.6	176	-73.3	-171.1	59	120.4	-2.4	112.7	D515 F531 E532 D536 F537 M538	D515-R534 VanDerWaalsContact O-CD 3.28Å; D515-R534 WeakPolarHBondContact O-CD 3.38Å; D515-R534 WeakPolarHBondContact O-CG 3.34Å; D515-R534 PolarHBondContact O-NH1 2.81Å; F531-R534 HydrophobicContact CB-CG 3.96Å; E532-R534 PolarHBondContact O-N 3.45Å; R534-D536 VanDerWaalsContact C-N 3.27Å; R534-D536 VanDerWaalsContact CB-OD1 3.3Å; R534-D536 WeakPolarHBondContact CB-OD1 3.29Å; R534-D536 IonicContact CZ-OD1 2.79Å; R534-D536 IonicContact CZ-OD2 3.55Å; R534-D536 IonicContact NE-OD1 3.56Å; R534-D536 PolarHBondContact NE-OD1 2.68Å; R534-D536 IonicContact NE-OD2 2.66Å; R534-D536 IonicContact NH2-OD1 2.77Å; R534-D536 IonicContact NH2-OD2 3.64Å; R534-D536 PolarHBondContact NH2-OD2 2.74Å; R534-D536 PolarHBondContact O-N 2.95Å; R534-F537 PolarHBondContact O-N 3.46Å; R534-F537 VanDerWaalsContact O-N 3.09Å; R534-M538 WeakPolarHBondContact CD-O 3.32Å
535	P	91.4	Very high	95.5	Very high	122 Å²	122	50.9 Å²	50.9	79%	0.792	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-22.9	179.2	29.2	-36	0	0	0	113.5	F537	P535-F537 VanDerWaalsContact C-N 3.3Å
536	D	91.9	Very high	95.2	Very high	59 Å²	59	45.5 Å²	45.5	32%	0.316	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	8.5	175	63.3	-0.9	0	0	0	112.9	R534 M538 F574	R534-D536 VanDerWaalsContact C-N 3.27Å; R534-D536 VanDerWaalsContact CB-OD1 3.3Å; R534-D536 WeakPolarHBondContact CB-OD1 3.29Å; R534-D536 IonicContact CZ-OD1 2.79Å; R534-D536 IonicContact CZ-OD2 3.55Å; R534-D536 IonicContact NE-OD1 3.56Å; R534-D536 PolarHBondContact NE-OD1 2.68Å; R534-D536 IonicContact NE-OD2 2.66Å; R534-D536 IonicContact NH2-OD1 2.77Å; R534-D536 IonicContact NH2-OD2 3.64Å; R534-D536 PolarHBondContact NH2-OD2 2.74Å; R534-D536 PolarHBondContact O-N 2.95Å; D536-M538 PolarHBondContact O-N 3.19Å; D536-M538 PolarHBondContact OD1-N 2.73Å; D536-F574 WeakPolarHBondContact O-CD1 3.44Å
537	F	94.3	Very high	94.6	Very high	82 Å²	82	49.7 Å²	49.7	36%	0.36	25%	0.25	S	C	.	.			trans	61.2	6.1	179.2	-60.9	-93.5	0	0	0	115.5	R534 P535 Y539 F574 N575 D577	R534-F537 PolarHBondContact O-N 3.46Å; R534-F537 VanDerWaalsContact O-N 3.09Å; P535-F537 VanDerWaalsContact C-N 3.3Å; F537-Y539 PolarHBondContact O-N 2.93Å; F537-F574 CarbonylContact O-C 3.6Å; F537-F574 WeakPolarHBondContact O-CA 3.27Å; F537-N575 HydrophobicContact CB-CB 4.17Å; F537-N575 WeakPolarHBondContact CB-O 3.46Å; F537-N575 HydrophobicContact CD1-CB 4.27Å; F537-N575 PolarHBondContact O-N 3.29Å; F537-D577 HydrophobicContact CD2-CB 4.1Å; F537-D577 HydrophobicContact CE2-CB 3.95Å; F537-D577 HydrophobicContact CG-CB 4.5Å; F537-D577 HydrophobicContact CZ-CB 4.21Å
538	M	95.6	Very high	93.8	Very high	7 Å²	7	54.8 Å²	54.8	3%	0.034	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	127.1	175.3	-171.5	-174.4	-65.6	0	0	109.6	F531 R534 D536 E572 F574	F531-M538 WeakPolarHBondContact CB-O 3.34Å; F531-M538 HydrophobicContact CD2-CG 4.44Å; F531-M538 HydrophobicContact CD2-SD 4.45Å; F531-M538 HydrophobicContact CE2-SD 4.21Å; R534-M538 WeakPolarHBondContact CD-O 3.32Å; D536-M538 PolarHBondContact O-N 3.19Å; D536-M538 PolarHBondContact OD1-N 2.73Å; M538-E572 HydrophobicContact CE-CB 4.22Å; M538-E572 HydrophobicContact CE-CG 4.08Å; M538-E572 VanDerWaalsContact CE-OE1 3.29Å; M538-E572 WeakPolarHBondContact CE-OE1 3.31Å; M538-E572 WeakPolarHBondContact CE-OE2 3.41Å; M538-E572 HydrophobicContact SD-CG 4.43Å; M538-F574 HydrophobicContact CB-CD1 3.78Å; M538-F574 HydrophobicContact CB-CE1 3.71Å; M538-F574 HydrophobicContact CE-CE1 3.62Å; M538-F574 HydrophobicContact CE-CZ 3.66Å; M538-F574 HydrophobicContact CG-CD1 4.35Å; M538-F574 HydrophobicContact CG-CE1 4.07Å
539	Y	96.4	Very high	92.1	Very high	80 Å²	80	60.2 Å²	60.2	31%	0.314	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	-13.7	177.6	72.2	-90.3	0	0	0	113	T530 F531 F537 R573 F574 N575	T530-Y539 WeakPolarHBondContact CA-O 3.48Å; F531-Y539 PolarHBondContact N-O 2.89Å; F537-Y539 PolarHBondContact O-N 2.93Å; Y539-R573 HydrophobicContact CD1-CB 4.39Å; Y539-R573 WeakPolarHBondContact CD1-O 3.33Å; Y539-R573 HydrophobicContact CE1-CB 3.64Å; Y539-R573 HydrophobicContact CE2-CB 4.31Å; Y539-R573 PolarHBondContact N-O 3.29Å; Y539-F574 WeakPolarHBondContact CE1-O 3.05Å; Y539-N575 HydrophobicContact CD1-CB 4.49Å; Y539-N575 WeakPolarHBondContact CD1-OD1 3.35Å
540	H	97.7	Very high	90.1	Very high	34 Å²	34	68.7 Å²	68.7	16%	0.157	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.2	133.2	-174.8	174.5	-81.8	0	0	0	112.1	E529 E572 R573	E529-H540 CarbonylContact O-C 3.58Å; E529-H540 WeakPolarHBondContact O-CA 2.95Å; H540-E572 CarbonylContact O-C 3.57Å; H540-E572 WeakPolarHBondContact O-CA 3.24Å; H540-R573 HydrophobicContact CB-CB 4.24Å; H540-R573 PolarHBondContact N-O 3.38Å; H540-R573 PolarHBondContact O-N 2.91Å
541	R	97.8	Very high	87.8	Confident	11 Å²	11	72.8 Å²	72.8	4%	0.042	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	130.5	170.7	-179.5	170.2	63.7	-175.7	2.1	109.4	T528 E529 F531 V543 V570 V571 E572 R670 S674	T528-R541 CarbonylContact C-O 3.56Å; T528-R541 WeakPolarHBondContact CA-O 3.4Å; E529-R541 HydrophobicContact CB-CB 4.45Å; E529-R541 PolarHBondContact N-O 3.36Å; E529-R541 PolarHBondContact O-N 3.47Å; E529-R541 IonicContact OE1-NH2 3.57Å; E529-R541 PolarHBondContact OE1-NH2 3.32Å; E529-R541 IonicContact OE2-CZ 3.11Å; E529-R541 IonicContact OE2-NE 3.28Å; E529-R541 PolarHBondContact OE2-NE 3.49Å; E529-R541 IonicContact OE2-NH2 3.51Å; E529-R541 PolarHBondContact OE2-NH2 3.5Å; F531-R541 HydrophobicContact CE2-CB 3.94Å; R541-V543 HydrophobicContact CG-CG2 4.22Å; R541-V570 HydrophobicContact CG-CG1 4.11Å; R541-V571 CarbonylContact C-O 3.5Å; R541-V571 VanDerWaalsContact CA-O 3.3Å; R541-V571 WeakPolarHBondContact CA-O 3.37Å; R541-E572 HydrophobicContact CB-CG 4.47Å; R541-E572 HydrophobicContact CG-CG 4.13Å; R541-R670 VanDerWaalsContact NH1-CB 3.33Å; R541-S674 PolarHBondContact NH2-OG 3.48Å
542	H	98.3	Very high	85	Confident	42 Å²	42	81.8 Å²	81.8	19%	0.194	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	126.2	177.2	176.2	-77.1	0	0	0	110.1	E526 M527 T528 V570 V571	E526-H542 IonicContact OE2-NE2 3.84Å; M527-H542 CarbonylContact O-C 3.55Å; M527-H542 WeakPolarHBondContact O-CA 3.44Å; T528-H542 PolarHBondContact OG1-CD2 3.01Å; H542-V570 CarbonylContact O-C 3.51Å; H542-V570 WeakPolarHBondContact O-CA 3.47Å; H542-V571 HydrophobicContact CB-CB 4.33Å; H542-V571 PolarHBondContact N-O 2.72Å; H542-V571 PolarHBondContact O-N 3.43Å
543	V	97.4	Very high	82.6	Confident	0 Å²	0	79.5 Å²	79.5	0%	0	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	134.1	-173.9	-177.1	0	0	0	0	109	E526 M527 R541 F545 L567 K569 V570 V671	E526-V543 CarbonylContact C-O 3.35Å; E526-V543 WeakPolarHBondContact CA-O 3.41Å; M527-V543 HydrophobicContact CB-CB 4.38Å; M527-V543 HydrophobicContact CE-CG2 4.24Å; M527-V543 PolarHBondContact N-O 3.02Å; M527-V543 PolarHBondContact O-N 3.01Å; R541-V543 HydrophobicContact CG-CG2 4.22Å; V543-F545 HydrophobicContact CB-CE2 4.46Å; V543-F545 HydrophobicContact CB-CZ 4.34Å; V543-F545 HydrophobicContact CG1-CD1 4.17Å; V543-F545 HydrophobicContact CG1-CD2 4.43Å; V543-F545 HydrophobicContact CG1-CE1 3.71Å; V543-F545 HydrophobicContact CG1-CE2 4Å; V543-F545 HydrophobicContact CG1-CZ 3.62Å; V543-L567 HydrophobicContact CG1-CD1 3.37Å; V543-K569 CarbonylContact C-O 3.55Å; V543-K569 WeakPolarHBondContact CA-O 3.28Å; V543-V570 HydrophobicContact CG1-CG2 4.32Å; V543-V570 HydrophobicContact CG2-CG1 4.19Å; V543-V570 HydrophobicContact CG2-CG2 4.38Å; V543-V671 HydrophobicContact CG1-CG1 3.98Å; V543-V671 HydrophobicContact CG1-CG2 4.44Å; V543-V671 HydrophobicContact CG2-CG1 4.33Å; V543-V671 HydrophobicContact CG2-CG2 3.63Å
544	V	96.5	Very high	80.5	Confident	27 Å²	27	78.4 Å²	78.4	16%	0.164	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	128	170.4	-174.4	0	0	0	0	108.4	E526 Q568 K569	E526-V544 HydrophobicContact CG-CG2 4.4Å; V544-Q568 HydrophobicContact CG1-CB 4.45Å; V544-Q568 WeakPolarHBondContact O-CB 3.31Å; V544-Q568 PolarHBondContact O-N 2.95Å; V544-K569 HydrophobicContact CB-CB 4.09Å; V544-K569 HydrophobicContact CG2-CB 4.27Å; V544-K569 PolarHBondContact N-O 3.47Å; V544-K569 PolarHBondContact O-N 3.03Å
545	F	94.1	Very high	78	Confident	4 Å²	4	80.7 Å²	80.7	2%	0.018	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	146.6	178.8	-60.8	-72.6	0	0	0	111.2	F525 M527 V543 R565 P566 L567 V671 E675	F525-F545 PolarHBondContact O-N 3.46Å; M527-F545 HydrophobicContact CB-CE2 3.81Å; M527-F545 HydrophobicContact CB-CZ 4.32Å; V543-F545 HydrophobicContact CB-CE2 4.46Å; V543-F545 HydrophobicContact CB-CZ 4.34Å; V543-F545 HydrophobicContact CG1-CD1 4.17Å; V543-F545 HydrophobicContact CG1-CD2 4.43Å; V543-F545 HydrophobicContact CG1-CE1 3.71Å; V543-F545 HydrophobicContact CG1-CE2 4Å; V543-F545 HydrophobicContact CG1-CZ 3.62Å; F545-R565 HydrophobicContact CB-CB 3.91Å; F545-R565 HydrophobicContact CD1-CB 3.54Å; F545-R565 HydrophobicContact CE1-CB 4.22Å; F545-R565 VanDerWaalsContact CE2-CZ 3.48Å; F545-R565 HydrophobicContact CG-CB 3.82Å; F545-P566 CarbonylContact C-O 3.56Å; F545-P566 WeakPolarHBondContact CA-O 3.43Å; F545-L567 HydrophobicContact CE1-CD1 4.43Å; F545-V671 HydrophobicContact CE1-CG1 3.79Å; F545-V671 HydrophobicContact CZ-CG1 3.91Å; F545-E675 HydrophobicContact CZ-CG 4.28Å
546	G	87.6	Confident	75.6	Confident	7 Å²	7	82.8 Å²	82.8	7%	0.072	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-89.5	171.8	173.8	0	0	0	0	0	113.3	P566 Q568	G546-P566 PolarHBondContact N-O 3.02Å; G546-P566 WeakPolarHBondContact O-CD 3.22Å; G546-P566 WeakPolarHBondContact O-CG 3.44Å; G546-Q568 VanDerWaalsContact CA-CD 3.48Å; G546-Q568 VanDerWaalsContact CA-NE2 3.29Å
547	K	82.5	Confident	73.1	Confident	170 Å²	170	85.5 Å²	85.5	74%	0.739	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-69.2	136.3	174.9	-64.5	-177.2	178.9	-178.4	0	110.4	F525 I549 P566	F525-K547 HydrophobicContact CE1-CG 4.48Å; K547-I549 PolarHBondContact O-N 2.82Å; K547-P566 WeakPolarHBondContact O-CG 3.45Å
548	R	78	Confident	70.5	Confident	107 Å²	107	90.6 Å²	90.6	40%	0.404	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-63.9	130	172	-74.9	178.7	168	133.3	3.3	110	E501 G563	E501-R548 IonicContact OE1-CZ 2.86Å; E501-R548 IonicContact OE1-NH1 3.69Å; E501-R548 IonicContact OE1-NH2 2.79Å; E501-R548 PolarHBondContact OE1-NH2 3.23Å; E501-R548 IonicContact OE2-CZ 2.73Å; E501-R548 IonicContact OE2-NH1 3.54Å; E501-R548 PolarHBondContact OE2-NH1 2.9Å; E501-R548 IonicContact OE2-NH2 3.47Å; E501-R548 PolarHBondContact OE2-NH2 3Å; R548-G563 VanDerWaalsContact CZ-O 3.22Å; R548-G563 PolarHBondContact NE-O 3.04Å; R548-G563 PolarHBondContact NH2-O 2.87Å
549	I	63.9	Low	67.7	Low	149 Å²	149	95.7 Å²	95.7	76%	0.764	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-88	117.6	169.4	-56.8	172.2	0	0	0	106.7	K547 V551	K547-I549 PolarHBondContact O-N 2.82Å; I549-V551 PolarHBondContact O-N 3.19Å; I549-V551 VanDerWaalsContact O-N 3.09Å
550	K	55.5	Low	65.1	Low	177 Å²	177	97.6 Å²	97.6	77%	0.77	53%	0.526	S	S	*	.			trans	-69.8	103.4	172.4	-71.7	-175.6	179.8	-178.8	0	108.2	F552	K550-F552 HydrophobicContact CB-CD2 4.38Å; K550-F552 HydrophobicContact CB-CE2 4.24Å; K550-F552 HydrophobicContact CD-CE2 4.39Å; K550-F552 PolarHBondContact O-N 3.03Å
551	V	50.8	Low	62.5	Low	130 Å²	130	102.4 Å²	102.4	79%	0.788	55%	0.553	S	S	*	*			trans	-82.2	103.1	172.5	-176.6	0	0	0	0	107.8	I549 G553	I549-V551 PolarHBondContact O-N 3.19Å; I549-V551 VanDerWaalsContact O-N 3.09Å; V551-G553 PolarHBondContact O-N 3.26Å
552	F	38.7	Very low	60.3	Low	198 Å²	198	107.1 Å²	107.1	87%	0.868	58%	0.575	S	S	*	*			trans	-81.7	105.1	167.4	-83.2	-90	0	0	0	108.4	K550	K550-F552 HydrophobicContact CB-CD2 4.38Å; K550-F552 HydrophobicContact CB-CE2 4.24Å; K550-F552 HydrophobicContact CD-CE2 4.39Å; K550-F552 PolarHBondContact O-N 3.03Å
553	G	44.3	Very low	58.4	Low	49 Å²	49	107 Å²	107	51%	0.505	59%	0.585	S	S	.	*			trans	-119.9	148.7	175.5	0	0	0	0	0	111.8	V551 S555	V551-G553 PolarHBondContact O-N 3.26Å; G553-S555 VanDerWaalsContact C-N 3.32Å; G553-S555 PolarHBondContact O-N 2.67Å
554	P	44.5	Very low	57.1	Low	145 Å²	145	110.8 Å²	110.8	94%	0.942	60%	0.603	S	S	*	*	S	Bend	trans	-87	63.9	-174.5	36.2	-34.2	0	0	0	111.8
555	S	41.4	Very low	56.6	Low	94 Å²	94	110.4 Å²	110.4	66%	0.657	60%	0.598	S	S	*	*			trans	-142.3	103.9	168	55.8	0	0	0	0	110.1	G553 T557	G553-S555 VanDerWaalsContact C-N 3.32Å; G553-S555 PolarHBondContact O-N 2.67Å; S555-T557 VanDerWaalsContact C-N 3.29Å; S555-T557 PolarHBondContact O-N 2.86Å
556	N	40.3	Very low	56.3	Low	167 Å²	167	112.9 Å²	112.9	89%	0.893	62%	0.615	S	S	*	*			trans	-63.5	84.8	170.1	-86.2	-2.5	0	0	0	110.5
557	T	39	Very low	56.5	Low	116 Å²	116	114.3 Å²	114.3	71%	0.712	62%	0.621	S	S	*	*			trans	-135.3	88.8	157.7	-26.4	0	0	0	0	106.4	S555 V559	S555-T557 VanDerWaalsContact C-N 3.29Å; S555-T557 PolarHBondContact O-N 2.86Å; T557-V559 VanDerWaalsContact C-N 3.27Å; T557-V559 PolarHBondContact O-N 3.45Å
558	E	39.9	Very low	57.1	Low	188 Å²	188	110.1 Å²	110.1	88%	0.879	60%	0.604	S	S	*	*			trans	-66.3	87.2	175.1	-67.9	-179.9	161.2	0	0	109.2
559	V	38.1	Very low	57.9	Low	115 Å²	115	108.6 Å²	108.6	70%	0.697	60%	0.6	S	S	*	*			trans	-119.6	112.8	150.2	-172.5	0	0	0	0	104.8	T557 D561	T557-V559 VanDerWaalsContact C-N 3.27Å; T557-V559 PolarHBondContact O-N 3.45Å; V559-D561 PolarHBondContact O-N 2.9Å
560	P	41.6	Very low	59.5	Low	119 Å²	119	101.5 Å²	101.5	77%	0.773	56%	0.564	S	S	*	*			trans	-74.1	76.6	174.7	30.6	-30.3	0	0	0	107.7	Q562	P560-Q562 PolarHBondContact O-N 2.68Å
561	D	42.4	Very low	61.6	Low	136 Å²	136	93.6 Å²	93.6	73%	0.727	53%	0.53	S	S	*	.			trans	-65.7	97.8	157.1	-161.2	20.6	0	0	0	104.4	V559 G563	V559-D561 PolarHBondContact O-N 2.9Å; D561-G563 PolarHBondContact O-N 2.74Å
562	Q	51.8	Low	63.8	Low	109 Å²	109	87.5 Å²	87.5	51%	0.509	49%	0.493	S	S	.	.			trans	-54.8	95.1	175.7	-74.2	-173.4	-13.3	0	0	107.1	P560 Q564	P560-Q562 PolarHBondContact O-N 2.68Å; Q562-Q564 PolarHBondContact O-N 2.89Å
563	G	57.1	Low	66.6	Low	39 Å²	39	82.7 Å²	82.7	40%	0.402	47%	0.469	S	S	.	.	P	Polyproline II helix	trans	-49.9	128.9	-167.6	0	0	0	0	0	110.7	R548 D561 R565	R548-G563 VanDerWaalsContact CZ-O 3.22Å; R548-G563 PolarHBondContact NE-O 3.04Å; R548-G563 PolarHBondContact NH2-O 2.87Å; D561-G563 PolarHBondContact O-N 2.74Å; G563-R565 PolarHBondContact O-N 3.25Å
564	Q	71	Confident	69.1	Low	81 Å²	81	81.4 Å²	81.4	38%	0.379	45%	0.45	S	S	.	.	P	Polyproline II helix	trans	-46.4	138.2	177.2	-98.4	137.3	50.9	0	0	111	Q562 K672	Q562-Q564 PolarHBondContact O-N 2.89Å; Q564-K672 VanDerWaalsContact CD-CE 3.41Å; Q564-K672 HydrophobicContact CG-CG 4.36Å; Q564-K672 VanDerWaalsContact OE1-CD 3.29Å; Q564-K672 VanDerWaalsContact OE1-CE 3.22Å
565	R	85.8	Confident	71.6	Confident	18 Å²	18	78.6 Å²	78.6	7%	0.068	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-64	127.9	175.4	-68.5	-175.3	-70.8	-166.4	-13.5	108.4	E522 M523 P524 F545 G563 L567 E675	E522-R565 IonicContact OE1-CZ 2.71Å; E522-R565 IonicContact OE1-NH1 2.68Å; E522-R565 IonicContact OE1-NH2 3.95Å; E522-R565 PolarHBondContact OE1-NH2 2.71Å; M523-R565 PolarHBondContact O-NH1 3.49Å; P524-R565 PolarHBondContact O-NH1 2.86Å; F545-R565 HydrophobicContact CB-CB 3.91Å; F545-R565 HydrophobicContact CD1-CB 3.54Å; F545-R565 HydrophobicContact CE1-CB 4.22Å; F545-R565 VanDerWaalsContact CE2-CZ 3.48Å; F545-R565 HydrophobicContact CG-CB 3.82Å; G563-R565 PolarHBondContact O-N 3.25Å; R565-L567 PolarHBondContact O-N 3.29Å; R565-E675 IonicContact CZ-OE1 3.76Å; R565-E675 IonicContact NE-OE1 3.89Å; R565-E675 PolarHBondContact NE-OE1 2.97Å; R565-E675 IonicContact NH2-OE1 3.09Å; R565-E675 PolarHBondContact NH2-OE1 3.19Å
566	P	88.4	Confident	74.1	Confident	57 Å²	57	78.1 Å²	78.1	37%	0.37	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-64.9	134.8	-179.1	24.8	-31.7	0	0	0	109.8	F545 G546 K547	F545-P566 CarbonylContact C-O 3.56Å; F545-P566 WeakPolarHBondContact CA-O 3.43Å; G546-P566 PolarHBondContact N-O 3.02Å; G546-P566 WeakPolarHBondContact O-CD 3.22Å; G546-P566 WeakPolarHBondContact O-CG 3.44Å; K547-P566 WeakPolarHBondContact O-CG 3.45Å
567	L	91.8	Very high	76.6	Confident	37 Å²	37	71.2 Å²	71.2	19%	0.194	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	120.7	-178	-167	63.4	0	0	0	110.1	V543 F545 R565 V570 V593 A668 V671	V543-L567 HydrophobicContact CG1-CD1 3.37Å; F545-L567 HydrophobicContact CE1-CD1 4.43Å; R565-L567 PolarHBondContact O-N 3.29Å; L567-V570 HydrophobicContact CD1-CG2 3.6Å; L567-V570 HydrophobicContact CD2-CG2 3.76Å; L567-V570 HydrophobicContact CG-CG2 3.89Å; L567-V593 HydrophobicContact CD2-CG2 3.96Å; L567-V593 HydrophobicContact CG-CG2 4.06Å; L567-A668 HydrophobicContact CD2-CB 3.9Å; L567-V671 HydrophobicContact CD1-CG1 4.28Å
568	Q	93.9	Very high	79.1	Confident	82 Å²	82	76.3 Å²	76.3	38%	0.383	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	-47.5	176.8	-81.6	-172.9	-4.9	0	0	112.7	V544 G546 V593 S594	V544-Q568 HydrophobicContact CG1-CB 4.45Å; V544-Q568 WeakPolarHBondContact O-CB 3.31Å; V544-Q568 PolarHBondContact O-N 2.95Å; G546-Q568 VanDerWaalsContact CA-CD 3.48Å; G546-Q568 VanDerWaalsContact CA-NE2 3.29Å; Q568-V593 PolarHBondContact O-N 3.4Å; Q568-S594 PolarHBondContact O-N 3.09Å; Q568-S594 PolarHBondContact O-OG 3.23Å
569	K	96.3	Very high	81.7	Confident	74 Å²	74	72 Å²	72	32%	0.322	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	140.4	-175.4	179.9	-179	-179.6	-175.8	0	111.1	V543 V544 V571 I590 F591 L592	V543-K569 CarbonylContact C-O 3.55Å; V543-K569 WeakPolarHBondContact CA-O 3.28Å; V544-K569 HydrophobicContact CB-CB 4.09Å; V544-K569 HydrophobicContact CG2-CB 4.27Å; V544-K569 PolarHBondContact N-O 3.47Å; V544-K569 PolarHBondContact O-N 3.03Å; K569-V571 HydrophobicContact CD-CG2 4.37Å; K569-V571 HydrophobicContact CG-CG2 4.33Å; K569-I590 HydrophobicContact CD-CG2 4.43Å; K569-I590 HydrophobicContact CG-CG2 4.2Å; K569-F591 CarbonylContact C-O 3.55Å; K569-F591 WeakPolarHBondContact CA-O 3.38Å; K569-L592 HydrophobicContact CB-CD2 4.35Å; K569-L592 HydrophobicContact CD-CD2 3.81Å; K569-L592 HydrophobicContact CG-CD2 3.88Å
570	V	97.5	Very high	84.2	Confident	1 Å²	1	71.3 Å²	71.3	1%	0.006	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	136.4	167.6	-171.8	0	0	0	0	110.1	R541 H542 V543 L567 E572 I590 F591 V667	R541-V570 HydrophobicContact CG-CG1 4.11Å; H542-V570 CarbonylContact O-C 3.51Å; H542-V570 WeakPolarHBondContact O-CA 3.47Å; V543-V570 HydrophobicContact CG1-CG2 4.32Å; V543-V570 HydrophobicContact CG2-CG1 4.19Å; V543-V570 HydrophobicContact CG2-CG2 4.38Å; L567-V570 HydrophobicContact CD1-CG2 3.6Å; L567-V570 HydrophobicContact CD2-CG2 3.76Å; L567-V570 HydrophobicContact CG-CG2 3.89Å; V570-E572 HydrophobicContact CG1-CG 4.33Å; V570-I590 CarbonylContact O-C 3.5Å; V570-I590 VanDerWaalsContact O-CA 3.31Å; V570-I590 WeakPolarHBondContact O-CA 3.44Å; V570-F591 HydrophobicContact CB-CB 4.44Å; V570-F591 HydrophobicContact CB-CD2 4.29Å; V570-F591 PolarHBondContact N-O 2.88Å; V570-F591 PolarHBondContact O-N 3.24Å; V570-V667 HydrophobicContact CB-CG1 4.2Å; V570-V667 HydrophobicContact CG1-CG1 3.59Å; V570-V667 HydrophobicContact CG2-CG1 4.25Å
571	V	97.9	Very high	86.5	Confident	11 Å²	11	69 Å²	69	7%	0.067	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	121.7	175.9	-178.4	0	0	0	0	108.4	R541 H542 K569 R573 E588 R589 I590	R541-V571 CarbonylContact C-O 3.5Å; R541-V571 VanDerWaalsContact CA-O 3.3Å; R541-V571 WeakPolarHBondContact CA-O 3.37Å; H542-V571 HydrophobicContact CB-CB 4.33Å; H542-V571 PolarHBondContact N-O 2.72Å; H542-V571 PolarHBondContact O-N 3.43Å; K569-V571 HydrophobicContact CD-CG2 4.37Å; K569-V571 HydrophobicContact CG-CG2 4.33Å; V571-R573 HydrophobicContact CG1-CG 4.42Å; V571-E588 HydrophobicContact CG1-CG 4.04Å; V571-R589 CarbonylContact C-O 3.5Å; V571-R589 WeakPolarHBondContact CA-O 3.37Å; V571-I590 HydrophobicContact CG1-CG1 4.24Å; V571-I590 HydrophobicContact CG2-CG1 4.21Å; V571-I590 HydrophobicContact CG2-CG2 4.15Å
572	E	97.9	Very high	88.7	Confident	2 Å²	2	62.9 Å²	62.9	1%	0.009	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	135.8	173.5	-65.1	-174.1	146.3	0	0	109.9	M538 H540 R541 V570 F574 E588 R589 V667	M538-E572 HydrophobicContact CE-CB 4.22Å; M538-E572 HydrophobicContact CE-CG 4.08Å; M538-E572 VanDerWaalsContact CE-OE1 3.29Å; M538-E572 WeakPolarHBondContact CE-OE1 3.31Å; M538-E572 WeakPolarHBondContact CE-OE2 3.41Å; M538-E572 HydrophobicContact SD-CG 4.43Å; H540-E572 CarbonylContact O-C 3.57Å; H540-E572 WeakPolarHBondContact O-CA 3.24Å; R541-E572 HydrophobicContact CB-CG 4.47Å; R541-E572 HydrophobicContact CG-CG 4.13Å; V570-E572 HydrophobicContact CG1-CG 4.33Å; E572-F574 HydrophobicContact CB-CE2 3.84Å; E572-F574 HydrophobicContact CB-CZ 3.99Å; E572-E588 CarbonylContact O-C 3.54Å; E572-E588 VanDerWaalsContact O-CA 3.28Å; E572-E588 WeakPolarHBondContact O-CA 3.1Å; E572-R589 PolarHBondContact N-O 2.84Å; E572-R589 PolarHBondContact O-N 3Å; E572-V667 VanDerWaalsContact OE1-CG2 3.23Å; E572-V667 WeakPolarHBondContact OE1-CG2 3.48Å
573	R	97.8	Very high	90.4	Very high	97 Å²	97	58.7 Å²	58.7	37%	0.366	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	143.4	178.5	-62	177.3	172.2	166.2	-2	111.4	Y539 H540 V571 A587 E588	Y539-R573 HydrophobicContact CD1-CB 4.39Å; Y539-R573 WeakPolarHBondContact CD1-O 3.33Å; Y539-R573 HydrophobicContact CE1-CB 3.64Å; Y539-R573 HydrophobicContact CE2-CB 4.31Å; Y539-R573 PolarHBondContact N-O 3.29Å; H540-R573 HydrophobicContact CB-CB 4.24Å; H540-R573 PolarHBondContact N-O 3.38Å; H540-R573 PolarHBondContact O-N 2.91Å; V571-R573 HydrophobicContact CG1-CG 4.42Å; R573-A587 WeakPolarHBondContact CA-O 3.46Å; R573-E588 HydrophobicContact CG-CB 4.44Å; R573-E588 HydrophobicContact CG-CG 4.04Å; R573-E588 IonicContact CZ-OE2 2.87Å; R573-E588 IonicContact NE-OE2 3.93Å; R573-E588 PolarHBondContact NE-OE2 3.09Å; R573-E588 IonicContact NH2-OE2 3.11Å; R573-E588 PolarHBondContact NH2-OE2 3.38Å; R573-E588 VanDerWaalsContact NH2-OE2 3.08Å
574	F	97.1	Very high	91.8	Very high	21 Å²	21	63.5 Å²	63.5	9%	0.092	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	146.9	-172.4	-55	-94.8	0	0	0	111.1	D536 F537 M538 Y539 E572 V586 A587 R589 H603	D536-F574 WeakPolarHBondContact O-CD1 3.44Å; F537-F574 CarbonylContact O-C 3.6Å; F537-F574 WeakPolarHBondContact O-CA 3.27Å; M538-F574 HydrophobicContact CB-CD1 3.78Å; M538-F574 HydrophobicContact CB-CE1 3.71Å; M538-F574 HydrophobicContact CE-CE1 3.62Å; M538-F574 HydrophobicContact CE-CZ 3.66Å; M538-F574 HydrophobicContact CG-CD1 4.35Å; M538-F574 HydrophobicContact CG-CE1 4.07Å; Y539-F574 WeakPolarHBondContact CE1-O 3.05Å; E572-F574 HydrophobicContact CB-CE2 3.84Å; E572-F574 HydrophobicContact CB-CZ 3.99Å; F574-V586 WeakPolarHBondContact CB-O 3.44Å; F574-V586 HydrophobicContact CD2-CG1 4.45Å; F574-A587 PolarHBondContact N-O 2.96Å; F574-R589 HydrophobicContact CE2-CG 4.19Å; F574-H603 PolarHBondContact O-CE1 3.05Å; F574-H603 VanDerWaalsContact O-CE1 3.3Å; F574-H603 PolarHBondContact O-NE2 3.32Å
575	N	95.6	Very high	92.9	Very high	87 Å²	87	60.1 Å²	60.1	47%	0.465	29%	0.294	S	S	.	.			trans	-78.5	153.9	170.7	-74.1	-41.1	0	0	0	110	F537 Y539 D577	F537-N575 HydrophobicContact CB-CB 4.17Å; F537-N575 WeakPolarHBondContact CB-O 3.46Å; F537-N575 HydrophobicContact CD1-CB 4.27Å; F537-N575 PolarHBondContact O-N 3.29Å; Y539-N575 HydrophobicContact CD1-CB 4.49Å; Y539-N575 WeakPolarHBondContact CD1-OD1 3.35Å; N575-D577 PolarHBondContact O-N 2.78Å
576	R	94.1	Very high	93.3	Very high	84 Å²	84	60.2 Å²	60.2	32%	0.317	30%	0.297	S	S	.	.			trans	-64.4	120.3	-177.2	-178.1	70.2	179.6	97.5	11.3	111.8	R578 K580 D585 H603	R576-R578 HydrophobicContact CG-CG 4.45Å; R576-K580 VanDerWaalsContact CZ-O 3.31Å; R576-K580 PolarHBondContact NH1-O 3.49Å; R576-K580 PolarHBondContact NH2-O 2.95Å; R576-D585 WeakPolarHBondContact CD-OD2 3.15Å; R576-D585 IonicContact CZ-OD2 3.4Å; R576-D585 IonicContact NE-OD2 3.08Å; R576-D585 VanDerWaalsContact NH1-CG 3.31Å; R576-D585 IonicContact NH1-OD2 2.79Å; R576-D585 PolarHBondContact NH1-OD2 3.28Å; R576-H603 VanDerWaalsContact CD-CG 3.41Å; R576-H603 PolarHBondContact N-CE1 3.24Å
577	D	93.7	Very high	93.6	Very high	21 Å²	21	58.5 Å²	58.5	11%	0.112	29%	0.287	C	S	.	.			trans	-91.3	99.8	170.1	177.1	4.4	0	0	0	110.3	F537 N575 S579 K580 D585	F537-D577 HydrophobicContact CD2-CB 4.1Å; F537-D577 HydrophobicContact CE2-CB 3.95Å; F537-D577 HydrophobicContact CG-CB 4.5Å; F537-D577 HydrophobicContact CZ-CB 4.21Å; N575-D577 PolarHBondContact O-N 2.78Å; D577-S579 PolarHBondContact O-N 2.65Å; D577-S579 VanDerWaalsContact OD1-CB 3.25Å; D577-S579 WeakPolarHBondContact OD1-CB 3.48Å; D577-S579 PolarHBondContact OD1-N 3.34Å; D577-S579 PolarHBondContact OD1-OG 3.2Å; D577-S579 PolarHBondContact OD2-OG 2.73Å; D577-K580 PolarHBondContact O-N 2.93Å; D577-K580 VanDerWaalsContact O-N 3.14Å; D577-K580 WeakPolarHBondContact OD2-CE 3.39Å; D577-K580 IonicContact OD2-NZ 3.96Å; D577-D585 PolarHBondContact N-OD2 3.3Å
578	R	92.1	Very high	93.9	Very high	223 Å²	223	58.7 Å²	58.7	84%	0.842	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-7.5	-178.1	-66.7	-175.7	179.8	-110	-0.1	114.3	R576 K580	R576-R578 HydrophobicContact CG-CG 4.45Å; R578-K580 VanDerWaalsContact C-N 3.31Å
579	S	92.9	Very high	94	Very high	97 Å²	97	56.6 Å²	56.6	68%	0.678	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-19.6	174.2	75.1	0	0	0	0	113.5	D577	D577-S579 PolarHBondContact O-N 2.65Å; D577-S579 VanDerWaalsContact OD1-CB 3.25Å; D577-S579 WeakPolarHBondContact OD1-CB 3.48Å; D577-S579 PolarHBondContact OD1-N 3.34Å; D577-S579 PolarHBondContact OD1-OG 3.2Å; D577-S579 PolarHBondContact OD2-OG 2.73Å
580	K	91.2	Very high	94.1	Very high	101 Å²	101	53.9 Å²	53.9	44%	0.439	27%	0.265	S	S	.	.	S	Bend	trans	-110.5	153	179.8	-65	173.8	-167	156.2	0	111.7	R576 D577 R578 D585	R576-K580 VanDerWaalsContact CZ-O 3.31Å; R576-K580 PolarHBondContact NH1-O 3.49Å; R576-K580 PolarHBondContact NH2-O 2.95Å; D577-K580 PolarHBondContact O-N 2.93Å; D577-K580 VanDerWaalsContact O-N 3.14Å; D577-K580 WeakPolarHBondContact OD2-CE 3.39Å; D577-K580 IonicContact OD2-NZ 3.96Å; R578-K580 VanDerWaalsContact C-N 3.31Å; K580-D585 HydrophobicContact CB-CB 4.15Å
581	P	90.8	Very high	94.1	Very high	70 Å²	70	53.9 Å²	53.9	46%	0.455	27%	0.265	S	S	.	.			trans	-64.6	147.3	168.8	27.9	-31.8	0	0	0	110.5	G583 E584 D585	P581-G583 VanDerWaalsContact C-N 3.3Å; P581-G583 PolarHBondContact O-N 3.5Å; P581-E584 HydrophobicContact CG-CB 3.92Å; P581-E584 HydrophobicContact CG-CG 3.8Å; P581-E584 WeakPolarHBondContact CG-OE2 3.46Å; P581-E584 PolarHBondContact O-N 3.25Å; P581-D585 PolarHBondContact O-N 3.03Å; P581-D585 VanDerWaalsContact O-N 3.08Å
582	A	88.9	Confident	93.9	Very high	9 Å²	9	54.2 Å²	54.2	7%	0.074	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-35.2	-171.1	0	0	0	0	0	112.6	E584 D585 H603 E605	A582-E584 PolarHBondContact O-N 3.39Å; A582-D585 PolarHBondContact O-N 3.22Å; A582-H603 CarbonylContact C-O 3.54Å; A582-H603 HydrophobicContact CB-CB 4.09Å; A582-H603 WeakPolarHBondContact CB-O 3.5Å; A582-H603 PolarHBondContact O-N 2.88Å; A582-H603 VanDerWaalsContact O-O 3.07Å; A582-E605 HydrophobicContact CB-CG 3.82Å
583	G	86.3	Confident	93.6	Very high	21 Å²	21	55.8 Å²	55.8	22%	0.216	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-10.2	174.9	0	0	0	0	0	115.8	P581 Y602	P581-G583 VanDerWaalsContact C-N 3.3Å; P581-G583 PolarHBondContact O-N 3.5Å; G583-Y602 WeakPolarHBondContact O-CD1 3.4Å
584	E	86.9	Confident	93.1	Very high	140 Å²	140	55 Å²	55	65%	0.654	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.4	-10.4	173.8	-59.4	-178.1	173	0	0	112.8	P581 A582	P581-E584 HydrophobicContact CG-CB 3.92Å; P581-E584 HydrophobicContact CG-CG 3.8Å; P581-E584 WeakPolarHBondContact CG-OE2 3.46Å; P581-E584 PolarHBondContact O-N 3.25Å; A582-E584 PolarHBondContact O-N 3.39Å
585	D	93.3	Very high	92.8	Very high	10 Å²	10	58.7 Å²	58.7	5%	0.053	30%	0.303	C	S	.	.	S	Bend	trans	-90.5	118.8	179	-171.4	25.4	0	0	0	110.7	R576 D577 K580 P581 A582 A587 Y602 H603	R576-D585 WeakPolarHBondContact CD-OD2 3.15Å; R576-D585 IonicContact CZ-OD2 3.4Å; R576-D585 IonicContact NE-OD2 3.08Å; R576-D585 VanDerWaalsContact NH1-CG 3.31Å; R576-D585 IonicContact NH1-OD2 2.79Å; R576-D585 PolarHBondContact NH1-OD2 3.28Å; D577-D585 PolarHBondContact N-OD2 3.3Å; K580-D585 HydrophobicContact CB-CB 4.15Å; P581-D585 PolarHBondContact O-N 3.03Å; P581-D585 VanDerWaalsContact O-N 3.08Å; A582-D585 PolarHBondContact O-N 3.22Å; D585-A587 PolarHBondContact O-N 3.13Å; D585-Y602 CarbonylContact O-C 3.59Å; D585-Y602 VanDerWaalsContact O-CA 3.27Å; D585-Y602 WeakPolarHBondContact O-CA 3.45Å; D585-H603 VanDerWaalsContact CG-CD2 3.45Å; D585-H603 PolarHBondContact O-CD2 2.73Å; D585-H603 PolarHBondContact O-N 3.26Å; D585-H603 IonicContact OD2-CD2 3.01Å; D585-H603 PolarHBondContact OD2-CD2 3.05Å; D585-H603 IonicContact OD2-CG 3.71Å; D585-H603 IonicContact OD2-NE2 3.86Å
586	V	94.9	Very high	92.6	Very high	19 Å²	19	57.8 Å²	57.8	12%	0.115	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	119.7	-172	-179.5	0	0	0	0	109.9	F574 R589 V600 Y602	F574-V586 WeakPolarHBondContact CB-O 3.44Å; F574-V586 HydrophobicContact CD2-CG1 4.45Å; V586-R589 HydrophobicContact CG1-CG 3.45Å; V586-R589 VanDerWaalsContact CG1-CG 3.45Å; V586-V600 HydrophobicContact CG1-CG1 3.8Å; V586-V600 HydrophobicContact CG2-CG1 4Å; V586-Y602 HydrophobicContact CG2-CD1 4.04Å; V586-Y602 HydrophobicContact CG2-CE1 3.71Å
587	A	95.8	Very high	92.6	Very high	21 Å²	21	57.8 Å²	57.8	17%	0.174	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	-38.4	176.8	0	0	0	0	0	112.7	R573 F574 D585 T601 H603	R573-A587 WeakPolarHBondContact CA-O 3.46Å; F574-A587 PolarHBondContact N-O 2.96Å; D585-A587 PolarHBondContact O-N 3.13Å; A587-T601 PolarHBondContact N-O 3.37Å; A587-H603 WeakPolarHBondContact CA-NE2 3.4Å; A587-H603 HydrophobicContact CB-CB 4.43Å
588	E	97.3	Very high	92.7	Very high	42 Å²	42	56.8 Å²	56.8	20%	0.196	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	138.2	-177.7	-171.8	176.2	69.1	0	0	110.8	V571 E572 R573 I590 T601	V571-E588 HydrophobicContact CG1-CG 4.04Å; E572-E588 CarbonylContact O-C 3.54Å; E572-E588 VanDerWaalsContact O-CA 3.28Å; E572-E588 WeakPolarHBondContact O-CA 3.1Å; R573-E588 HydrophobicContact CG-CB 4.44Å; R573-E588 HydrophobicContact CG-CG 4.04Å; R573-E588 IonicContact CZ-OE2 2.87Å; R573-E588 IonicContact NE-OE2 3.93Å; R573-E588 PolarHBondContact NE-OE2 3.09Å; R573-E588 IonicContact NH2-OE2 3.11Å; R573-E588 PolarHBondContact NH2-OE2 3.38Å; R573-E588 VanDerWaalsContact NH2-OE2 3.08Å; E588-I590 HydrophobicContact CG-CG1 4.1Å; E588-T601 PolarHBondContact N-O 3.07Å; E588-T601 PolarHBondContact O-N 3.49Å
589	R	96.9	Very high	92.9	Very high	38 Å²	38	48.4 Å²	48.4	14%	0.143	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	132.9	169.4	-59.6	-180	-170.8	169.5	3.1	109.1	V571 E572 F574 V586 F591 Q599 V600 E663	V571-R589 CarbonylContact C-O 3.5Å; V571-R589 WeakPolarHBondContact CA-O 3.37Å; E572-R589 PolarHBondContact N-O 2.84Å; E572-R589 PolarHBondContact O-N 3Å; F574-R589 HydrophobicContact CE2-CG 4.19Å; V586-R589 HydrophobicContact CG1-CG 3.45Å; V586-R589 VanDerWaalsContact CG1-CG 3.45Å; R589-F591 HydrophobicContact CB-CE2 4.2Å; R589-F591 HydrophobicContact CB-CZ 4.4Å; R589-Q599 CarbonylContact C-O 3.23Å; R589-Q599 WeakPolarHBondContact CA-O 3.42Å; R589-V600 HydrophobicContact CG-CG1 4.46Å; R589-E663 IonicContact NH1-OE2 2.7Å; R589-E663 PolarHBondContact NH1-OE2 3.1Å
590	I	97.5	Very high	93.1	Very high	17 Å²	17	43.9 Å²	43.9	9%	0.087	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	116	178.3	-51.8	179.6	0	0	0	108.6	K569 V570 V571 E588 L592 I598 Q599	K569-I590 HydrophobicContact CD-CG2 4.43Å; K569-I590 HydrophobicContact CG-CG2 4.2Å; V570-I590 CarbonylContact O-C 3.5Å; V570-I590 VanDerWaalsContact O-CA 3.31Å; V570-I590 WeakPolarHBondContact O-CA 3.44Å; V571-I590 HydrophobicContact CG1-CG1 4.24Å; V571-I590 HydrophobicContact CG2-CG1 4.21Å; V571-I590 HydrophobicContact CG2-CG2 4.15Å; E588-I590 HydrophobicContact CG-CG1 4.1Å; I590-L592 HydrophobicContact CG2-CD2 4.3Å; I590-L592 HydrophobicContact CG2-CG 4.12Å; I590-I598 CarbonylContact O-C 3.1Å; I590-I598 WeakPolarHBondContact O-CA 3.38Å; I590-Q599 HydrophobicContact CB-CB 4.14Å; I590-Q599 PolarHBondContact N-O 3.2Å; I590-Q599 PolarHBondContact O-N 3.26Å
591	F	96.8	Very high	93.3	Very high	1 Å²	1	40.8 Å²	40.8	0%	0.004	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	107	172.4	-56.6	-79	0	0	0	108.5	K569 V570 R589 V593 I598 M660 E663 E664 V667	K569-F591 CarbonylContact C-O 3.55Å; K569-F591 WeakPolarHBondContact CA-O 3.38Å; V570-F591 HydrophobicContact CB-CB 4.44Å; V570-F591 HydrophobicContact CB-CD2 4.29Å; V570-F591 PolarHBondContact N-O 2.88Å; V570-F591 PolarHBondContact O-N 3.24Å; R589-F591 HydrophobicContact CB-CE2 4.2Å; R589-F591 HydrophobicContact CB-CZ 4.4Å; F591-V593 HydrophobicContact CB-CG2 4.34Å; F591-V593 PolarHBondContact O-N 3.47Å; F591-I598 HydrophobicContact CD1-CD1 4.26Å; F591-I598 HydrophobicContact CD1-CG1 4.11Å; F591-I598 HydrophobicContact CD1-CG2 3.9Å; F591-I598 HydrophobicContact CE1-CD1 4.41Å; F591-I598 HydrophobicContact CE1-CG2 3.92Å; F591-M660 WeakPolarHBondContact CE1-O 3.45Å; F591-E663 HydrophobicContact CZ-CB 4.13Å; F591-E664 HydrophobicContact CB-CG 4.24Å; F591-E664 HydrophobicContact CD1-CB 3.61Å; F591-E664 HydrophobicContact CD1-CG 3.85Å; F591-E664 HydrophobicContact CE1-CB 3.8Å; F591-E664 HydrophobicContact CG-CB 4.31Å; F591-E664 HydrophobicContact CG-CG 4.19Å; F591-V667 HydrophobicContact CE2-CG2 4.26Å
592	L	94.6	Very high	93.5	Very high	17 Å²	17	37.8 Å²	37.8	9%	0.089	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	76.7	172.9	-65.7	164.3	0	0	0	108	K569 I590 S594 E595 D596 R597	K569-L592 HydrophobicContact CB-CD2 4.35Å; K569-L592 HydrophobicContact CD-CD2 3.81Å; K569-L592 HydrophobicContact CG-CD2 3.88Å; I590-L592 HydrophobicContact CG2-CD2 4.3Å; I590-L592 HydrophobicContact CG2-CG 4.12Å; L592-S594 VanDerWaalsContact C-N 3.27Å; L592-S594 PolarHBondContact O-N 3.23Å; L592-E595 HydrophobicContact CB-CB 4.09Å; L592-E595 HydrophobicContact CB-CG 4.45Å; L592-E595 PolarHBondContact O-N 3.22Å; L592-D596 PolarHBondContact O-N 3.12Å; L592-D596 VanDerWaalsContact O-N 3.1Å; L592-R597 WeakPolarHBondContact CA-O 3.14Å; L592-R597 HydrophobicContact CB-CB 4.11Å; L592-R597 WeakPolarHBondContact CB-O 3.47Å; L592-R597 HydrophobicContact CD1-CB 4.16Å; L592-R597 PolarHBondContact N-O 3.44Å; L592-R597 PolarHBondContact O-N 3.43Å; L592-R597 VanDerWaalsContact O-N 3.16Å
593	V	90.9	Very high	93.8	Very high	35 Å²	35	38.8 Å²	38.8	21%	0.212	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-57.8	-41.4	-172.4	-176.4	0	0	0	0	111.3	L567 Q568 F591 E595 D596 E664	L567-V593 HydrophobicContact CD2-CG2 3.96Å; L567-V593 HydrophobicContact CG-CG2 4.06Å; Q568-V593 PolarHBondContact O-N 3.4Å; F591-V593 HydrophobicContact CB-CG2 4.34Å; F591-V593 PolarHBondContact O-N 3.47Å; V593-E595 VanDerWaalsContact C-N 3.29Å; V593-E595 PolarHBondContact O-N 3.1Å; V593-D596 PolarHBondContact O-N 3Å; V593-E664 HydrophobicContact CG2-CG 4.45Å
594	S	88.1	Confident	94.1	Very high	80 Å²	80	44.4 Å²	44.4	56%	0.559	22%	0.218	S	C	*	.	G	3₁₀ helix	trans	-70	-19.4	178.5	56.5	0	0	0	0	115.1	Q568 L592	Q568-S594 PolarHBondContact O-N 3.09Å; Q568-S594 PolarHBondContact O-OG 3.23Å; L592-S594 VanDerWaalsContact C-N 3.27Å; L592-S594 PolarHBondContact O-N 3.23Å
595	E	90.9	Very high	94.1	Very high	100 Å²	100	40.9 Å²	40.9	47%	0.467	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-104	-0.2	178.2	-63.2	-178.1	-158.7	0	0	112.8	L592 V593 R597	L592-E595 HydrophobicContact CB-CB 4.09Å; L592-E595 HydrophobicContact CB-CG 4.45Å; L592-E595 PolarHBondContact O-N 3.22Å; V593-E595 VanDerWaalsContact C-N 3.29Å; V593-E595 PolarHBondContact O-N 3.1Å; E595-R597 HydrophobicContact CB-CB 4.33Å; E595-R597 HydrophobicContact CB-CG 4.25Å; E595-R597 WeakPolarHBondContact O-CG 3.16Å; E595-R597 PolarHBondContact O-N 2.93Å; E595-R597 WeakPolarHBondContact OE2-CD 3.27Å; E595-R597 IonicContact OE2-CZ 3.8Å; E595-R597 IonicContact OE2-NH1 2.71Å; E595-R597 PolarHBondContact OE2-NH1 3.01Å
596	D	90.8	Very high	93.7	Very high	68 Å²	68	48 Å²	48	36%	0.364	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	38.6	-170.6	-73.1	-42	0	0	0	113.9	L592 V593 K618	L592-D596 PolarHBondContact O-N 3.12Å; L592-D596 VanDerWaalsContact O-N 3.1Å; V593-D596 PolarHBondContact O-N 3Å; D596-K618 HydrophobicContact CB-CB 4.15Å; D596-K618 PolarHBondContact O-N 3.16Å; D596-K618 WeakPolarHBondContact OD1-CE 3.48Å; D596-K618 IonicContact OD1-NZ 3.43Å; D596-K618 PolarHBondContact OD1-NZ 2.92Å
597	R	93.9	Very high	93.3	Very high	84 Å²	84	52.1 Å²	52.1	32%	0.317	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	145.9	-176.2	-72	171.1	72	-157.8	6.5	112.9	L592 E595 F616 I617	L592-R597 WeakPolarHBondContact CA-O 3.14Å; L592-R597 HydrophobicContact CB-CB 4.11Å; L592-R597 WeakPolarHBondContact CB-O 3.47Å; L592-R597 HydrophobicContact CD1-CB 4.16Å; L592-R597 PolarHBondContact N-O 3.44Å; L592-R597 PolarHBondContact O-N 3.43Å; L592-R597 VanDerWaalsContact O-N 3.16Å; E595-R597 HydrophobicContact CB-CB 4.33Å; E595-R597 HydrophobicContact CB-CG 4.25Å; E595-R597 WeakPolarHBondContact O-CG 3.16Å; E595-R597 PolarHBondContact O-N 2.93Å; E595-R597 WeakPolarHBondContact OE2-CD 3.27Å; E595-R597 IonicContact OE2-CZ 3.8Å; E595-R597 IonicContact OE2-NH1 2.71Å; E595-R597 PolarHBondContact OE2-NH1 3.01Å; R597-F616 WeakPolarHBondContact CA-O 3.49Å; R597-I617 HydrophobicContact CG-CG1 4.32Å
598	I	95.7	Very high	92.8	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	131.6	176.3	-51.6	178	0	0	0	108.8	I590 F591 V600 N615 F616 K618 L657 M660 M661	I590-I598 CarbonylContact O-C 3.1Å; I590-I598 WeakPolarHBondContact O-CA 3.38Å; F591-I598 HydrophobicContact CD1-CD1 4.26Å; F591-I598 HydrophobicContact CD1-CG1 4.11Å; F591-I598 HydrophobicContact CD1-CG2 3.9Å; F591-I598 HydrophobicContact CE1-CD1 4.41Å; F591-I598 HydrophobicContact CE1-CG2 3.92Å; I598-V600 HydrophobicContact CG2-CG2 4.3Å; I598-N615 CarbonylContact O-C 3.5Å; I598-N615 WeakPolarHBondContact O-CA 3.45Å; I598-F616 HydrophobicContact CB-CB 4.35Å; I598-F616 PolarHBondContact N-O 3.44Å; I598-F616 PolarHBondContact O-N 3.44Å; I598-K618 HydrophobicContact CD1-CG 4.42Å; I598-L657 HydrophobicContact CD1-CD1 4.32Å; I598-M660 HydrophobicContact CD1-CB 3.83Å; I598-M660 HydrophobicContact CG2-CB 4.17Å; I598-M660 HydrophobicContact CG2-CG 4.42Å; I598-M661 HydrophobicContact CD1-CG 4.29Å
599	Q	96.8	Very high	92.2	Very high	47 Å²	47	60.4 Å²	60.4	22%	0.22	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	135.1	176.3	-47.8	-178.9	-18.5	0	0	109.4	R589 I590 R614 N615	R589-Q599 CarbonylContact C-O 3.23Å; R589-Q599 WeakPolarHBondContact CA-O 3.42Å; I590-Q599 HydrophobicContact CB-CB 4.14Å; I590-Q599 PolarHBondContact N-O 3.2Å; I590-Q599 PolarHBondContact O-N 3.26Å; Q599-R614 CarbonylContact C-O 3.53Å; Q599-N615 VanDerWaalsContact CB-OD1 3.3Å; Q599-N615 WeakPolarHBondContact CB-OD1 3.37Å; Q599-N615 VanDerWaalsContact CG-OD1 3.3Å; Q599-N615 WeakPolarHBondContact CG-OD1 3.37Å
600	V	96.4	Very high	91.8	Very high	1 Å²	1	63.2 Å²	63.2	1%	0.006	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	119.4	-178.9	-176.6	0	0	0	0	108.3	V586 R589 I598 Y602 W613 R614 M660	V586-V600 HydrophobicContact CG1-CG1 3.8Å; V586-V600 HydrophobicContact CG2-CG1 4Å; R589-V600 HydrophobicContact CG-CG1 4.46Å; I598-V600 HydrophobicContact CG2-CG2 4.3Å; V600-Y602 HydrophobicContact CG1-CE1 4.37Å; V600-Y602 HydrophobicContact CG1-CE2 4.21Å; V600-W613 CarbonylContact O-C 3.55Å; V600-W613 WeakPolarHBondContact O-CA 3.47Å; V600-W613 WeakPolarHBondContact O-CB 3.3Å; V600-R614 PolarHBondContact N-O 2.92Å; V600-R614 PolarHBondContact O-N 2.83Å; V600-M660 HydrophobicContact CG2-CG 4.33Å; V600-M660 HydrophobicContact CG2-SD 3.75Å
601	T	96.3	Very high	91.6	Very high	36 Å²	36	64.3 Å²	64.3	22%	0.221	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	132.2	177	-53.3	0	0	0	0	108.9	A587 E588 P611	A587-T601 PolarHBondContact N-O 3.37Å; E588-T601 PolarHBondContact N-O 3.07Å; E588-T601 PolarHBondContact O-N 3.49Å; T601-P611 HydrophobicContact CG2-CB 4.1Å; T601-P611 HydrophobicContact CG2-CG 3.86Å
602	Y	94.7	Very high	91.4	Very high	8 Å²	8	65 Å²	65	3%	0.031	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	165.1	-179.3	-62.9	-84.7	0	0	0	111.6	G583 D585 V586 V600 P611 A612 R614	G583-Y602 WeakPolarHBondContact O-CD1 3.4Å; D585-Y602 CarbonylContact O-C 3.59Å; D585-Y602 VanDerWaalsContact O-CA 3.27Å; D585-Y602 WeakPolarHBondContact O-CA 3.45Å; V586-Y602 HydrophobicContact CG2-CD1 4.04Å; V586-Y602 HydrophobicContact CG2-CE1 3.71Å; V600-Y602 HydrophobicContact CG1-CE1 4.37Å; V600-Y602 HydrophobicContact CG1-CE2 4.21Å; Y602-P611 VanDerWaalsContact O-CB 3.26Å; Y602-P611 WeakPolarHBondContact O-CB 3.32Å; Y602-A612 HydrophobicContact CD2-CB 4.17Å; Y602-A612 PolarHBondContact N-O 3.06Å; Y602-R614 HydrophobicContact CE2-CG 4.02Å; Y602-R614 PolarHBondContact OH-NH1 3.46Å
603	H	94.4	Very high	91.3	Very high	30 Å²	30	68 Å²	68	14%	0.139	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-64.1	142.1	174.8	-81.3	-77.2	0	0	0	110.8	F574 R576 A582 D585 A587	F574-H603 PolarHBondContact O-CE1 3.05Å; F574-H603 VanDerWaalsContact O-CE1 3.3Å; F574-H603 PolarHBondContact O-NE2 3.32Å; R576-H603 VanDerWaalsContact CD-CG 3.41Å; R576-H603 PolarHBondContact N-CE1 3.24Å; A582-H603 CarbonylContact C-O 3.54Å; A582-H603 HydrophobicContact CB-CB 4.09Å; A582-H603 WeakPolarHBondContact CB-O 3.5Å; A582-H603 PolarHBondContact O-N 2.88Å; A582-H603 VanDerWaalsContact O-O 3.07Å; D585-H603 VanDerWaalsContact CG-CD2 3.45Å; D585-H603 PolarHBondContact O-CD2 2.73Å; D585-H603 PolarHBondContact O-N 3.26Å; D585-H603 IonicContact OD2-CD2 3.01Å; D585-H603 PolarHBondContact OD2-CD2 3.05Å; D585-H603 IonicContact OD2-CG 3.71Å; D585-H603 IonicContact OD2-NE2 3.86Å; A587-H603 WeakPolarHBondContact CA-NE2 3.4Å; A587-H603 HydrophobicContact CB-CB 4.43Å
604	R	92.8	Very high	91.5	Very high	138 Å²	138	67.9 Å²	67.9	52%	0.521	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-71.6	131.8	176.9	-167.3	-171.6	69.6	156.4	2.2	109.9	R608 I609 P611	R604-R608 VanDerWaalsContact CD-O 3.26Å; R604-R608 WeakPolarHBondContact CD-O 3.28Å; R604-R608 PolarHBondContact NE-O 2.85Å; R604-I609 WeakPolarHBondContact CD-O 3.45Å; R604-P611 HydrophobicContact CB-CB 4.34Å
605	E	87.7	Confident	91.7	Very high	67 Å²	67	65.9 Å²	65.9	31%	0.313	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-66.6	149.7	170.3	-68.3	172.2	175	0	0	111.3	A582 D607 R608	A582-E605 HydrophobicContact CB-CG 3.82Å; E605-D607 PolarHBondContact O-N 3.33Å; E605-R608 HydrophobicContact CB-CB 4.08Å; E605-R608 HydrophobicContact CB-CG 3.74Å; E605-R608 PolarHBondContact O-N 3.29Å; E605-R608 WeakPolarHBondContact OE2-CG 3.25Å; E605-R608 IonicContact OE2-NE 3.26Å
606	D	84.9	Confident	91.8	Very high	158 Å²	158	61.2 Å²	61.2	85%	0.845	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-29.1	-173.9	-71.7	-24.4	0	0	0	112.7
607	D	87.2	Confident	91.9	Very high	107 Å²	107	62 Å²	62	57%	0.572	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	10.3	-179.5	66.8	-37.5	0	0	0	113.6	E605	E605-D607 PolarHBondContact O-N 3.33Å
608	R	83.9	Confident	91.6	Very high	83 Å²	83	59.3 Å²	59.3	31%	0.313	29%	0.288	S	S	.	.			trans	-123.1	153.9	-177.2	-58.9	-61.1	-171.5	-111.1	-6.4	112.8	R604 E605 V641	R604-R608 VanDerWaalsContact CD-O 3.26Å; R604-R608 WeakPolarHBondContact CD-O 3.28Å; R604-R608 PolarHBondContact NE-O 2.85Å; E605-R608 HydrophobicContact CB-CB 4.08Å; E605-R608 HydrophobicContact CB-CG 3.74Å; E605-R608 PolarHBondContact O-N 3.29Å; E605-R608 WeakPolarHBondContact OE2-CG 3.25Å; E605-R608 IonicContact OE2-NE 3.26Å; R608-V641 HydrophobicContact CB-CG1 4.08Å; R608-V641 VanDerWaalsContact CD-CG1 3.47Å; R608-V641 HydrophobicContact CG-CG1 3.73Å
609	I	85.7	Confident	91	Very high	154 Å²	154	61 Å²	61	79%	0.79	30%	0.299	S	S	*	.	S	Bend	trans	-95.5	-30.1	-178.7	-52.7	175.7	0	0	0	111.5	R604	R604-I609 WeakPolarHBondContact CD-O 3.45Å
610	I	88.8	Confident	89.9	Confident	97 Å²	97	69.1 Å²	69.1	50%	0.497	33%	0.327	S	S	.	.	S	Bend	trans	-122.8	138.2	-174.4	-54.6	169.6	0	0	0	109	F639 V641	I610-F639 HydrophobicContact CG2-CE1 3.84Å; I610-F639 HydrophobicContact CG2-CZ 4.4Å; I610-V641 VanDerWaalsContact O-CG2 3.29Å; I610-V641 WeakPolarHBondContact O-CG2 3.48Å
611	P	92.1	Very high	88.1	Confident	40 Å²	40	76.5 Å²	76.5	26%	0.26	37%	0.367	S	S	.	.			trans	-78.4	156.8	174.9	31.6	-34.7	0	0	0	112.9	T601 Y602 R604	T601-P611 HydrophobicContact CG2-CB 4.1Å; T601-P611 HydrophobicContact CG2-CG 3.86Å; Y602-P611 VanDerWaalsContact O-CB 3.26Å; Y602-P611 WeakPolarHBondContact O-CB 3.32Å; R604-P611 HydrophobicContact CB-CB 4.34Å
612	A	91.8	Very high	85.9	Confident	15 Å²	15	78.8 Å²	78.8	12%	0.124	38%	0.384	C	S	.	.			trans	-71.2	151.1	167.6	0	0	0	0	0	110.9	Y602 F639 V641	Y602-A612 HydrophobicContact CD2-CB 4.17Å; Y602-A612 PolarHBondContact N-O 3.06Å; A612-F639 WeakPolarHBondContact CA-O 3.43Å; A612-F639 WeakPolarHBondContact CB-O 3.1Å; A612-V641 HydrophobicContact CB-CG2 4.23Å
613	W	93.8	Very high	83.9	Confident	80 Å²	80	82.6 Å²	82.6	30%	0.303	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	160	177	55.8	-98	0	0	0	112.7	V600 N615 F639	V600-W613 CarbonylContact O-C 3.55Å; V600-W613 WeakPolarHBondContact O-CA 3.47Å; V600-W613 WeakPolarHBondContact O-CB 3.3Å; W613-N615 WeakPolarHBondContact CZ3-ND2 3.38Å; W613-F639 AromaticContact CD1-CD1 3.6Å; W613-F639 HydrophobicContact CD2-CB 3.55Å; W613-F639 HydrophobicContact CD2-CG 4.43Å; W613-F639 AromaticContact CE2-CG 3.72Å; W613-F639 HydrophobicContact CE3-CB 4.07Å; W613-F639 HydrophobicContact CG-CB 4Å; W613-F639 HydrophobicContact CG-CD1 4.43Å; W613-F639 HydrophobicContact CH2-CB 3.92Å; W613-F639 HydrophobicContact CZ2-CB 3.41Å; W613-F639 VanDerWaalsContact CZ2-CB 3.41Å; W613-F639 HydrophobicContact CZ2-CD2 4.46Å; W613-F639 AromaticContact CZ2-CG 4Å; W613-F639 HydrophobicContact CZ2-CG 4Å; W613-F639 HydrophobicContact CZ3-CB 4.22Å; W613-F639 PolarHBondContact N-O 2.91Å; W613-F639 VanDerWaalsContact N-O 3.17Å; W613-F639 AromaticContact NE1-CD1 3.34Å; W613-F639 VanDerWaalsContact NE1-CD1 3.34Å; W613-F639 AromaticContact NE1-CG 3.45Å; W613-F639 PolarHBondContact O-N 3.34Å
614	R	93.8	Very high	81.4	Confident	33 Å²	33	88.1 Å²	88.1	13%	0.125	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	134.2	177.8	-62.2	-178.6	177.7	150.9	-4.7	110.3	Q599 V600 Y602 F616 S637 T638 S648	Q599-R614 CarbonylContact C-O 3.53Å; V600-R614 PolarHBondContact N-O 2.92Å; V600-R614 PolarHBondContact O-N 2.83Å; Y602-R614 HydrophobicContact CE2-CG 4.02Å; Y602-R614 PolarHBondContact OH-NH1 3.46Å; R614-F616 HydrophobicContact CB-CE2 4.09Å; R614-F616 HydrophobicContact CB-CZ 4.31Å; R614-S637 CarbonylContact C-O 3.53Å; R614-S637 WeakPolarHBondContact CA-O 3.43Å; R614-T638 HydrophobicContact CB-CG2 4.3Å; R614-T638 HydrophobicContact CG-CG2 3.74Å; R614-S648 PolarHBondContact NH2-OG 3.03Å
615	N	94.1	Very high	79.4	Confident	38 Å²	38	87.1 Å²	87.1	20%	0.203	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	138.2	177.2	-65.3	-30.7	0	0	0	109.7	I598 Q599 W613 A636 S637	I598-N615 CarbonylContact O-C 3.5Å; I598-N615 WeakPolarHBondContact O-CA 3.45Å; Q599-N615 VanDerWaalsContact CB-OD1 3.3Å; Q599-N615 WeakPolarHBondContact CB-OD1 3.37Å; Q599-N615 VanDerWaalsContact CG-OD1 3.3Å; Q599-N615 WeakPolarHBondContact CG-OD1 3.37Å; W613-N615 WeakPolarHBondContact CZ3-ND2 3.38Å; N615-A636 CarbonylContact O-C 3.59Å; N615-A636 WeakPolarHBondContact O-CA 3.31Å; N615-S637 PolarHBondContact N-O 3.42Å; N615-S637 PolarHBondContact O-N 3.38Å
616	F	93.4	Very high	77.5	Confident	1 Å²	1	92.5 Å²	92.5	0%	0.004	50%	0.496	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	148.3	177.5	-58	-82.9	0	0	0	111.6	R597 I598 R614 M635 A636 L653 M656 L657	R597-F616 WeakPolarHBondContact CA-O 3.49Å; I598-F616 HydrophobicContact CB-CB 4.35Å; I598-F616 PolarHBondContact N-O 3.44Å; I598-F616 PolarHBondContact O-N 3.44Å; R614-F616 HydrophobicContact CB-CE2 4.09Å; R614-F616 HydrophobicContact CB-CZ 4.31Å; F616-M635 CarbonylContact C-O 3.45Å; F616-M635 VanDerWaalsContact CA-O 3.23Å; F616-M635 WeakPolarHBondContact CA-O 3.49Å; F616-A636 HydrophobicContact CD1-CB 3.78Å; F616-A636 HydrophobicContact CE1-CB 3.81Å; F616-L653 HydrophobicContact CE1-CB 4.48Å; F616-L653 HydrophobicContact CE1-CD2 4.46Å; F616-M656 HydrophobicContact CE2-CG 4.18Å; F616-M656 HydrophobicContact CZ-CB 4.22Å; F616-M656 HydrophobicContact CZ-CG 3.88Å; F616-L657 HydrophobicContact CB-CD1 3.61Å; F616-L657 HydrophobicContact CD1-CB 4Å; F616-L657 HydrophobicContact CD1-CD1 4.21Å; F616-L657 HydrophobicContact CD1-CG 4.49Å; F616-L657 HydrophobicContact CE1-CB 4.26Å; F616-L657 HydrophobicContact CG-CB 4.48Å; F616-L657 HydrophobicContact CG-CD1 3.96Å
617	I	91.9	Very high	75.9	Confident	86 Å²	86	91.7 Å²	91.7	44%	0.441	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	123.5	170.6	-56.8	172.2	0	0	0	106.9	R597 M635	R597-I617 HydrophobicContact CG-CG1 4.32Å; I617-M635 PolarHBondContact N-O 3.02Å; I617-M635 WeakPolarHBondContact O-CE 3.37Å
618	K	88.1	Confident	74	Confident	26 Å²	26	90.5 Å²	90.5	11%	0.113	49%	0.489	C	S	.	.	P	Polyproline II helix	trans	-68.5	147.8	-179.3	-65.5	-175.7	-70.7	176.6	0	110.7	D596 I598 M661 E664	D596-K618 HydrophobicContact CB-CB 4.15Å; D596-K618 PolarHBondContact O-N 3.16Å; D596-K618 WeakPolarHBondContact OD1-CE 3.48Å; D596-K618 IonicContact OD1-NZ 3.43Å; D596-K618 PolarHBondContact OD1-NZ 2.92Å; I598-K618 HydrophobicContact CD1-CG 4.42Å; K618-M661 HydrophobicContact CD-CG 4.2Å; K618-M661 HydrophobicContact CG-CG 4.25Å; K618-M661 HydrophobicContact CG-SD 4.41Å; K618-E664 IonicContact NZ-OE1 3.96Å; K618-E664 PolarHBondContact NZ-OE1 3.44Å; K618-E664 IonicContact NZ-OE2 2.97Å
619	P	83.2	Confident	72.7	Confident	36 Å²	36	91.5 Å²	91.5	23%	0.234	50%	0.497	C	S	.	.	P	Polyproline II helix	trans	-61.1	138.6	170.8	-8.2	19.7	0	0	0	109.9	M635	P619-M635 HydrophobicContact CB-CE 3.91Å; P619-M635 HydrophobicContact CG-CE 3.69Å
620	R	72.5	Confident	71.7	Confident	217 Å²	217	88.4 Å²	88.4	82%	0.819	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-77.9	138	172.5	-65.8	-177.8	177	-177.2	-1.6	109.4	S622	R620-S622 VanDerWaalsContact C-N 3.33Å; R620-S622 PolarHBondContact O-N 3.03Å
621	D	58.9	Low	71.2	Confident	157 Å²	157	86 Å²	86	84%	0.84	48%	0.475	S	S	*	.			trans	-68.8	90	170.8	-75.8	-26.1	0	0	0	109.7	G623	D621-G623 PolarHBondContact O-N 3.16Å
622	S	51.3	Low	70.7	Confident	83 Å²	83	87 Å²	87	58%	0.58	48%	0.481	S	S	*	.			trans	-79	114.3	166.9	53.6	0	0	0	0	108.3	R620 D624	R620-S622 VanDerWaalsContact C-N 3.33Å; R620-S622 PolarHBondContact O-N 3.03Å; S622-D624 PolarHBondContact O-N 2.82Å
623	G	50.9	Low	70.2	Confident	88 Å²	88	90.2 Å²	90.2	91%	0.907	50%	0.501	S	S	*	.			trans	-63.5	16.8	-179	0	0	0	0	0	116.8	D621	D621-G623 PolarHBondContact O-N 3.16Å
624	D	43.5	Very low	69.6	Low	146 Å²	146	94.9 Å²	94.9	78%	0.781	53%	0.526	S	S	*	.			trans	-108.6	119.5	178	-90.1	-32.3	0	0	0	112.2	S622 Q626	S622-D624 PolarHBondContact O-N 2.82Å; D624-Q626 PolarHBondContact O-N 3.02Å
625	S	50.6	Low	69.2	Low	117 Å²	117	94.4 Å²	94.4	82%	0.818	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	106.9	-177.9	-166.5	0	0	0	0	110.9
626	Q	48.4	Very low	68.9	Low	180 Å²	180	93.3 Å²	93.3	84%	0.841	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-171.8	-14.6	139.9	-105	170.2	29.6	0	0	115.4	D624	D624-Q626 PolarHBondContact O-N 3.02Å
627	N	50.3	Low	68.8	Low	142 Å²	142	96.2 Å²	96.2	76%	0.759	54%	0.542	S	S	*	.			trans	-159.7	90.2	166.9	-90.8	-40	0	0	0	111.4	H629	N627-H629 PolarHBondContact O-N 3.21Å
628	P	48	Very low	68.6	Low	81 Å²	81	94.6 Å²	94.6	53%	0.526	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-9.4	-170.9	-20.6	31.6	0	0	0	116.4
629	H	56.3	Low	68.6	Low	104 Å²	104	96.7 Å²	96.7	48%	0.481	55%	0.546	S	S	.	.	T	Hydrogen-bonded Turn	trans	-148	61	-168.7	-54.9	-56.4	0	0	0	113.9	N627 F631	N627-H629 PolarHBondContact O-N 3.21Å; H629-F631 PolarHBondContact O-N 3.05Å
630	S	65.2	Low	68.7	Low	89 Å²	89	97.1 Å²	97.1	62%	0.622	54%	0.544	S	S	*	.			trans	-79.6	107.6	170.4	68.6	0	0	0	0	110.5	T632	S630-T632 PolarHBondContact O-N 3.03Å
631	F	78.1	Confident	69	Low	46 Å²	46	88.6 Å²	88.6	20%	0.202	52%	0.517	C	S	.	.			trans	-68.2	121	174.2	178.8	-99.2	0	0	0	110.2	H629 M635 A636 N650 L653 Y654 L657	H629-F631 PolarHBondContact O-N 3.05Å; F631-M635 HydrophobicContact CE2-CB 4.39Å; F631-A636 HydrophobicContact CE2-CB 4.47Å; F631-A636 HydrophobicContact CZ-CB 4.07Å; F631-N650 HydrophobicContact CE1-CB 4.14Å; F631-L653 HydrophobicContact CE1-CB 4.42Å; F631-L653 HydrophobicContact CZ-CB 3.81Å; F631-Y654 HydrophobicContact CB-CD2 3.54Å; F631-Y654 HydrophobicContact CB-CE2 4.13Å; F631-Y654 HydrophobicContact CB-CG 4.19Å; F631-Y654 AromaticContact CD2-CD2 3.74Å; F631-Y654 HydrophobicContact CD2-CD2 3.74Å; F631-Y654 HydrophobicContact CD2-CG 4.38Å; F631-Y654 AromaticContact CG-CD2 3.79Å; F631-Y654 HydrophobicContact CG-CD2 3.79Å; F631-Y654 HydrophobicContact CG-CG 4.25Å; F631-L657 HydrophobicContact CD2-CD2 4.16Å; F631-L657 HydrophobicContact CE2-CD2 4.16Å
632	T	81.9	Confident	70	Confident	61 Å²	61	84 Å²	84	37%	0.374	49%	0.492	S	S	.	.			trans	-104.7	143.6	172.8	64.6	0	0	0	0	110.1	S630 Q634 M635	S630-T632 PolarHBondContact O-N 3.03Å; T632-Q634 PolarHBondContact O-N 3.33Å; T632-M635 PolarHBondContact N-SD 3.08Å; T632-M635 VanDerWaalsContact N-SD 3.44Å; T632-M635 WeakPolarHBondContact O-CB 3.42Å; T632-M635 PolarHBondContact O-N 3.02Å; T632-M635 VanDerWaalsContact OG1-CG 3.31Å; T632-M635 WeakPolarHBondContact OG1-CG 3.49Å
633	P	79.9	Confident	71.2	Confident	83 Å²	83	85.7 Å²	85.7	54%	0.539	50%	0.501	S	S	.	.	G	3₁₀ helix	trans	-57.2	-22.8	-180	-25.6	34	0	0	0	114.3	M635 A636	P633-M635 PolarHBondContact O-N 3.14Å; P633-A636 PolarHBondContact O-N 2.79Å
634	Q	82.3	Confident	72.6	Confident	178 Å²	178	90.5 Å²	90.5	83%	0.832	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-71.8	-15.8	177.7	-63.7	179.7	0.1	0	0	113.3	T632 A636	T632-Q634 PolarHBondContact O-N 3.33Å; Q634-A636 VanDerWaalsContact C-N 3.26Å; Q634-A636 PolarHBondContact O-N 2.9Å
635	M	84.9	Confident	74.3	Confident	23 Å²	23	88.6 Å²	88.6	11%	0.113	48%	0.484	C	S	.	.	G	3₁₀ helix	trans	-77.6	-10.9	179	-64.9	170.2	76.2	0	0	112.9	F616 I617 P619 F631 T632 P633	F616-M635 CarbonylContact C-O 3.45Å; F616-M635 VanDerWaalsContact CA-O 3.23Å; F616-M635 WeakPolarHBondContact CA-O 3.49Å; I617-M635 PolarHBondContact N-O 3.02Å; I617-M635 WeakPolarHBondContact O-CE 3.37Å; P619-M635 HydrophobicContact CB-CE 3.91Å; P619-M635 HydrophobicContact CG-CE 3.69Å; F631-M635 HydrophobicContact CE2-CB 4.39Å; T632-M635 PolarHBondContact N-SD 3.08Å; T632-M635 VanDerWaalsContact N-SD 3.44Å; T632-M635 WeakPolarHBondContact O-CB 3.42Å; T632-M635 PolarHBondContact O-N 3.02Å; T632-M635 VanDerWaalsContact OG1-CG 3.31Å; T632-M635 WeakPolarHBondContact OG1-CG 3.49Å; P633-M635 PolarHBondContact O-N 3.14Å
636	A	88	Confident	75.7	Confident	15 Å²	15	91.8 Å²	91.8	12%	0.124	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	127.7	177.4	0	0	0	0	0	110.5	N615 F616 F631 P633 Q634 L653	N615-A636 CarbonylContact O-C 3.59Å; N615-A636 WeakPolarHBondContact O-CA 3.31Å; F616-A636 HydrophobicContact CD1-CB 3.78Å; F616-A636 HydrophobicContact CE1-CB 3.81Å; F631-A636 HydrophobicContact CE2-CB 4.47Å; F631-A636 HydrophobicContact CZ-CB 4.07Å; P633-A636 PolarHBondContact O-N 2.79Å; Q634-A636 VanDerWaalsContact C-N 3.26Å; Q634-A636 PolarHBondContact O-N 2.9Å; A636-L653 HydrophobicContact CB-CB 4.39Å; A636-L653 HydrophobicContact CB-CD1 4.09Å
637	S	90.1	Very high	77.2	Confident	63 Å²	63	88.2 Å²	88.2	44%	0.441	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	121.9	173.3	177.8	0	0	0	0	108.7	R614 N615	R614-S637 CarbonylContact C-O 3.53Å; R614-S637 WeakPolarHBondContact CA-O 3.43Å; N615-S637 PolarHBondContact N-O 3.42Å; N615-S637 PolarHBondContact O-N 3.38Å
638	T	88.8	Confident	78.8	Confident	51 Å²	51	82.7 Å²	82.7	31%	0.313	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	137.7	-173.6	60.6	0	0	0	0	111.2	R614 L653	R614-T638 HydrophobicContact CB-CG2 4.3Å; R614-T638 HydrophobicContact CG-CG2 3.74Å; T638-L653 HydrophobicContact CG2-CD1 4.46Å; T638-L653 HydrophobicContact CG2-CD2 3.84Å
639	F	88.7	Confident	80.6	Confident	71 Å²	71	87 Å²	87	31%	0.311	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	119.3	170.4	176.5	-103	0	0	0	109.8	I610 A612 W613 V641	I610-F639 HydrophobicContact CG2-CE1 3.84Å; I610-F639 HydrophobicContact CG2-CZ 4.4Å; A612-F639 WeakPolarHBondContact CA-O 3.43Å; A612-F639 WeakPolarHBondContact CB-O 3.1Å; W613-F639 AromaticContact CD1-CD1 3.6Å; W613-F639 HydrophobicContact CD2-CB 3.55Å; W613-F639 HydrophobicContact CD2-CG 4.43Å; W613-F639 AromaticContact CE2-CG 3.72Å; W613-F639 HydrophobicContact CE3-CB 4.07Å; W613-F639 HydrophobicContact CG-CB 4Å; W613-F639 HydrophobicContact CG-CD1 4.43Å; W613-F639 HydrophobicContact CH2-CB 3.92Å; W613-F639 HydrophobicContact CZ2-CB 3.41Å; W613-F639 VanDerWaalsContact CZ2-CB 3.41Å; W613-F639 HydrophobicContact CZ2-CD2 4.46Å; W613-F639 AromaticContact CZ2-CG 4Å; W613-F639 HydrophobicContact CZ2-CG 4Å; W613-F639 HydrophobicContact CZ3-CB 4.22Å; W613-F639 PolarHBondContact N-O 2.91Å; W613-F639 VanDerWaalsContact N-O 3.17Å; W613-F639 AromaticContact NE1-CD1 3.34Å; W613-F639 VanDerWaalsContact NE1-CD1 3.34Å; W613-F639 AromaticContact NE1-CG 3.45Å; W613-F639 PolarHBondContact O-N 3.34Å; F639-V641 HydrophobicContact CE1-CG2 4.26Å
640	Q	83.4	Confident	82	Confident	44 Å²	44	86.1 Å²	86.1	21%	0.206	46%	0.457	C	S	.	.			trans	-106.3	141.4	172.8	-73.3	171.9	-52.9	0	0	108.8	E645 K646	Q640-E645 PolarHBondContact NE2-OE2 2.61Å; Q640-K646 PolarHBondContact NE2-O 3.09Å
641	V	80.8	Confident	83	Confident	39 Å²	39	87.3 Å²	87.3	24%	0.236	46%	0.456	C	S	.	.	S	Bend	trans	-78.6	-36.8	-175.9	-174.7	0	0	0	0	111	R608 I610 A612 F639 P643	R608-V641 HydrophobicContact CB-CG1 4.08Å; R608-V641 VanDerWaalsContact CD-CG1 3.47Å; R608-V641 HydrophobicContact CG-CG1 3.73Å; I610-V641 VanDerWaalsContact O-CG2 3.29Å; I610-V641 WeakPolarHBondContact O-CG2 3.48Å; A612-V641 HydrophobicContact CB-CG2 4.23Å; F639-V641 HydrophobicContact CE1-CG2 4.26Å; V641-P643 WeakPolarHBondContact O-CD 3.33Å
642	D	79	Confident	83.5	Confident	61 Å²	61	89.3 Å²	89.3	33%	0.326	47%	0.465	S	S	.	.			trans	-85.1	114.4	174.5	-174.9	-3.6	0	0	0	110.4	F644 E645	D642-F644 PolarHBondContact O-N 2.77Å; D642-F644 WeakPolarHBondContact OD1-CB 3.46Å; D642-F644 WeakPolarHBondContact OD1-CD2 3.35Å; D642-F644 PolarHBondContact OD1-N 3.01Å; D642-E645 HydrophobicContact CB-CB 4.18Å; D642-E645 PolarHBondContact O-N 2.76Å
643	P	77.4	Confident	83.8	Confident	118 Å²	118	87 Å²	87	77%	0.766	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-16.3	178	-19.7	33.5	0	0	0	114.2	V641	V641-P643 WeakPolarHBondContact O-CD 3.33Å
644	F	79.4	Confident	84.2	Confident	188 Å²	188	87 Å²	87	83%	0.825	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-6.8	-179.4	-58.4	-72.9	0	0	0	113.3	D642	D642-F644 PolarHBondContact O-N 2.77Å; D642-F644 WeakPolarHBondContact OD1-CB 3.46Å; D642-F644 WeakPolarHBondContact OD1-CD2 3.35Å; D642-F644 PolarHBondContact OD1-N 3.01Å
645	E	79.3	Confident	84.5	Confident	107 Å²	107	83.7 Å²	83.7	50%	0.5	42%	0.424	S	S	.	.	S	Bend	trans	-69.5	139.3	175.9	-161.6	178.4	-169.7	0	0	110.5	Q640 D642	Q640-E645 PolarHBondContact NE2-OE2 2.61Å; D642-E645 HydrophobicContact CB-CB 4.18Å; D642-E645 PolarHBondContact O-N 2.76Å
646	K	79.9	Confident	84.8	Confident	184 Å²	184	84.5 Å²	84.5	80%	0.8	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-69.9	138.5	-179.6	-70	180	-177.8	174.5	0	109.8	Q640	Q640-K646 PolarHBondContact NE2-O 3.09Å
647	P	79.2	Confident	84.9	Confident	105 Å²	105	83.9 Å²	83.9	68%	0.682	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-63	142.9	175.9	26.1	-33.6	0	0	0	110.4
648	S	83.4	Confident	85	Confident	26 Å²	26	83 Å²	83	18%	0.182	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-57.4	138.7	177.7	-59.9	0	0	0	0	111.6	R614	R614-S648 PolarHBondContact NH2-OG 3.03Å
649	K	86.8	Confident	85.2	Confident	171 Å²	171	84.6 Å²	84.6	74%	0.743	42%	0.418	S	S	*	.	P	Polyproline II helix	trans	-64	143.7	174.8	-64.6	-179.9	-178.2	176.1	0	110.5	L651 F652 L653	K649-L651 PolarHBondContact O-N 3.43Å; K649-F652 WeakPolarHBondContact O-CB 2.97Å; K649-F652 PolarHBondContact O-N 2.97Å; K649-L653 PolarHBondContact O-N 3.48Å; K649-L653 VanDerWaalsContact O-N 3.14Å
650	N	85	Confident	85.4	Confident	86 Å²	86	81.4 Å²	81.4	46%	0.46	40%	0.404	S	S	.	.	H	α-helix	trans	-56	-36.6	178.4	-71.6	-15.7	0	0	0	113.4	F631 F652 L653 Y654	F631-N650 HydrophobicContact CE1-CB 4.14Å; N650-F652 VanDerWaalsContact C-N 3.34Å; N650-F652 PolarHBondContact O-N 3.03Å; N650-L653 PolarHBondContact O-N 2.86Å; N650-Y654 WeakPolarHBondContact O-CB 3.01Å; N650-Y654 PolarHBondContact O-N 3.24Å
651	L	87	Confident	85.8	Confident	114 Å²	114	81.9 Å²	81.9	60%	0.597	41%	0.407	S	S	*	.	H	α-helix	trans	-58.8	-45.5	175.6	-179.1	64	0	0	0	111.8	K649 Y654 E655	K649-L651 PolarHBondContact O-N 3.43Å; L651-Y654 PolarHBondContact O-N 2.96Å; L651-E655 WeakPolarHBondContact O-CG 3.49Å; L651-E655 PolarHBondContact O-N 3.49Å
652	F	88	Confident	86.5	Confident	88 Å²	88	85.5 Å²	85.5	39%	0.386	42%	0.42	S	S	.	.	H	α-helix	trans	-66.4	-39.3	179.3	175.3	-95.6	0	0	0	111.9	K649 N650 Y654 E655 M656	K649-F652 WeakPolarHBondContact O-CB 2.97Å; K649-F652 PolarHBondContact O-N 2.97Å; N650-F652 VanDerWaalsContact C-N 3.34Å; N650-F652 PolarHBondContact O-N 3.03Å; F652-Y654 VanDerWaalsContact C-N 3.33Å; F652-E655 PolarHBondContact O-N 3.47Å; F652-M656 HydrophobicContact CE1-CE 4.26Å; F652-M656 HydrophobicContact CE2-CE 4.49Å; F652-M656 HydrophobicContact CZ-CE 3.81Å; F652-M656 WeakPolarHBondContact O-CB 3.33Å; F652-M656 PolarHBondContact O-N 2.9Å
653	L	88.6	Confident	87.2	Confident	11 Å²	11	84 Å²	84	6%	0.058	41%	0.411	C	S	.	.	H	α-helix	trans	-64.9	-38.4	175.4	-66	176.5	0	0	0	111.9	F616 F631 A636 T638 K649 N650 L657	F616-L653 HydrophobicContact CE1-CB 4.48Å; F616-L653 HydrophobicContact CE1-CD2 4.46Å; F631-L653 HydrophobicContact CE1-CB 4.42Å; F631-L653 HydrophobicContact CZ-CB 3.81Å; A636-L653 HydrophobicContact CB-CB 4.39Å; A636-L653 HydrophobicContact CB-CD1 4.09Å; T638-L653 HydrophobicContact CG2-CD1 4.46Å; T638-L653 HydrophobicContact CG2-CD2 3.84Å; K649-L653 PolarHBondContact O-N 3.48Å; K649-L653 VanDerWaalsContact O-N 3.14Å; N650-L653 PolarHBondContact O-N 2.86Å; L653-L657 WeakPolarHBondContact O-CB 3.38Å; L653-L657 PolarHBondContact O-N 3.29Å
654	Y	88	Confident	88	Confident	84 Å²	84	79.4 Å²	79.4	33%	0.329	38%	0.379	S	S	.	.	H	α-helix	trans	-66.2	-47.4	174.1	176.2	-109.5	0	0	0	112.2	F631 N650 L651 F652 M656 L657 V658	F631-Y654 HydrophobicContact CB-CD2 3.54Å; F631-Y654 HydrophobicContact CB-CE2 4.13Å; F631-Y654 HydrophobicContact CB-CG 4.19Å; F631-Y654 AromaticContact CD2-CD2 3.74Å; F631-Y654 HydrophobicContact CD2-CD2 3.74Å; F631-Y654 HydrophobicContact CD2-CG 4.38Å; F631-Y654 AromaticContact CG-CD2 3.79Å; F631-Y654 HydrophobicContact CG-CD2 3.79Å; F631-Y654 HydrophobicContact CG-CG 4.25Å; N650-Y654 WeakPolarHBondContact O-CB 3.01Å; N650-Y654 PolarHBondContact O-N 3.24Å; L651-Y654 PolarHBondContact O-N 2.96Å; F652-Y654 VanDerWaalsContact C-N 3.33Å; Y654-M656 VanDerWaalsContact C-N 3.28Å; Y654-M656 PolarHBondContact O-N 3.24Å; Y654-L657 PolarHBondContact O-N 3.3Å; Y654-L657 VanDerWaalsContact O-N 3.16Å; Y654-V658 HydrophobicContact CD1-CG2 4.46Å; Y654-V658 HydrophobicContact CD2-CG2 4.27Å; Y654-V658 HydrophobicContact CE1-CG2 4.03Å; Y654-V658 HydrophobicContact CE2-CG2 3.85Å; Y654-V658 WeakPolarHBondContact O-CG2 3.43Å; Y654-V658 PolarHBondContact O-N 3.39Å
655	E	89.9	Confident	88.7	Confident	109 Å²	109	76.6 Å²	76.6	51%	0.509	37%	0.368	S	S	.	.	H	α-helix	trans	-58.2	-41.4	175.8	-73.9	172	173.7	0	0	111.6	L651 F652 V658 H659	L651-E655 WeakPolarHBondContact O-CG 3.49Å; L651-E655 PolarHBondContact O-N 3.49Å; F652-E655 PolarHBondContact O-N 3.47Å; E655-V658 PolarHBondContact O-N 2.65Å; E655-H659 WeakPolarHBondContact O-CB 3.34Å; E655-H659 PolarHBondContact O-N 3.37Å
656	M	90.6	Very high	89.4	Confident	40 Å²	40	78 Å²	78	20%	0.197	37%	0.369	C	S	.	.	H	α-helix	trans	-64.4	-43.7	174.8	-174	66.1	69.6	0	0	111.9	F616 F652 Y654 H659 M660	F616-M656 HydrophobicContact CE2-CG 4.18Å; F616-M656 HydrophobicContact CZ-CB 4.22Å; F616-M656 HydrophobicContact CZ-CG 3.88Å; F652-M656 HydrophobicContact CE1-CE 4.26Å; F652-M656 HydrophobicContact CE2-CE 4.49Å; F652-M656 HydrophobicContact CZ-CE 3.81Å; F652-M656 WeakPolarHBondContact O-CB 3.33Å; F652-M656 PolarHBondContact O-N 2.9Å; Y654-M656 VanDerWaalsContact C-N 3.28Å; Y654-M656 PolarHBondContact O-N 3.24Å; M656-H659 WeakPolarHBondContact O-CB 3.44Å; M656-H659 PolarHBondContact O-N 3.16Å; M656-M660 HydrophobicContact CG-CG 4.41Å; M656-M660 WeakPolarHBondContact O-CB 3.44Å; M656-M660 VanDerWaalsContact O-CG 3.27Å; M656-M660 WeakPolarHBondContact O-CG 3.31Å; M656-M660 PolarHBondContact O-N 2.84Å; M656-M660 HydrophobicContact SD-CE 4.16Å
657	L	90.7	Very high	90.1	Very high	2 Å²	2	69.3 Å²	69.3	1%	0.01	33%	0.332	C	S	.	.	H	α-helix	trans	-60.1	-48.7	176.3	175.3	55	0	0	0	111.2	I598 F616 F631 L653 Y654 H659 M660 M661	I598-L657 HydrophobicContact CD1-CD1 4.32Å; F616-L657 HydrophobicContact CB-CD1 3.61Å; F616-L657 HydrophobicContact CD1-CB 4Å; F616-L657 HydrophobicContact CD1-CD1 4.21Å; F616-L657 HydrophobicContact CD1-CG 4.49Å; F616-L657 HydrophobicContact CE1-CB 4.26Å; F616-L657 HydrophobicContact CG-CB 4.48Å; F616-L657 HydrophobicContact CG-CD1 3.96Å; F631-L657 HydrophobicContact CD2-CD2 4.16Å; F631-L657 HydrophobicContact CE2-CD2 4.16Å; L653-L657 WeakPolarHBondContact O-CB 3.38Å; L653-L657 PolarHBondContact O-N 3.29Å; Y654-L657 PolarHBondContact O-N 3.3Å; Y654-L657 VanDerWaalsContact O-N 3.16Å; L657-H659 VanDerWaalsContact C-N 3.28Å; L657-H659 PolarHBondContact O-N 3.46Å; L657-M660 PolarHBondContact O-N 3.32Å; L657-M660 VanDerWaalsContact O-N 3.14Å; L657-M661 HydrophobicContact CD1-CG 4.14Å; L657-M661 HydrophobicContact CD1-SD 4.25Å; L657-M661 HydrophobicContact CG-SD 4.2Å; L657-M661 WeakPolarHBondContact O-CG 3.36Å; L657-M661 PolarHBondContact O-N 3.22Å
658	V	90.6	Very high	90.8	Very high	45 Å²	45	66.2 Å²	66.2	27%	0.273	32%	0.315	S	S	.	.	H	α-helix	trans	-59.9	-40.7	176.7	173.3	0	0	0	0	111	Y654 E655 M661 K662	Y654-V658 HydrophobicContact CD1-CG2 4.46Å; Y654-V658 HydrophobicContact CD2-CG2 4.27Å; Y654-V658 HydrophobicContact CE1-CG2 4.03Å; Y654-V658 HydrophobicContact CE2-CG2 3.85Å; Y654-V658 WeakPolarHBondContact O-CG2 3.43Å; Y654-V658 PolarHBondContact O-N 3.39Å; E655-V658 PolarHBondContact O-N 2.65Å; V658-M661 PolarHBondContact O-N 3.01Å; V658-K662 WeakPolarHBondContact O-CG 3.44Å; V658-K662 PolarHBondContact O-N 3.45Å; V658-K662 VanDerWaalsContact O-N 3.15Å
659	H	93	Very high	91.3	Very high	84 Å²	84	70 Å²	70	39%	0.389	33%	0.333	S	S	.	.	H	α-helix	trans	-62.9	-45.7	174.3	179.8	-81.5	0	0	0	111.6	E655 M656 L657 M661 K662 E663	E655-H659 WeakPolarHBondContact O-CB 3.34Å; E655-H659 PolarHBondContact O-N 3.37Å; M656-H659 WeakPolarHBondContact O-CB 3.44Å; M656-H659 PolarHBondContact O-N 3.16Å; L657-H659 VanDerWaalsContact C-N 3.28Å; L657-H659 PolarHBondContact O-N 3.46Å; H659-M661 PolarHBondContact O-N 3.02Å; H659-K662 WeakPolarHBondContact O-CB 3.3Å; H659-K662 PolarHBondContact O-N 3.24Å; H659-E663 WeakPolarHBondContact O-CG 3.42Å; H659-E663 PolarHBondContact O-N 3.21Å
660	M	93.9	Very high	91.6	Very high	4 Å²	4	66.3 Å²	66.3	2%	0.02	31%	0.314	C	S	.	.	H	α-helix	trans	-65.4	-35.9	178.2	-68.9	-66.5	102.2	0	0	112.8	F591 I598 V600 M656 L657 K662 E663 E664	F591-M660 WeakPolarHBondContact CE1-O 3.45Å; I598-M660 HydrophobicContact CD1-CB 3.83Å; I598-M660 HydrophobicContact CG2-CB 4.17Å; I598-M660 HydrophobicContact CG2-CG 4.42Å; V600-M660 HydrophobicContact CG2-CG 4.33Å; V600-M660 HydrophobicContact CG2-SD 3.75Å; M656-M660 HydrophobicContact CG-CG 4.41Å; M656-M660 WeakPolarHBondContact O-CB 3.44Å; M656-M660 VanDerWaalsContact O-CG 3.27Å; M656-M660 WeakPolarHBondContact O-CG 3.31Å; M656-M660 PolarHBondContact O-N 2.84Å; M656-M660 HydrophobicContact SD-CE 4.16Å; L657-M660 PolarHBondContact O-N 3.32Å; L657-M660 VanDerWaalsContact O-N 3.14Å; M660-K662 VanDerWaalsContact C-N 3.35Å; M660-E663 HydrophobicContact CE-CG 4.32Å; M660-E663 PolarHBondContact O-N 3.08Å; M660-E664 PolarHBondContact O-N 3.45Å
661	M	92.4	Very high	92.1	Very high	54 Å²	54	62.4 Å²	62.4	27%	0.266	29%	0.293	S	S	.	.	H	α-helix	trans	-63.4	-40.5	173.4	-71.8	175.2	64.1	0	0	111.6	I598 K618 L657 V658 H659 E663 E664 E665	I598-M661 HydrophobicContact CD1-CG 4.29Å; K618-M661 HydrophobicContact CD-CG 4.2Å; K618-M661 HydrophobicContact CG-CG 4.25Å; K618-M661 HydrophobicContact CG-SD 4.41Å; L657-M661 HydrophobicContact CD1-CG 4.14Å; L657-M661 HydrophobicContact CD1-SD 4.25Å; L657-M661 HydrophobicContact CG-SD 4.2Å; L657-M661 WeakPolarHBondContact O-CG 3.36Å; L657-M661 PolarHBondContact O-N 3.22Å; V658-M661 PolarHBondContact O-N 3.01Å; H659-M661 PolarHBondContact O-N 3.02Å; M661-E663 VanDerWaalsContact C-N 3.33Å; M661-E663 PolarHBondContact O-N 3.48Å; M661-E664 WeakPolarHBondContact O-CB 3.25Å; M661-E664 PolarHBondContact O-N 3.07Å; M661-E665 PolarHBondContact O-N 3.28Å; M661-E665 VanDerWaalsContact O-N 3.09Å
662	K	94.6	Very high	92.4	Very high	115 Å²	115	60.3 Å²	60.3	50%	0.5	28%	0.279	S	S	.	.	H	α-helix	trans	-64.6	-37.5	172.9	-70.3	174.7	-179.1	179.4	0	112.3	V658 H659 M660 R666	V658-K662 WeakPolarHBondContact O-CG 3.44Å; V658-K662 PolarHBondContact O-N 3.45Å; V658-K662 VanDerWaalsContact O-N 3.15Å; H659-K662 WeakPolarHBondContact O-CB 3.3Å; H659-K662 PolarHBondContact O-N 3.24Å; M660-K662 VanDerWaalsContact C-N 3.35Å; K662-R666 VanDerWaalsContact O-CG 3.28Å; K662-R666 WeakPolarHBondContact O-CG 3.19Å; K662-R666 PolarHBondContact O-N 3.11Å; K662-R666 VanDerWaalsContact O-N 3.09Å
663	E	94.3	Very high	92.6	Very high	29 Å²	29	62 Å²	62	14%	0.136	29%	0.289	C	S	.	.	H	α-helix	trans	-66.5	-40.6	174.2	-67.9	-68.1	103.6	0	0	111.4	R589 F591 H659 M660 M661 E665 R666 V667	R589-E663 IonicContact NH1-OE2 2.7Å; R589-E663 PolarHBondContact NH1-OE2 3.1Å; F591-E663 HydrophobicContact CZ-CB 4.13Å; H659-E663 WeakPolarHBondContact O-CG 3.42Å; H659-E663 PolarHBondContact O-N 3.21Å; M660-E663 HydrophobicContact CE-CG 4.32Å; M660-E663 PolarHBondContact O-N 3.08Å; M661-E663 VanDerWaalsContact C-N 3.33Å; M661-E663 PolarHBondContact O-N 3.48Å; E663-E665 PolarHBondContact O-N 2.86Å; E663-R666 WeakPolarHBondContact O-CB 3.31Å; E663-R666 PolarHBondContact O-N 2.92Å; E663-R666 WeakPolarHBondContact OE1-CD 3.49Å; E663-R666 IonicContact OE1-CZ 3.2Å; E663-R666 IonicContact OE1-NE 2.79Å; E663-R666 IonicContact OE1-NH1 2.77Å; E663-R666 PolarHBondContact OE1-NH1 3.5Å; E663-V667 WeakPolarHBondContact O-CB 3.45Å; E663-V667 VanDerWaalsContact O-CG2 3.25Å; E663-V667 WeakPolarHBondContact O-CG2 3.36Å; E663-V667 PolarHBondContact O-N 2.95Å
664	E	94.3	Very high	92.9	Very high	21 Å²	21	61.9 Å²	61.9	10%	0.098	29%	0.289	C	S	.	.	H	α-helix	trans	-56.2	-48	174.1	-174	-179	154.4	0	0	111.3	F591 V593 K618 M660 M661 R666 V667 A668	F591-E664 HydrophobicContact CB-CG 4.24Å; F591-E664 HydrophobicContact CD1-CB 3.61Å; F591-E664 HydrophobicContact CD1-CG 3.85Å; F591-E664 HydrophobicContact CE1-CB 3.8Å; F591-E664 HydrophobicContact CG-CB 4.31Å; F591-E664 HydrophobicContact CG-CG 4.19Å; V593-E664 HydrophobicContact CG2-CG 4.45Å; K618-E664 IonicContact NZ-OE1 3.96Å; K618-E664 PolarHBondContact NZ-OE1 3.44Å; K618-E664 IonicContact NZ-OE2 2.97Å; M660-E664 PolarHBondContact O-N 3.45Å; M661-E664 WeakPolarHBondContact O-CB 3.25Å; M661-E664 PolarHBondContact O-N 3.07Å; E664-R666 PolarHBondContact O-N 3.38Å; E664-V667 PolarHBondContact O-N 3.34Å; E664-A668 WeakPolarHBondContact O-CB 3.39Å; E664-A668 PolarHBondContact O-N 2.61Å
665	E	93.3	Very high	93.1	Very high	129 Å²	129	58.2 Å²	58.2	60%	0.603	27%	0.274	S	S	*	.	H	α-helix	trans	-59.7	-44.2	175.6	-71.1	173.9	-174.2	0	0	112.2	M661 E663 A668 L669	M661-E665 PolarHBondContact O-N 3.28Å; M661-E665 VanDerWaalsContact O-N 3.09Å; E663-E665 PolarHBondContact O-N 2.86Å; E665-A668 PolarHBondContact O-N 2.9Å; E665-L669 WeakPolarHBondContact O-CG 3.25Å; E665-L669 PolarHBondContact O-N 2.98Å
666	R	94.9	Very high	93.3	Very high	136 Å²	136	58.2 Å²	58.2	51%	0.513	27%	0.273	S	S	.	.	H	α-helix	trans	-63.2	-43.2	177.3	-73.5	169.6	-178.7	178.9	-1.2	111.8	K662 E663 E664 L669 R670	K662-R666 VanDerWaalsContact O-CG 3.28Å; K662-R666 WeakPolarHBondContact O-CG 3.19Å; K662-R666 PolarHBondContact O-N 3.11Å; K662-R666 VanDerWaalsContact O-N 3.09Å; E663-R666 WeakPolarHBondContact O-CB 3.31Å; E663-R666 PolarHBondContact O-N 2.92Å; E663-R666 WeakPolarHBondContact OE1-CD 3.49Å; E663-R666 IonicContact OE1-CZ 3.2Å; E663-R666 IonicContact OE1-NE 2.79Å; E663-R666 IonicContact OE1-NH1 2.77Å; E663-R666 PolarHBondContact OE1-NH1 3.5Å; E664-R666 PolarHBondContact O-N 3.38Å; R666-L669 PolarHBondContact O-N 3.22Å; R666-R670 WeakPolarHBondContact O-CG 3.45Å; R666-R670 PolarHBondContact O-N 3.22Å
667	V	94.5	Very high	93.5	Very high	3 Å²	3	57.9 Å²	57.9	2%	0.018	27%	0.27	C	S	.	.	H	α-helix	trans	-66.3	-42.5	179	172.6	0	0	0	0	110.1	V570 E572 F591 E663 E664 L669 R670 V671	V570-V667 HydrophobicContact CB-CG1 4.2Å; V570-V667 HydrophobicContact CG1-CG1 3.59Å; V570-V667 HydrophobicContact CG2-CG1 4.25Å; E572-V667 VanDerWaalsContact OE1-CG2 3.23Å; E572-V667 WeakPolarHBondContact OE1-CG2 3.48Å; F591-V667 HydrophobicContact CE2-CG2 4.26Å; E663-V667 WeakPolarHBondContact O-CB 3.45Å; E663-V667 VanDerWaalsContact O-CG2 3.25Å; E663-V667 WeakPolarHBondContact O-CG2 3.36Å; E663-V667 PolarHBondContact O-N 2.95Å; E664-V667 PolarHBondContact O-N 3.34Å; V667-L669 VanDerWaalsContact C-N 3.32Å; V667-L669 PolarHBondContact O-N 3.12Å; V667-R670 PolarHBondContact O-N 3.37Å; V667-R670 VanDerWaalsContact O-N 3.16Å; V667-V671 HydrophobicContact CG1-CG2 4.36Å; V667-V671 VanDerWaalsContact O-CG2 3.32Å; V667-V671 WeakPolarHBondContact O-CG2 3.45Å; V667-V671 PolarHBondContact O-N 3.3Å
668	A	93	Very high	93.7	Very high	39 Å²	39	57.9 Å²	57.9	32%	0.322	27%	0.271	S	S	.	.	H	α-helix	trans	-58.4	-42.2	174.8	0	0	0	0	0	112.3	L567 E664 E665 V671 K672	L567-A668 HydrophobicContact CD2-CB 3.9Å; E664-A668 WeakPolarHBondContact O-CB 3.39Å; E664-A668 PolarHBondContact O-N 2.61Å; E665-A668 PolarHBondContact O-N 2.9Å; A668-V671 PolarHBondContact O-N 2.91Å; A668-K672 PolarHBondContact O-N 3.18Å; A668-K672 VanDerWaalsContact O-N 3.09Å
669	L	94.1	Very high	93.9	Very high	107 Å²	107	59 Å²	59	56%	0.56	27%	0.27	S	S	*	.	H	α-helix	trans	-62.3	-46	173.7	-72.2	170.9	0	0	0	112.1	E665 R666 V667 V671 K672 E673	E665-L669 WeakPolarHBondContact O-CG 3.25Å; E665-L669 PolarHBondContact O-N 2.98Å; R666-L669 PolarHBondContact O-N 3.22Å; V667-L669 VanDerWaalsContact C-N 3.32Å; V667-L669 PolarHBondContact O-N 3.12Å; L669-V671 VanDerWaalsContact C-N 3.33Å; L669-V671 PolarHBondContact O-N 3Å; L669-K672 WeakPolarHBondContact O-CB 3.41Å; L669-K672 PolarHBondContact O-N 3.17Å; L669-E673 WeakPolarHBondContact O-CG 3.41Å; L669-E673 PolarHBondContact O-N 2.8Å
670	R	93.7	Very high	94	Very high	93 Å²	93	56.8 Å²	56.8	35%	0.351	27%	0.266	S	S	.	.	H	α-helix	trans	-63.6	-37.3	178	-70.1	177.9	-179.2	176.5	1.3	112.7	R541 R666 V667 K672 E673 S674	R541-R670 VanDerWaalsContact NH1-CB 3.33Å; R666-R670 WeakPolarHBondContact O-CG 3.45Å; R666-R670 PolarHBondContact O-N 3.22Å; V667-R670 PolarHBondContact O-N 3.37Å; V667-R670 VanDerWaalsContact O-N 3.16Å; R670-K672 VanDerWaalsContact C-N 3.34Å; R670-E673 PolarHBondContact O-N 3.17Å; R670-S674 WeakPolarHBondContact O-CB 3.21Å; R670-S674 PolarHBondContact O-N 2.91Å; R670-S674 PolarHBondContact O-OG 3.12Å
671	V	94.6	Very high	94.1	Very high	4 Å²	4	56.7 Å²	56.7	2%	0.024	27%	0.266	C	S	.	.	H	α-helix	trans	-62.5	-44.8	175	169.6	0	0	0	0	109.9	M527 V543 F545 L567 V667 A668 L669 E673 S674 E675	M527-V671 HydrophobicContact CE-CG1 4.2Å; V543-V671 HydrophobicContact CG1-CG1 3.98Å; V543-V671 HydrophobicContact CG1-CG2 4.44Å; V543-V671 HydrophobicContact CG2-CG1 4.33Å; V543-V671 HydrophobicContact CG2-CG2 3.63Å; F545-V671 HydrophobicContact CE1-CG1 3.79Å; F545-V671 HydrophobicContact CZ-CG1 3.91Å; L567-V671 HydrophobicContact CD1-CG1 4.28Å; V667-V671 HydrophobicContact CG1-CG2 4.36Å; V667-V671 VanDerWaalsContact O-CG2 3.32Å; V667-V671 WeakPolarHBondContact O-CG2 3.45Å; V667-V671 PolarHBondContact O-N 3.3Å; A668-V671 PolarHBondContact O-N 2.91Å; L669-V671 VanDerWaalsContact C-N 3.33Å; L669-V671 PolarHBondContact O-N 3Å; V671-E673 VanDerWaalsContact C-N 3.35Å; V671-E673 PolarHBondContact O-N 2.59Å; V671-S674 WeakPolarHBondContact O-CB 3.49Å; V671-S674 PolarHBondContact O-N 3.05Å; V671-S674 VanDerWaalsContact O-N 3.11Å; V671-E675 PolarHBondContact O-N 2.9Å
672	K	92.7	Very high	94.2	Very high	69 Å²	69	54.6 Å²	54.6	30%	0.3	26%	0.255	S	S	.	.	H	α-helix	trans	-61.7	-40	175.4	175.8	176.8	175.7	152.6	0	112.7	Q564 A668 L669 R670 S674 K676	Q564-K672 VanDerWaalsContact CD-CE 3.41Å; Q564-K672 HydrophobicContact CG-CG 4.36Å; Q564-K672 VanDerWaalsContact OE1-CD 3.29Å; Q564-K672 VanDerWaalsContact OE1-CE 3.22Å; A668-K672 PolarHBondContact O-N 3.18Å; A668-K672 VanDerWaalsContact O-N 3.09Å; L669-K672 WeakPolarHBondContact O-CB 3.41Å; L669-K672 PolarHBondContact O-N 3.17Å; R670-K672 VanDerWaalsContact C-N 3.34Å; K672-S674 VanDerWaalsContact C-N 3.33Å; K672-K676 WeakPolarHBondContact O-CG 3.24Å; K672-K676 PolarHBondContact O-N 2.84Å; K672-K676 VanDerWaalsContact O-N 3.1Å
673	E	94	Very high	94.2	Very high	125 Å²	125	50.8 Å²	50.8	58%	0.584	25%	0.249	S	C	*	.	H	α-helix	trans	-63.6	-39.6	172.7	-71.8	171.7	168.5	0	0	111.7	L669 R670 V671 K676 E677	L669-E673 WeakPolarHBondContact O-CG 3.41Å; L669-E673 PolarHBondContact O-N 2.8Å; R670-E673 PolarHBondContact O-N 3.17Å; V671-E673 VanDerWaalsContact C-N 3.35Å; V671-E673 PolarHBondContact O-N 2.59Å; E673-K676 WeakPolarHBondContact O-CB 3.15Å; E673-K676 PolarHBondContact O-N 3.26Å; E673-E677 WeakPolarHBondContact O-CB 3.36Å; E673-E677 PolarHBondContact O-N 2.94Å
674	S	94.5	Very high	94.2	Very high	8 Å²	8	51.2 Å²	51.2	6%	0.056	25%	0.254	C	S	.	.	H	α-helix	trans	-64.5	-42.8	178.2	-54.4	0	0	0	0	111.5	R520 E529 R541 R670 V671 K672 K676 E677 V678	R520-S674 PolarHBondContact NH2-OG 3.37Å; E529-S674 PolarHBondContact OE1-OG 2.99Å; R541-S674 PolarHBondContact NH2-OG 3.48Å; R670-S674 WeakPolarHBondContact O-CB 3.21Å; R670-S674 PolarHBondContact O-N 2.91Å; R670-S674 PolarHBondContact O-OG 3.12Å; V671-S674 WeakPolarHBondContact O-CB 3.49Å; V671-S674 PolarHBondContact O-N 3.05Å; V671-S674 VanDerWaalsContact O-N 3.11Å; K672-S674 VanDerWaalsContact C-N 3.33Å; S674-K676 VanDerWaalsContact C-N 3.35Å; S674-K676 PolarHBondContact O-N 3.25Å; S674-E677 PolarHBondContact O-N 3.19Å; S674-V678 WeakPolarHBondContact O-CG2 3.19Å; S674-V678 PolarHBondContact O-N 3.01Å
675	E	92.6	Very high	94.2	Very high	6 Å²	6	50.3 Å²	50.3	3%	0.028	25%	0.249	C	C	.	.	H	α-helix	trans	-63.6	-38.8	173.1	-66.1	-168.3	120.7	0	0	112.6	F545 R565 V671 V678 R679	F545-E675 HydrophobicContact CZ-CG 4.28Å; R565-E675 IonicContact CZ-OE1 3.76Å; R565-E675 IonicContact NE-OE1 3.89Å; R565-E675 PolarHBondContact NE-OE1 2.97Å; R565-E675 IonicContact NH2-OE1 3.09Å; R565-E675 PolarHBondContact NH2-OE1 3.19Å; V671-E675 PolarHBondContact O-N 2.9Å; E675-V678 PolarHBondContact O-N 3.26Å; E675-R679 PolarHBondContact O-N 2.95Å; E675-R679 IonicContact OE2-NH2 3.35Å
676	K	93.6	Very high	94.2	Very high	110 Å²	110	50.9 Å²	50.9	48%	0.478	25%	0.252	S	S	.	.	H	α-helix	trans	-64.6	-42.5	175.1	-74.8	177.2	177.1	-171.6	0	111.7	K672 E673 S674 V678 R679 A680	K672-K676 WeakPolarHBondContact O-CG 3.24Å; K672-K676 PolarHBondContact O-N 2.84Å; K672-K676 VanDerWaalsContact O-N 3.1Å; E673-K676 WeakPolarHBondContact O-CB 3.15Å; E673-K676 PolarHBondContact O-N 3.26Å; S674-K676 VanDerWaalsContact C-N 3.35Å; S674-K676 PolarHBondContact O-N 3.25Å; K676-V678 VanDerWaalsContact C-N 3.34Å; K676-R679 PolarHBondContact O-N 2.96Å; K676-A680 WeakPolarHBondContact O-CB 3.25Å; K676-A680 PolarHBondContact O-N 3.28Å
677	E	94.9	Very high	94	Very high	32 Å²	32	50.9 Å²	50.9	15%	0.15	26%	0.258	C	S	.	.	H	α-helix	trans	-61.2	-43	176.9	-174.1	-174.9	-156	0	0	111.1	Y488 R513 R520 E673 S674 R679 A680 I681	Y488-E677 HydrophobicContact CD1-CG 3.99Å; Y488-E677 HydrophobicContact CE1-CG 4.17Å; R513-E677 IonicContact CZ-OE1 2.9Å; R513-E677 VanDerWaalsContact CZ-OE1 3.24Å; R513-E677 IonicContact NH1-OE1 2.68Å; R513-E677 PolarHBondContact NH1-OE1 3.11Å; R513-E677 IonicContact NH2-OE1 2.81Å; R513-E677 PolarHBondContact NH2-OE1 2.96Å; R513-E677 IonicContact NH2-OE2 3.33Å; R520-E677 IonicContact CZ-OE2 2.65Å; R520-E677 IonicContact NH1-OE2 3Å; R520-E677 PolarHBondContact NH1-OE2 2.94Å; R520-E677 IonicContact NH2-OE2 2.78Å; R520-E677 PolarHBondContact NH2-OE2 3.21Å; E673-E677 WeakPolarHBondContact O-CB 3.36Å; E673-E677 PolarHBondContact O-N 2.94Å; S674-E677 PolarHBondContact O-N 3.19Å; E677-R679 PolarHBondContact O-N 3.19Å; E677-A680 WeakPolarHBondContact O-CB 3.24Å; E677-A680 PolarHBondContact O-N 3.43Å; E677-A680 VanDerWaalsContact O-N 3.17Å; E677-I681 HydrophobicContact CG-CD1 3.99Å; E677-I681 HydrophobicContact CG-CG1 4.44Å; E677-I681 WeakPolarHBondContact O-CG1 3.4Å; E677-I681 PolarHBondContact O-N 3.29Å
678	V	94.6	Very high	93.9	Very high	2 Å²	2	52.3 Å²	52.3	1%	0.012	26%	0.264	C	S	.	.	H	α-helix	trans	-58.6	-47.7	175	172	0	0	0	0	111.3	M506 E522 S674 E675 K676 A680 I681 L682	M506-V678 HydrophobicContact CE-CG1 4.16Å; E522-V678 WeakPolarHBondContact OE2-CG1 3.34Å; S674-V678 WeakPolarHBondContact O-CG2 3.19Å; S674-V678 PolarHBondContact O-N 3.01Å; E675-V678 PolarHBondContact O-N 3.26Å; K676-V678 VanDerWaalsContact C-N 3.34Å; V678-A680 VanDerWaalsContact C-N 3.29Å; V678-A680 PolarHBondContact O-N 3.45Å; V678-I681 PolarHBondContact O-N 3.2Å; V678-L682 HydrophobicContact CG1-CD1 4.34Å; V678-L682 WeakPolarHBondContact O-CG 3.3Å; V678-L682 PolarHBondContact O-N 3.33Å
679	R	94.3	Very high	93.8	Very high	69 Å²	69	53.6 Å²	53.6	26%	0.26	26%	0.264	S	S	.	.	H	α-helix	trans	-61	-39.3	176.2	-66.4	-173.6	-143.2	92	6.9	112	P500 E675 K676 E677 L682 G683	P500-R679 HydrophobicContact CB-CG 4.27Å; E675-R679 PolarHBondContact O-N 2.95Å; E675-R679 IonicContact OE2-NH2 3.35Å; K676-R679 PolarHBondContact O-N 2.96Å; E677-R679 PolarHBondContact O-N 3.19Å; R679-L682 PolarHBondContact O-N 3.38Å; R679-G683 PolarHBondContact O-N 2.82Å
680	A	95.4	Very high	93.6	Very high	37 Å²	37	53.1 Å²	53.1	31%	0.306	27%	0.269	S	S	.	.	H	α-helix	trans	-65.4	-44	177.6	0	0	0	0	0	112.1	K676 E677 V678 L682 G683 V684	K676-A680 WeakPolarHBondContact O-CB 3.25Å; K676-A680 PolarHBondContact O-N 3.28Å; E677-A680 WeakPolarHBondContact O-CB 3.24Å; E677-A680 PolarHBondContact O-N 3.43Å; E677-A680 VanDerWaalsContact O-N 3.17Å; V678-A680 VanDerWaalsContact C-N 3.29Å; V678-A680 PolarHBondContact O-N 3.45Å; A680-L682 VanDerWaalsContact C-N 3.34Å; A680-L682 PolarHBondContact O-N 3.32Å; A680-G683 PolarHBondContact O-N 2.95Å; A680-V684 WeakPolarHBondContact O-CG2 3.41Å; A680-V684 PolarHBondContact O-N 3.38Å
681	I	95.5	Very high	93.5	Very high	3 Å²	3	52.1 Å²	52.1	2%	0.015	28%	0.276	C	S	.	.	H	α-helix	trans	-59.7	-46.1	175	-69.5	166.7	0	0	0	110.1	Y488 L490 M506 F508 E677 V678 V684 R685	Y488-I681 HydrophobicContact CD1-CD1 4.48Å; Y488-I681 HydrophobicContact CD1-CG1 4.13Å; Y488-I681 HydrophobicContact CD2-CG1 3.74Å; Y488-I681 HydrophobicContact CE2-CG1 4.25Å; Y488-I681 HydrophobicContact CG-CD1 4.18Å; Y488-I681 HydrophobicContact CG-CG1 3.67Å; L490-I681 HydrophobicContact CD2-CG2 4.02Å; M506-I681 HydrophobicContact CE-CG2 4.01Å; M506-I681 HydrophobicContact SD-CD1 4.13Å; M506-I681 HydrophobicContact SD-CG2 4.27Å; F508-I681 HydrophobicContact CE1-CD1 3.93Å; F508-I681 HydrophobicContact CZ-CD1 4.09Å; E677-I681 HydrophobicContact CG-CD1 3.99Å; E677-I681 HydrophobicContact CG-CG1 4.44Å; E677-I681 WeakPolarHBondContact O-CG1 3.4Å; E677-I681 PolarHBondContact O-N 3.29Å; V678-I681 PolarHBondContact O-N 3.2Å; I681-V684 PolarHBondContact O-N 3.23Å; I681-R685 WeakPolarHBondContact O-CG 3.2Å; I681-R685 PolarHBondContact O-N 3.49Å
682	L	94.9	Very high	93.3	Very high	9 Å²	9	54.6 Å²	54.6	5%	0.047	29%	0.289	C	S	.	.	H	α-helix	trans	-63.2	-42.6	178.2	-69.3	-179.9	0	0	0	112.7	M498 P500 M506 V678 R679 A680 V684 R685 E686	M498-L682 HydrophobicContact CE-CD2 3.79Å; M498-L682 VanDerWaalsContact O-CD1 3.3Å; M498-L682 WeakPolarHBondContact O-CD1 3.36Å; M498-L682 HydrophobicContact SD-CD2 4.22Å; P500-L682 HydrophobicContact CB-CD1 4.08Å; M506-L682 HydrophobicContact CE-CD2 4.11Å; M506-L682 HydrophobicContact CE-CG 4.46Å; V678-L682 HydrophobicContact CG1-CD1 4.34Å; V678-L682 WeakPolarHBondContact O-CG 3.3Å; V678-L682 PolarHBondContact O-N 3.33Å; R679-L682 PolarHBondContact O-N 3.38Å; A680-L682 VanDerWaalsContact C-N 3.34Å; A680-L682 PolarHBondContact O-N 3.32Å; L682-V684 VanDerWaalsContact C-N 3.34Å; L682-V684 PolarHBondContact O-N 3.39Å; L682-R685 PolarHBondContact O-N 2.92Å; L682-E686 PolarHBondContact O-N 2.78Å
683	G	94.3	Very high	93.1	Very high	36 Å²	36	57 Å²	57	37%	0.371	30%	0.301	S	S	.	.	H	α-helix	trans	-63.6	-38.9	176.9	0	0	0	0	0	112.6	R679 A680 E686 Q687	R679-G683 PolarHBondContact O-N 2.82Å; A680-G683 PolarHBondContact O-N 2.95Å; G683-E686 PolarHBondContact O-N 2.89Å; G683-Q687 PolarHBondContact O-N 2.73Å
684	V	94.1	Very high	92.9	Very high	38 Å²	38	53.1 Å²	53.1	23%	0.23	28%	0.284	C	S	.	.	H	α-helix	trans	-63.5	-44.1	172.5	170.4	0	0	0	0	110.8	Y488 A680 I681 L682 E686 Q687 E688	Y488-V684 HydrophobicContact CE2-CG2 4.33Å; A680-V684 WeakPolarHBondContact O-CG2 3.41Å; A680-V684 PolarHBondContact O-N 3.38Å; I681-V684 PolarHBondContact O-N 3.23Å; L682-V684 VanDerWaalsContact C-N 3.34Å; L682-V684 PolarHBondContact O-N 3.39Å; V684-E686 PolarHBondContact O-N 2.88Å; V684-Q687 PolarHBondContact O-N 2.9Å; V684-E688 HydrophobicContact CG1-CG 4.25Å; V684-E688 VanDerWaalsContact CG1-OE1 3.24Å; V684-E688 WeakPolarHBondContact CG1-OE1 3.49Å; V684-E688 WeakPolarHBondContact O-CB 3.45Å; V684-E688 VanDerWaalsContact O-CG 3.24Å; V684-E688 WeakPolarHBondContact O-CG 3.49Å; V684-E688 PolarHBondContact O-N 3.12Å
685	R	94.1	Very high	92.4	Very high	1 Å²	1	57.6 Å²	57.6	0%	0.004	30%	0.304	C	S	.	.	H	α-helix	trans	-61.4	-42.7	176.1	-72.5	-62.2	-60.6	131.8	3	112.3	D464 E480 M498 I681 L682 Q687 E688 E689	D464-R685 IonicContact OD2-NH1 2.75Å; D464-R685 PolarHBondContact OD2-NH1 3.31Å; D464-R685 VanDerWaalsContact OD2-NH1 3.13Å; E480-R685 IonicContact OE1-CZ 3.54Å; E480-R685 IonicContact OE1-NH2 3.03Å; E480-R685 PolarHBondContact OE1-NH2 3.4Å; E480-R685 IonicContact OE2-CZ 2.74Å; E480-R685 IonicContact OE2-NE 2.74Å; E480-R685 PolarHBondContact OE2-NE 3.06Å; E480-R685 VanDerWaalsContact OE2-NE 3.11Å; E480-R685 IonicContact OE2-NH2 3.71Å; E480-R685 PolarHBondContact OE2-NH2 3.46Å; M498-R685 HydrophobicContact CE-CB 3.41Å; M498-R685 VanDerWaalsContact CE-CB 3.41Å; M498-R685 HydrophobicContact CE-CG 4.16Å; I681-R685 WeakPolarHBondContact O-CG 3.2Å; I681-R685 PolarHBondContact O-N 3.49Å; L682-R685 PolarHBondContact O-N 2.92Å; R685-Q687 VanDerWaalsContact C-N 3.32Å; R685-Q687 PolarHBondContact O-N 2.88Å; R685-E688 WeakPolarHBondContact CD-OE2 3.34Å; R685-E688 IonicContact CZ-OE2 2.84Å; R685-E688 IonicContact NE-OE2 3.6Å; R685-E688 IonicContact NH1-OE2 3.04Å; R685-E688 PolarHBondContact NH1-OE2 3.29Å; R685-E688 PolarHBondContact O-N 3.34Å; R685-E689 IonicContact CZ-OE1 3.51Å; R685-E689 IonicContact NH1-OE1 3.66Å; R685-E689 IonicContact NH2-OE1 2.78Å; R685-E689 PolarHBondContact NH2-OE1 3.12Å; R685-E689 WeakPolarHBondContact O-CG 3.42Å; R685-E689 PolarHBondContact O-N 3.21Å
686	E	93.2	Very high	91.8	Very high	141 Å²	141	60.9 Å²	60.9	66%	0.659	32%	0.321	S	S	*	.	H	α-helix	trans	-61.2	-42.6	177.4	-175.5	173.6	-160.5	0	0	111.5	L682 G683 V684 E689 S690	L682-E686 PolarHBondContact O-N 2.78Å; G683-E686 PolarHBondContact O-N 2.89Å; V684-E686 PolarHBondContact O-N 2.88Å; E686-E689 PolarHBondContact O-N 2.97Å; E686-S690 WeakPolarHBondContact O-CB 3.5Å; E686-S690 PolarHBondContact O-N 3.23Å
687	Q	92.4	Very high	90.7	Very high	136 Å²	136	57.7 Å²	57.7	64%	0.636	31%	0.313	S	S	*	.	H	α-helix	trans	-63.3	-46.2	174.1	-172.9	177.7	10.5	0	0	112.1	G683 V684 R685 E689 S690 S691	G683-Q687 PolarHBondContact O-N 2.73Å; V684-Q687 PolarHBondContact O-N 2.9Å; R685-Q687 VanDerWaalsContact C-N 3.32Å; R685-Q687 PolarHBondContact O-N 2.88Å; Q687-E689 VanDerWaalsContact C-N 3.32Å; Q687-E689 PolarHBondContact O-N 3.13Å; Q687-S690 PolarHBondContact O-N 2.89Å; Q687-S690 PolarHBondContact O-OG 3.31Å; Q687-S691 PolarHBondContact O-N 3.14Å; Q687-S691 VanDerWaalsContact O-N 3.08Å
688	E	92.2	Very high	89.2	Confident	34 Å²	34	62.3 Å²	62.3	16%	0.159	34%	0.337	C	S	.	.	H	α-helix	trans	-59.8	-38.8	177.6	-72.8	168.1	174.4	0	0	112.2	D464 R486 V684 R685 S691 I692	D464-E688 HydrophobicContact CB-CB 4.21Å; D464-E688 VanDerWaalsContact CB-CD 3.48Å; D464-E688 HydrophobicContact CB-CG 3.84Å; R486-E688 IonicContact CZ-OE1 2.96Å; R486-E688 IonicContact CZ-OE2 2.64Å; R486-E688 IonicContact NH1-OE2 3.51Å; R486-E688 IonicContact NH2-OE1 3.23Å; R486-E688 PolarHBondContact NH2-OE1 3.23Å; R486-E688 IonicContact NH2-OE2 2.73Å; R486-E688 PolarHBondContact NH2-OE2 3.08Å; V684-E688 HydrophobicContact CG1-CG 4.25Å; V684-E688 VanDerWaalsContact CG1-OE1 3.24Å; V684-E688 WeakPolarHBondContact CG1-OE1 3.49Å; V684-E688 WeakPolarHBondContact O-CB 3.45Å; V684-E688 VanDerWaalsContact O-CG 3.24Å; V684-E688 WeakPolarHBondContact O-CG 3.49Å; V684-E688 PolarHBondContact O-N 3.12Å; R685-E688 WeakPolarHBondContact CD-OE2 3.34Å; R685-E688 IonicContact CZ-OE2 2.84Å; R685-E688 IonicContact NE-OE2 3.6Å; R685-E688 IonicContact NH1-OE2 3.04Å; R685-E688 PolarHBondContact NH1-OE2 3.29Å; R685-E688 PolarHBondContact O-N 3.34Å; E688-S691 CarbonylContact O-C 3.48Å; E688-I692 WeakPolarHBondContact O-CG1 3.36Å
689	E	89.7	Confident	87.3	Confident	66 Å²	66	71.9 Å²	71.9	31%	0.308	37%	0.374	S	S	.	.	H	α-helix	trans	-74.5	-31.2	176	-67.8	-60.1	128.4	0	0	112.7	R462 R469 R685 E686 Q687	R462-E689 IonicContact NH2-OE1 3.18Å; R462-E689 PolarHBondContact NH2-OE1 3.16Å; R469-E689 IonicContact CZ-OE1 2.7Å; R469-E689 IonicContact CZ-OE2 3.17Å; R469-E689 IonicContact NH1-OE2 3.37Å; R469-E689 PolarHBondContact NH1-OE2 2.82Å; R469-E689 IonicContact NH2-OE1 2.71Å; R469-E689 PolarHBondContact NH2-OE1 3.43Å; R469-E689 IonicContact NH2-OE2 3.55Å; R469-E689 PolarHBondContact NH2-OE2 2.89Å; R685-E689 IonicContact CZ-OE1 3.51Å; R685-E689 IonicContact NH1-OE1 3.66Å; R685-E689 IonicContact NH2-OE1 2.78Å; R685-E689 PolarHBondContact NH2-OE1 3.12Å; R685-E689 WeakPolarHBondContact O-CG 3.42Å; R685-E689 PolarHBondContact O-N 3.21Å; E686-E689 PolarHBondContact O-N 2.97Å; Q687-E689 VanDerWaalsContact C-N 3.32Å; Q687-E689 PolarHBondContact O-N 3.13Å
690	S	90.4	Very high	85.9	Confident	96 Å²	96	69.3 Å²	69.3	67%	0.671	37%	0.366	S	S	*	.	H	α-helix	trans	-71.3	-30	176.9	75.3	0	0	0	0	113.2	E686 Q687	E686-S690 WeakPolarHBondContact O-CB 3.5Å; E686-S690 PolarHBondContact O-N 3.23Å; Q687-S690 PolarHBondContact O-N 2.89Å; Q687-S690 PolarHBondContact O-OG 3.31Å
691	S	90.9	Very high	84.2	Confident	72 Å²	72	68.5 Å²	68.5	50%	0.503	36%	0.357	S	S	.	.	S	Bend	trans	-143.9	91.3	-176.6	-178.5	0	0	0	0	110.7	Q687 E688	Q687-S691 PolarHBondContact O-N 3.14Å; Q687-S691 VanDerWaalsContact O-N 3.08Å; E688-S691 CarbonylContact O-C 3.48Å
692	I	90.8	Very high	82.6	Confident	56 Å²	56	71 Å²	71	29%	0.287	38%	0.378	S	S	.	.			trans	-82.9	125.7	-178.8	-58.1	161.6	0	0	0	110	D435 R462 E688 L694	D435-I692 HydrophobicContact CB-CD1 3.72Å; R462-I692 HydrophobicContact CG-CG2 4.43Å; E688-I692 WeakPolarHBondContact O-CG1 3.36Å; I692-L694 HydrophobicContact CG2-CD2 4.42Å
693	E	88.8	Confident	81.2	Confident	121 Å²	121	74.3 Å²	74.3	57%	0.565	39%	0.39	S	S	*	.			trans	-113.3	137.3	177	-65.5	-175.4	179.3	0	0	111.6	H463	H463-E693 HydrophobicContact CB-CB 4.12Å; H463-E693 WeakPolarHBondContact CB-O 3.32Å; H463-E693 PolarHBondContact N-O 3.15Å
694	L	89.2	Confident	79.8	Confident	43 Å²	43	74.6 Å²	74.6	23%	0.225	38%	0.383	C	S	.	.	B	Isolated β-bridge	trans	-105.3	129.1	178.4	-56.2	-177.2	0	0	0	111.6	Y431 H461 R462 I692 I696	Y431-L694 HydrophobicContact CD1-CB 4.12Å; Y431-L694 HydrophobicContact CD1-CD1 3.89Å; Y431-L694 HydrophobicContact CE1-CB 4.24Å; H461-L694 CarbonylContact O-C 3.51Å; H461-L694 VanDerWaalsContact O-CA 3.28Å; H461-L694 WeakPolarHBondContact O-CA 3.29Å; R462-L694 HydrophobicContact CG-CD2 3.93Å; I692-L694 HydrophobicContact CG2-CD2 4.42Å; L694-I696 PolarHBondContact O-N 2.84Å
695	H	84.3	Confident	78.4	Confident	102 Å²	102	79.1 Å²	79.1	47%	0.472	40%	0.402	S	S	.	.			trans	-71.2	111.4	171.6	-178.9	-78.9	0	0	0	111.2	Y431 H461	Y431-H695 WeakPolarHBondContact CE1-O 3.24Å; Y431-H695 PolarHBondContact OH-O 2.68Å; H461-H695 WeakPolarHBondContact O-CB 3.24Å; H461-H695 PolarHBondContact O-N 2.93Å
696	I	80.1	Confident	76.8	Confident	75 Å²	75	89.6 Å²	89.6	39%	0.385	44%	0.441	S	S	.	.			trans	-95.5	123.7	174.4	-57.9	171.3	0	0	0	108.9	Y431 L694 N700 R703 N704	Y431-I696 HydrophobicContact CE1-CG1 4.13Å; L694-I696 PolarHBondContact O-N 2.84Å; I696-N700 HydrophobicContact CG2-CB 4.47Å; I696-R703 HydrophobicContact CD1-CB 4.49Å; I696-R703 HydrophobicContact CG2-CB 3.83Å; I696-N704 HydrophobicContact CG2-CB 4.33Å
697	S	70.1	Confident	75.2	Confident	43 Å²	43	84 Å²	84	30%	0.301	42%	0.419	S	S	.	.			trans	-60.8	140.7	177	178.1	0	0	0	0	111.6	Y699 N700	S697-Y699 PolarHBondContact O-N 2.94Å; S697-Y699 PolarHBondContact OG-N 3.2Å; S697-N700 PolarHBondContact O-N 2.9Å
698	I	63.1	Low	74	Confident	129 Å²	129	81.8 Å²	81.8	66%	0.662	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-31.3	175.7	-56	168.7	0	0	0	110.9	N700	I698-N700 VanDerWaalsContact C-N 3.34Å
699	Y	56.2	Low	72.8	Confident	202 Å²	202	83.4 Å²	83.4	79%	0.792	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-10.1	179.5	-56.1	-76.1	0	0	0	113.4	S697 T701	S697-Y699 PolarHBondContact O-N 2.94Å; S697-Y699 PolarHBondContact OG-N 3.2Å; Y699-T701 VanDerWaalsContact C-N 3.34Å; Y699-T701 PolarHBondContact O-N 2.84Å
700	N	64.9	Low	71.9	Confident	15 Å²	15	86.2 Å²	86.2	8%	0.08	43%	0.432	C	S	.	.			trans	-81.5	84.7	175.1	-165.8	-40.1	0	0	0	109.7	E408 I696 S697 I698 A702 R703 N704	E408-N700 PolarHBondContact OE1-ND2 2.77Å; I696-N700 HydrophobicContact CG2-CB 4.47Å; S697-N700 PolarHBondContact O-N 2.9Å; I698-N700 VanDerWaalsContact C-N 3.34Å; N700-A702 PolarHBondContact O-N 3.09Å; N700-A702 WeakPolarHBondContact OD1-CB 3.42Å; N700-A702 PolarHBondContact OD1-N 2.97Å; N700-A702 VanDerWaalsContact OD1-N 3.11Å; N700-R703 PolarHBondContact O-N 3.46Å; N700-R703 PolarHBondContact OD1-N 2.85Å; N700-N704 VanDerWaalsContact O-CB 3.25Å; N700-N704 WeakPolarHBondContact O-CB 3.24Å; N700-N704 PolarHBondContact O-N 3.27Å
701	T	59.3	Low	70.9	Confident	20 Å²	20	88.3 Å²	88.3	12%	0.123	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-14.8	178.9	53.4	0	0	0	0	113.7	Y699 A707 R708 R711	Y699-T701 VanDerWaalsContact C-N 3.34Å; Y699-T701 PolarHBondContact O-N 2.84Å; T701-A707 HydrophobicContact CG2-CB 4.29Å; T701-R708 WeakPolarHBondContact O-CB 3.44Å; T701-R708 WeakPolarHBondContact O-CG 3.46Å; T701-R711 PolarHBondContact OG1-NH2 2.87Å; T701-R711 VanDerWaalsContact OG1-NH2 3.12Å
702	A	62.5	Low	70.2	Confident	56 Å²	56	89.1 Å²	89.1	46%	0.463	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-37.7	177.8	0	0	0	0	0	111.5	N700	N700-A702 PolarHBondContact O-N 3.09Å; N700-A702 WeakPolarHBondContact OD1-CB 3.42Å; N700-A702 PolarHBondContact OD1-N 2.97Å; N700-A702 VanDerWaalsContact OD1-N 3.11Å
703	R	64.8	Low	69.6	Low	79 Å²	79	88.3 Å²	88.3	30%	0.298	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.2	-24	-173.6	-60.7	168.2	-168.5	-104	19.1	113.5	E408 P430 Y431 I696 N700 E705	E408-R703 IonicContact OE2-CZ 3.05Å; E408-R703 IonicContact OE2-NE 3.35Å; E408-R703 PolarHBondContact OE2-NE 2.86Å; E408-R703 VanDerWaalsContact OE2-NE 3.08Å; E408-R703 IonicContact OE2-NH2 2.68Å; E408-R703 PolarHBondContact OE2-NH2 2.87Å; P430-R703 PolarHBondContact O-NH2 3.3Å; Y431-R703 VanDerWaalsContact CD2-CZ 3.46Å; I696-R703 HydrophobicContact CD1-CB 4.49Å; I696-R703 HydrophobicContact CG2-CB 3.83Å; N700-R703 PolarHBondContact O-N 3.46Å; N700-R703 PolarHBondContact OD1-N 2.85Å; R703-E705 PolarHBondContact O-N 3.3Å
704	N	65.7	Low	69.2	Low	41 Å²	41	87 Å²	87	22%	0.219	42%	0.419	C	S	.	.			trans	-88.8	94.9	174.2	-173.7	-15.7	0	0	0	109.9	I696 N700 R706 A707 R708	I696-N704 HydrophobicContact CG2-CB 4.33Å; N700-N704 VanDerWaalsContact O-CB 3.25Å; N700-N704 WeakPolarHBondContact O-CB 3.24Å; N700-N704 PolarHBondContact O-N 3.27Å; N704-R706 PolarHBondContact O-N 3.06Å; N704-R706 PolarHBondContact OD1-N 3.18Å; N704-A707 HydrophobicContact CB-CB 3.92Å; N704-A707 PolarHBondContact O-N 2.9Å; N704-A707 PolarHBondContact OD1-N 3.32Å; N704-R708 PolarHBondContact O-N 3.35Å
705	E	63.5	Low	68.7	Low	133 Å²	133	89.8 Å²	89.8	62%	0.621	43%	0.431	S	S	*	.	H	α-helix	trans	-55.4	-37.3	-178.1	-67	-172.8	153.4	0	0	113	R703 R708 C709	R703-E705 PolarHBondContact O-N 3.3Å; E705-R708 PolarHBondContact O-N 3.35Å; E705-C709 WeakPolarHBondContact O-CB 3.4Å; E705-C709 PolarHBondContact O-N 2.98Å; E705-C709 PolarHBondContact O-SG 2.81Å
706	R	60.7	Low	68.6	Low	222 Å²	222	91.5 Å²	91.5	84%	0.838	43%	0.433	S	S	*	.	H	α-helix	trans	-65.4	-43.1	177.9	-66	-177.7	-177.4	169.3	1.9	111.3	N704 H710	N704-R706 PolarHBondContact O-N 3.06Å; N704-R706 PolarHBondContact OD1-N 3.18Å; R706-H710 VanDerWaalsContact O-CB 3.3Å; R706-H710 WeakPolarHBondContact O-CB 3.22Å; R706-H710 PolarHBondContact O-N 3.35Å
707	A	60.1	Low	68.6	Low	22 Å²	22	91.1 Å²	91.1	18%	0.182	43%	0.434	C	S	.	.	H	α-helix	trans	-68.4	-37.2	176.3	0	0	0	0	0	111.9	T701 N704 R711	T701-A707 HydrophobicContact CG2-CB 4.29Å; N704-A707 HydrophobicContact CB-CB 3.92Å; N704-A707 PolarHBondContact O-N 2.9Å; N704-A707 PolarHBondContact OD1-N 3.32Å; A707-R711 WeakPolarHBondContact O-CB 3.18Å; A707-R711 PolarHBondContact O-N 2.6Å
708	R	66.7	Low	69.1	Low	91 Å²	91	91.1 Å²	91.1	34%	0.343	44%	0.437	S	S	.	.	H	α-helix	trans	-61.1	-56.1	174.6	-162.4	-179.9	64.8	-151.2	-6.3	111.3	T701 N704 E705 H710 R711 E712	T701-R708 WeakPolarHBondContact O-CB 3.44Å; T701-R708 WeakPolarHBondContact O-CG 3.46Å; N704-R708 PolarHBondContact O-N 3.35Å; E705-R708 PolarHBondContact O-N 3.35Å; R708-H710 VanDerWaalsContact C-N 3.26Å; R708-H710 PolarHBondContact O-N 2.83Å; R708-R711 PolarHBondContact O-N 3.12Å; R708-R711 VanDerWaalsContact O-N 3.09Å; R708-E712 WeakPolarHBondContact CD-OE1 3.44Å; R708-E712 HydrophobicContact CG-CG 4.41Å; R708-E712 WeakPolarHBondContact CG-OE1 3.3Å; R708-E712 IonicContact NE-OE1 2.78Å; R708-E712 WeakPolarHBondContact O-CB 3.41Å; R708-E712 WeakPolarHBondContact O-CG 3.47Å; R708-E712 PolarHBondContact O-N 3.43Å
709	C	68.1	Low	69.8	Low	68 Å²	68	90.5 Å²	90.5	46%	0.459	43%	0.43	S	S	.	.	H	α-helix	trans	-58.4	-39.7	-179.9	-69.9	0	0	0	0	111.6	E705 A713	E705-C709 WeakPolarHBondContact O-CB 3.4Å; E705-C709 PolarHBondContact O-N 2.98Å; E705-C709 PolarHBondContact O-SG 2.81Å; C709-A713 VanDerWaalsContact O-CB 3.25Å; C709-A713 WeakPolarHBondContact O-CB 3.49Å; C709-A713 PolarHBondContact O-N 2.82Å
710	H	70.3	Confident	70.9	Confident	125 Å²	125	85.1 Å²	85.1	58%	0.579	41%	0.412	S	S	*	.	H	α-helix	trans	-64.5	-44.1	175.5	-176.6	-90.9	0	0	0	112.3	R706 R708 A713 L714	R706-H710 VanDerWaalsContact O-CB 3.3Å; R706-H710 WeakPolarHBondContact O-CB 3.22Å; R706-H710 PolarHBondContact O-N 3.35Å; R708-H710 VanDerWaalsContact C-N 3.26Å; R708-H710 PolarHBondContact O-N 2.83Å; H710-A713 PolarHBondContact O-N 2.69Å; H710-L714 VanDerWaalsContact CE1-CD1 3.46Å; H710-L714 WeakPolarHBondContact CE1-CD1 3.45Å; H710-L714 WeakPolarHBondContact O-CG 3.29Å; H710-L714 PolarHBondContact O-N 3.31Å
711	R	68.1	Low	71.5	Confident	139 Å²	139	90 Å²	90	53%	0.525	43%	0.434	S	S	.	.	H	α-helix	trans	-69.7	-41.1	179.5	-167.3	170.7	69.8	145.9	2.2	112.4	T701 A707 R708 A713 L714 E715	T701-R711 PolarHBondContact OG1-NH2 2.87Å; T701-R711 VanDerWaalsContact OG1-NH2 3.12Å; A707-R711 WeakPolarHBondContact O-CB 3.18Å; A707-R711 PolarHBondContact O-N 2.6Å; R708-R711 PolarHBondContact O-N 3.12Å; R708-R711 VanDerWaalsContact O-N 3.09Å; R711-A713 VanDerWaalsContact C-N 3.3Å; R711-A713 PolarHBondContact O-N 3.03Å; R711-L714 PolarHBondContact O-N 3.16Å; R711-E715 WeakPolarHBondContact O-CB 3.43Å; R711-E715 PolarHBondContact O-N 3.47Å
712	E	77.3	Confident	72.2	Confident	89 Å²	89	97.4 Å²	97.4	42%	0.416	46%	0.46	S	S	.	.	H	α-helix	trans	-62.4	-37.8	173.3	-72.9	174.2	-175.8	0	0	111.6	R708 R716	R708-E712 WeakPolarHBondContact CD-OE1 3.44Å; R708-E712 HydrophobicContact CG-CG 4.41Å; R708-E712 WeakPolarHBondContact CG-OE1 3.3Å; R708-E712 IonicContact NE-OE1 2.78Å; R708-E712 WeakPolarHBondContact O-CB 3.41Å; R708-E712 WeakPolarHBondContact O-CG 3.47Å; R708-E712 PolarHBondContact O-N 3.43Å; E712-R716 VanDerWaalsContact O-CB 3.29Å; E712-R716 WeakPolarHBondContact O-CB 3.3Å; E712-R716 PolarHBondContact O-N 2.88Å
713	A	78.6	Confident	72.7	Confident	40 Å²	40	99.5 Å²	99.5	33%	0.331	46%	0.463	S	S	.	.	H	α-helix	trans	-63.9	-46	173.4	0	0	0	0	0	111.7	C709 H710 R711 E715 R716 T717	C709-A713 VanDerWaalsContact O-CB 3.25Å; C709-A713 WeakPolarHBondContact O-CB 3.49Å; C709-A713 PolarHBondContact O-N 2.82Å; H710-A713 PolarHBondContact O-N 2.69Å; R711-A713 VanDerWaalsContact C-N 3.3Å; R711-A713 PolarHBondContact O-N 3.03Å; A713-E715 PolarHBondContact O-N 2.99Å; A713-R716 PolarHBondContact O-N 3.38Å; A713-T717 WeakPolarHBondContact O-CG2 3.29Å; A713-T717 PolarHBondContact O-N 2.93Å; A713-T717 PolarHBondContact O-OG1 3.32Å
714	L	79.6	Confident	73	Confident	92 Å²	92	103 Å²	103	48%	0.482	48%	0.476	S	S	.	.	H	α-helix	trans	-61.4	-41.9	175.9	-77.5	172.8	0	0	0	112.8	H710 R711 T717 A718	H710-L714 VanDerWaalsContact CE1-CD1 3.46Å; H710-L714 WeakPolarHBondContact CE1-CD1 3.45Å; H710-L714 WeakPolarHBondContact O-CG 3.29Å; H710-L714 PolarHBondContact O-N 3.31Å; R711-L714 PolarHBondContact O-N 3.16Å; L714-T717 VanDerWaalsContact CA-OG1 3.29Å; L714-T717 WeakPolarHBondContact CA-OG1 3.36Å; L714-T717 PolarHBondContact O-N 2.89Å; L714-T717 PolarHBondContact O-OG1 3.49Å; L714-A718 VanDerWaalsContact O-CB 3.3Å; L714-A718 WeakPolarHBondContact O-CB 3.5Å; L714-A718 PolarHBondContact O-N 3.27Å
715	E	79.5	Confident	73	Confident	102 Å²	102	106.5 Å²	106.5	48%	0.477	49%	0.491	S	S	.	.	H	α-helix	trans	-68.3	-38.3	178.1	-163.9	-172.3	152.5	0	0	111.3	R711 A713 A718 K719	R711-E715 WeakPolarHBondContact O-CB 3.43Å; R711-E715 PolarHBondContact O-N 3.47Å; A713-E715 PolarHBondContact O-N 2.99Å; E715-A718 PolarHBondContact O-N 2.66Å; E715-K719 HydrophobicContact CG-CD 4.43Å; E715-K719 WeakPolarHBondContact O-CB 3.39Å; E715-K719 WeakPolarHBondContact O-CG 3.39Å; E715-K719 PolarHBondContact O-N 3.28Å; E715-K719 WeakPolarHBondContact OE1-CE 3.33Å; E715-K719 IonicContact OE1-NZ 3.55Å; E715-K719 PolarHBondContact OE1-NZ 3.43Å
716	R	80.8	Confident	73.1	Confident	139 Å²	139	105.5 Å²	105.5	53%	0.525	49%	0.486	S	S	.	.	H	α-helix	trans	-62.1	-48.4	172.9	-170.5	-174.3	-64.3	106.2	1.1	110.8	E712 A713 A718 K719 E720	E712-R716 VanDerWaalsContact O-CB 3.29Å; E712-R716 WeakPolarHBondContact O-CB 3.3Å; E712-R716 PolarHBondContact O-N 2.88Å; A713-R716 PolarHBondContact O-N 3.38Å; R716-A718 VanDerWaalsContact C-N 3.32Å; R716-A718 PolarHBondContact O-N 3.01Å; R716-K719 PolarHBondContact O-N 3.5Å; R716-E720 WeakPolarHBondContact CG-OE1 3.47Å; R716-E720 WeakPolarHBondContact O-CB 3.25Å; R716-E720 WeakPolarHBondContact O-CG 3.5Å; R716-E720 PolarHBondContact O-N 2.95Å
717	T	80.9	Confident	73.1	Confident	66 Å²	66	101.5 Å²	101.5	41%	0.405	48%	0.477	S	S	.	.	H	α-helix	trans	-62.7	-38.6	176.9	51.4	0	0	0	0	111.9	A713 L714 E720 E721	A713-T717 WeakPolarHBondContact O-CG2 3.29Å; A713-T717 PolarHBondContact O-N 2.93Å; A713-T717 PolarHBondContact O-OG1 3.32Å; L714-T717 VanDerWaalsContact CA-OG1 3.29Å; L714-T717 WeakPolarHBondContact CA-OG1 3.36Å; L714-T717 PolarHBondContact O-N 2.89Å; L714-T717 PolarHBondContact O-OG1 3.49Å; T717-E720 PolarHBondContact O-N 3.1Å; T717-E721 WeakPolarHBondContact O-CB 3.37Å; T717-E721 WeakPolarHBondContact O-CG 3.45Å; T717-E721 PolarHBondContact O-N 3.13Å
718	A	81.1	Confident	73.2	Confident	44 Å²	44	108.1 Å²	108.1	36%	0.364	50%	0.502	S	S	.	.	H	α-helix	trans	-68.5	-38.1	177.4	0	0	0	0	0	112.5	L714 E715 R716 E721 R722	L714-A718 VanDerWaalsContact O-CB 3.3Å; L714-A718 WeakPolarHBondContact O-CB 3.5Å; L714-A718 PolarHBondContact O-N 3.27Å; E715-A718 PolarHBondContact O-N 2.66Å; R716-A718 VanDerWaalsContact C-N 3.32Å; R716-A718 PolarHBondContact O-N 3.01Å; A718-E721 PolarHBondContact O-N 3.46Å; A718-R722 WeakPolarHBondContact O-CB 3.34Å; A718-R722 WeakPolarHBondContact O-CG 3.35Å; A718-R722 PolarHBondContact O-N 3.08Å
719	K	77.1	Confident	72.7	Confident	116 Å²	116	112 Å²	112	50%	0.504	52%	0.523	S	S	.	.	H	α-helix	trans	-65.2	-44.5	172.4	-79.9	170.4	170.5	162.3	0	111.1	E715 R716 E721 R722 L723	E715-K719 HydrophobicContact CG-CD 4.43Å; E715-K719 WeakPolarHBondContact O-CB 3.39Å; E715-K719 WeakPolarHBondContact O-CG 3.39Å; E715-K719 PolarHBondContact O-N 3.28Å; E715-K719 WeakPolarHBondContact OE1-CE 3.33Å; E715-K719 IonicContact OE1-NZ 3.55Å; E715-K719 PolarHBondContact OE1-NZ 3.43Å; R716-K719 PolarHBondContact O-N 3.5Å; K719-E721 VanDerWaalsContact C-N 3.35Å; K719-R722 PolarHBondContact O-N 3.47Å; K719-L723 WeakPolarHBondContact O-CB 3.43Å; K719-L723 VanDerWaalsContact O-CG 3.29Å; K719-L723 WeakPolarHBondContact O-CG 3.45Å; K719-L723 PolarHBondContact O-N 2.78Å
720	E	79.9	Confident	72.3	Confident	89 Å²	89	114.9 Å²	114.9	42%	0.416	53%	0.534	S	S	.	.	H	α-helix	trans	-63	-39.5	174.7	-73.6	174	-165.5	0	0	111.9	R716 T717 R724	R716-E720 WeakPolarHBondContact CG-OE1 3.47Å; R716-E720 WeakPolarHBondContact O-CB 3.25Å; R716-E720 WeakPolarHBondContact O-CG 3.5Å; R716-E720 PolarHBondContact O-N 2.95Å; T717-E720 PolarHBondContact O-N 3.1Å; E720-R724 WeakPolarHBondContact O-CB 3.43Å; E720-R724 VanDerWaalsContact O-CG 3.23Å; E720-R724 WeakPolarHBondContact O-CG 3.42Å; E720-R724 PolarHBondContact O-N 3.03Å
721	E	76.5	Confident	72.2	Confident	118 Å²	118	110.7 Å²	110.7	55%	0.551	52%	0.516	S	S	*	.	H	α-helix	trans	-67	-41.4	174.6	-80.6	-175.4	168.8	0	0	112.4	T717 A718 K719 R724 Q725	T717-E721 WeakPolarHBondContact O-CB 3.37Å; T717-E721 WeakPolarHBondContact O-CG 3.45Å; T717-E721 PolarHBondContact O-N 3.13Å; A718-E721 PolarHBondContact O-N 3.46Å; K719-E721 VanDerWaalsContact C-N 3.35Å; E721-R724 CarbonylContact O-C 3.57Å; E721-R724 PolarHBondContact O-N 3.28Å; E721-Q725 WeakPolarHBondContact O-CB 3.48Å; E721-Q725 VanDerWaalsContact O-CG 3.3Å; E721-Q725 WeakPolarHBondContact O-CG 3.33Å; E721-Q725 PolarHBondContact O-N 2.88Å
722	R	75.4	Confident	72.4	Confident	175 Å²	175	107.3 Å²	107.3	66%	0.66	51%	0.505	S	S	*	.	H	α-helix	trans	-62.1	-46.9	173.7	-79.5	-175.8	-177.9	-171.6	1.5	111.6	A718 K719 R724 Q725 E726	A718-R722 WeakPolarHBondContact O-CB 3.34Å; A718-R722 WeakPolarHBondContact O-CG 3.35Å; A718-R722 PolarHBondContact O-N 3.08Å; K719-R722 PolarHBondContact O-N 3.47Å; R722-R724 VanDerWaalsContact C-N 3.31Å; R722-R724 PolarHBondContact O-N 2.89Å; R722-Q725 WeakPolarHBondContact O-CB 3.23Å; R722-Q725 PolarHBondContact O-N 3.41Å; R722-Q725 VanDerWaalsContact O-N 3.12Å; R722-E726 WeakPolarHBondContact O-CB 3.35Å; R722-E726 WeakPolarHBondContact O-CG 3.41Å; R722-E726 PolarHBondContact O-N 3.39Å
723	L	72.1	Confident	72.3	Confident	99 Å²	99	103 Å²	103	52%	0.518	49%	0.485	S	S	.	.	H	α-helix	trans	-60.2	-42.3	175.2	-72.3	168.7	0	0	0	110.9	K719 Q725 E726 E727	K719-L723 WeakPolarHBondContact O-CB 3.43Å; K719-L723 VanDerWaalsContact O-CG 3.29Å; K719-L723 WeakPolarHBondContact O-CG 3.45Å; K719-L723 PolarHBondContact O-N 2.78Å; L723-Q725 VanDerWaalsContact C-N 3.34Å; L723-Q725 PolarHBondContact O-N 3.16Å; L723-E726 PolarHBondContact O-N 3.3Å; L723-E727 WeakPolarHBondContact O-CB 3.4Å; L723-E727 VanDerWaalsContact O-CG 3.28Å; L723-E727 WeakPolarHBondContact O-CG 3.46Å; L723-E727 PolarHBondContact O-N 3.1Å
724	R	70.9	Confident	72.1	Confident	153 Å²	153	103 Å²	103	58%	0.577	48%	0.484	S	S	*	.	H	α-helix	trans	-64.5	-34.8	173.9	-77.6	175.9	-178.7	-177.6	4	113.2	E720 E721 R722 K728	E720-R724 WeakPolarHBondContact O-CB 3.43Å; E720-R724 VanDerWaalsContact O-CG 3.23Å; E720-R724 WeakPolarHBondContact O-CG 3.42Å; E720-R724 PolarHBondContact O-N 3.03Å; E721-R724 CarbonylContact O-C 3.57Å; E721-R724 PolarHBondContact O-N 3.28Å; R722-R724 VanDerWaalsContact C-N 3.31Å; R722-R724 PolarHBondContact O-N 2.89Å; R724-K728 WeakPolarHBondContact O-CB 3.42Å; R724-K728 VanDerWaalsContact O-CG 3.22Å; R724-K728 WeakPolarHBondContact O-CG 3.36Å; R724-K728 PolarHBondContact O-N 3.39Å
725	Q	65.2	Low	71.8	Confident	114 Å²	114	102.5 Å²	102.5	53%	0.533	49%	0.487	S	S	.	.	H	α-helix	trans	-69.8	-46.1	175.3	-77.7	173.8	-1	0	0	110.7	E721 R722 L723 E727 K728 E729	E721-Q725 WeakPolarHBondContact O-CB 3.48Å; E721-Q725 VanDerWaalsContact O-CG 3.3Å; E721-Q725 WeakPolarHBondContact O-CG 3.33Å; E721-Q725 PolarHBondContact O-N 2.88Å; R722-Q725 WeakPolarHBondContact O-CB 3.23Å; R722-Q725 PolarHBondContact O-N 3.41Å; R722-Q725 VanDerWaalsContact O-N 3.12Å; L723-Q725 VanDerWaalsContact C-N 3.34Å; L723-Q725 PolarHBondContact O-N 3.16Å; Q725-E727 VanDerWaalsContact C-N 3.3Å; Q725-E727 PolarHBondContact O-N 2.86Å; Q725-K728 PolarHBondContact O-N 3.45Å; Q725-K728 VanDerWaalsContact O-N 3.12Å; Q725-E729 WeakPolarHBondContact O-CG 3.46Å; Q725-E729 PolarHBondContact O-N 2.92Å
726	E	66.1	Low	71.6	Confident	112 Å²	112	98.9 Å²	98.9	52%	0.523	47%	0.471	S	S	.	.	H	α-helix	trans	-59	-40.7	174	-71.9	173.3	-173.8	0	0	111.4	R722 L723 L730	R722-E726 WeakPolarHBondContact O-CB 3.35Å; R722-E726 WeakPolarHBondContact O-CG 3.41Å; R722-E726 PolarHBondContact O-N 3.39Å; L723-E726 PolarHBondContact O-N 3.3Å; E726-L730 WeakPolarHBondContact O-CD1 3.43Å; E726-L730 VanDerWaalsContact O-CG 3.31Å; E726-L730 WeakPolarHBondContact O-CG 3.29Å; E726-L730 PolarHBondContact O-N 2.97Å
727	E	61.1	Low	71.2	Confident	139 Å²	139	93 Å²	93	65%	0.65	45%	0.45	S	S	*	.	H	α-helix	trans	-65.4	-39.7	173.5	-76.4	177.1	170.4	0	0	112.7	L723 Q725 L730	L723-E727 WeakPolarHBondContact O-CB 3.4Å; L723-E727 VanDerWaalsContact O-CG 3.28Å; L723-E727 WeakPolarHBondContact O-CG 3.46Å; L723-E727 PolarHBondContact O-N 3.1Å; Q725-E727 VanDerWaalsContact C-N 3.3Å; Q725-E727 PolarHBondContact O-N 2.86Å; E727-L730 PolarHBondContact O-N 2.92Å
728	K	61.4	Low	70.9	Confident	161 Å²	161	92.7 Å²	92.7	70%	0.7	45%	0.453	S	S	*	.	H	α-helix	trans	-70	-37.4	177.1	-78.1	175	-178.5	-175.2	0	112.9	R724 Q725 L730 D731	R724-K728 WeakPolarHBondContact O-CB 3.42Å; R724-K728 VanDerWaalsContact O-CG 3.22Å; R724-K728 WeakPolarHBondContact O-CG 3.36Å; R724-K728 PolarHBondContact O-N 3.39Å; Q725-K728 PolarHBondContact O-N 3.45Å; Q725-K728 VanDerWaalsContact O-N 3.12Å; K728-L730 PolarHBondContact O-N 3.27Å; K728-D731 PolarHBondContact O-N 3.44Å
729	E	57.4	Low	70.3	Confident	171 Å²	171	98.1 Å²	98.1	80%	0.799	47%	0.471	S	S	*	.	H	α-helix	trans	-67.7	-20.3	176.6	-74.2	-174.6	175.6	0	0	112.7	Q725	Q725-E729 WeakPolarHBondContact O-CG 3.46Å; Q725-E729 PolarHBondContact O-N 2.92Å
730	L	58.4	Low	69.9	Low	130 Å²	130	96.8 Å²	96.8	68%	0.681	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.5	-4.7	175.3	-71.3	166.8	0	0	0	114	E726 E727 K728 F732	E726-L730 WeakPolarHBondContact O-CD1 3.43Å; E726-L730 VanDerWaalsContact O-CG 3.31Å; E726-L730 WeakPolarHBondContact O-CG 3.29Å; E726-L730 PolarHBondContact O-N 2.97Å; E727-L730 PolarHBondContact O-N 2.92Å; K728-L730 PolarHBondContact O-N 3.27Å; L730-F732 WeakPolarHBondContact O-CD1 3.43Å; L730-F732 PolarHBondContact O-N 2.81Å
731	D	69.5	Low	69.3	Low	36 Å²	36	95.5 Å²	95.5	19%	0.193	48%	0.48	C	S	.	.			trans	-84.8	92.9	-179.9	-164.9	-23.5	0	0	0	111.5	K728 L733 A734 R847	K728-D731 PolarHBondContact O-N 3.44Å; D731-L733 PolarHBondContact O-N 2.96Å; D731-L733 PolarHBondContact OD1-N 3.02Å; D731-A734 HydrophobicContact CB-CB 3.92Å; D731-A734 PolarHBondContact OD1-N 2.9Å; D731-R847 IonicContact OD1-NH1 3.29Å; D731-R847 PolarHBondContact OD1-NH1 3.28Å; D731-R847 IonicContact OD2-CZ 3.09Å; D731-R847 IonicContact OD2-NH1 3.48Å; D731-R847 PolarHBondContact OD2-NH1 3.47Å; D731-R847 IonicContact OD2-NH2 2.71Å; D731-R847 PolarHBondContact OD2-NH2 3.35Å; D731-R847 VanDerWaalsContact OD2-NH2 3.09Å
732	F	71.1	Confident	68.7	Low	68 Å²	68	95.1 Å²	95.1	30%	0.298	48%	0.481	S	S	.	.	S	Bend	trans	-70.3	-11.1	178.8	44.6	-90.8	0	0	0	114	L730 C758 L838 L842	L730-F732 WeakPolarHBondContact O-CD1 3.43Å; L730-F732 PolarHBondContact O-N 2.81Å; F732-C758 PolarHBondContact O-SG 3.45Å; F732-C758 VanDerWaalsContact O-SG 3.4Å; F732-L838 HydrophobicContact CD2-CD1 3.98Å; F732-L838 HydrophobicContact CE2-CD1 4.34Å; F732-L838 HydrophobicContact CG-CD1 4.14Å; F732-L842 HydrophobicContact CD2-CD2 3.95Å; F732-L842 HydrophobicContact CE2-CD2 3.67Å; F732-L842 HydrophobicContact CE2-CG 4.34Å
733	L	75.5	Confident	68.3	Low	0 Å²	0	89.5 Å²	89.5	0%	0	47%	0.468	C	S	.	.	S	Bend	trans	-99.5	-25.3	178.7	-71.8	171.4	0	0	0	113	D731 L736 L737 L754 C758 L842 L848	D731-L733 PolarHBondContact O-N 2.96Å; D731-L733 PolarHBondContact OD1-N 3.02Å; L733-L736 PolarHBondContact O-N 3.12Å; L733-L736 VanDerWaalsContact O-N 3.09Å; L733-L737 HydrophobicContact CB-CD1 4.09Å; L733-L737 WeakPolarHBondContact O-CG 3.44Å; L733-L737 PolarHBondContact O-N 3.4Å; L733-L754 HydrophobicContact CD2-CD2 3.84Å; L733-L754 HydrophobicContact CD2-CG 3.97Å; L733-C758 HydrophobicContact CD2-CB 4.28Å; L733-L842 HydrophobicContact CD1-CD2 4.08Å; L733-L842 HydrophobicContact CD2-CD2 3.65Å; L733-L842 HydrophobicContact CG-CD2 4.02Å; L733-L848 HydrophobicContact CD1-CD1 3.67Å; L733-L848 HydrophobicContact CD1-CG 4.13Å; L733-L848 HydrophobicContact CD2-CD1 3.96Å; L733-L848 HydrophobicContact CG-CD1 4.47Å
734	A	73.6	Confident	67.8	Low	38 Å²	38	94 Å²	94	31%	0.314	49%	0.486	S	S	.	.	H	α-helix	trans	-53.4	-44.2	-176.5	0	0	0	0	0	115	D731 L736 L737 A738	D731-A734 HydrophobicContact CB-CB 3.92Å; D731-A734 PolarHBondContact OD1-N 2.9Å; A734-L736 VanDerWaalsContact C-N 3.28Å; A734-L736 PolarHBondContact O-N 3.42Å; A734-L737 PolarHBondContact O-N 2.83Å; A734-A738 WeakPolarHBondContact O-CB 3.22Å; A734-A738 PolarHBondContact O-N 2.79Å
735	P	74.3	Confident	67.5	Low	83 Å²	83	93.2 Å²	93.2	54%	0.539	49%	0.493	S	S	.	.	H	α-helix	trans	-65.4	-30.6	178.6	-21.8	34	0	0	0	113.7	Q739	P735-Q739 WeakPolarHBondContact O-CG 3.47Å; P735-Q739 PolarHBondContact O-N 3.03Å
736	L	74.6	Confident	67.7	Low	25 Å²	25	88.8 Å²	88.8	13%	0.131	47%	0.473	C	S	.	.	H	α-helix	trans	-83.2	-32.6	-179.7	-64.6	166.6	0	0	0	111.5	L733 A734 Q739 L740 L754 D757 C758	L733-L736 PolarHBondContact O-N 3.12Å; L733-L736 VanDerWaalsContact O-N 3.09Å; A734-L736 VanDerWaalsContact C-N 3.28Å; A734-L736 PolarHBondContact O-N 3.42Å; L736-Q739 PolarHBondContact O-N 2.99Å; L736-L740 PolarHBondContact O-N 3.35Å; L736-L754 HydrophobicContact CB-CD1 3.45Å; L736-L754 VanDerWaalsContact CB-CD1 3.45Å; L736-D757 HydrophobicContact CD2-CB 4.44Å; L736-C758 HydrophobicContact CD1-CB 3.42Å; L736-C758 VanDerWaalsContact CD1-CB 3.42Å
737	L	74.1	Confident	68.2	Low	17 Å²	17	87.8 Å²	87.8	9%	0.089	48%	0.475	C	S	.	.	H	α-helix	trans	-67.8	-40.1	172	-72.8	169.4	0	0	0	112	L733 A734 Q739 L740 G741 D742 L746 L754	L733-L737 HydrophobicContact CB-CD1 4.09Å; L733-L737 WeakPolarHBondContact O-CG 3.44Å; L733-L737 PolarHBondContact O-N 3.4Å; A734-L737 PolarHBondContact O-N 2.83Å; L737-Q739 VanDerWaalsContact C-N 3.28Å; L737-Q739 PolarHBondContact O-N 3.06Å; L737-L740 CarbonylContact O-C 3.55Å; L737-L740 WeakPolarHBondContact O-CA 3.36Å; L737-L740 WeakPolarHBondContact O-CB 3.42Å; L737-L740 PolarHBondContact O-N 3.13Å; L737-G741 PolarHBondContact O-N 3.21Å; L737-D742 VanDerWaalsContact C-OD1 3.31Å; L737-D742 PolarHBondContact O-N 3.21Å; L737-L746 HydrophobicContact CD2-CD1 4.13Å; L737-L746 HydrophobicContact CD2-CD2 4.17Å; L737-L754 HydrophobicContact CD2-CD1 4.23Å; L737-L754 HydrophobicContact CD2-CD2 3.5Å; L737-L754 VanDerWaalsContact CD2-CD2 3.5Å; L737-L754 HydrophobicContact CG-CD1 4.36Å; L737-L754 HydrophobicContact CG-CD2 3.9Å
738	A	72.6	Confident	69	Low	58 Å²	58	88.5 Å²	88.5	48%	0.479	47%	0.472	S	S	.	.	H	α-helix	trans	-61.6	-34.9	175.4	0	0	0	0	0	112.6	A734 L740 G741 D742	A734-A738 WeakPolarHBondContact O-CB 3.22Å; A734-A738 PolarHBondContact O-N 2.79Å; A738-L740 VanDerWaalsContact C-N 3.25Å; A738-L740 PolarHBondContact O-N 2.86Å; A738-G741 PolarHBondContact O-N 2.92Å; A738-D742 PolarHBondContact N-OD1 3.31Å
739	Q	70.2	Confident	69.8	Low	159 Å²	159	88.1 Å²	88.1	74%	0.743	47%	0.472	S	S	*	.	H	α-helix	trans	-67.5	-25	174.2	-72.6	177	7.9	0	0	113.1	P735 L736 L737	P735-Q739 WeakPolarHBondContact O-CG 3.47Å; P735-Q739 PolarHBondContact O-N 3.03Å; L736-Q739 PolarHBondContact O-N 2.99Å; L737-Q739 VanDerWaalsContact C-N 3.28Å; L737-Q739 PolarHBondContact O-N 3.06Å
740	L	68.7	Low	70.6	Confident	87 Å²	87	80.9 Å²	80.9	46%	0.455	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-0.1	176	-65.8	171.1	0	0	0	113.1	L736 L737 A738 L754	L736-L740 PolarHBondContact O-N 3.35Å; L737-L740 CarbonylContact O-C 3.55Å; L737-L740 WeakPolarHBondContact O-CA 3.36Å; L737-L740 WeakPolarHBondContact O-CB 3.42Å; L737-L740 PolarHBondContact O-N 3.13Å; A738-L740 VanDerWaalsContact C-N 3.25Å; A738-L740 PolarHBondContact O-N 2.86Å; L740-L754 HydrophobicContact CD1-CD1 3.79Å
741	G	66.8	Low	71.5	Confident	62 Å²	62	74.7 Å²	74.7	64%	0.639	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.5	27.4	178.7	0	0	0	0	0	114.9	L737 A738	L737-G741 PolarHBondContact O-N 3.21Å; A738-G741 PolarHBondContact O-N 2.92Å
742	D	63.3	Low	72	Confident	110 Å²	110	76 Å²	76	59%	0.588	42%	0.416	S	S	*	.			trans	47.5	63	176.3	-66.9	-33.5	0	0	0	114.8	L737 A738 E744	L737-D742 VanDerWaalsContact C-OD1 3.31Å; L737-D742 PolarHBondContact O-N 3.21Å; A738-D742 PolarHBondContact N-OD1 3.31Å; D742-E744 PolarHBondContact O-N 3.49Å
743	P	67.8	Low	72.5	Confident	58 Å²	58	78.4 Å²	78.4	38%	0.377	43%	0.428	S	S	.	.			trans	-68.2	131.5	179.3	27.1	-33.3	0	0	0	112.2	N745	P743-N745 PolarHBondContact O-N 2.88Å; P743-N745 VanDerWaalsContact O-N 3.16Å
744	E	60.8	Low	72.8	Confident	194 Å²	194	78.5 Å²	78.5	91%	0.907	43%	0.429	S	S	*	.	S	Bend	trans	-60.7	-24.5	179.2	-70	-173.4	164	0	0	113.8	D742	D742-E744 PolarHBondContact O-N 3.49Å
745	N	64.1	Low	73.3	Confident	135 Å²	135	78.5 Å²	78.5	72%	0.722	42%	0.42	S	S	*	.	S	Bend	trans	-135.7	119.3	175	-72.2	-58.8	0	0	0	110.3	P743	P743-N745 PolarHBondContact O-N 2.88Å; P743-N745 VanDerWaalsContact O-N 3.16Å
746	L	70.9	Confident	73.8	Confident	22 Å²	22	78.8 Å²	78.8	12%	0.115	42%	0.417	C	S	.	.			trans	-75.9	128.1	174.7	-82.3	135.4	0	0	0	110.2	L737 A750 L754 H851	L737-L746 HydrophobicContact CD2-CD1 4.13Å; L737-L746 HydrophobicContact CD2-CD2 4.17Å; L746-A750 HydrophobicContact CD2-CB 4.19Å; L746-L754 HydrophobicContact CD2-CD2 4.33Å; L746-H851 PolarHBondContact O-CE1 3.19Å; L746-H851 PolarHBondContact O-ND1 3.46Å; L746-H851 PolarHBondContact O-NE2 2.95Å
747	T	77.1	Confident	74.3	Confident	90 Å²	90	81.8 Å²	81.8	55%	0.552	43%	0.434	S	S	*	.			trans	-73.6	152.9	167.5	60.7	0	0	0	0	109.8	Q749 A750 A751	T747-Q749 PolarHBondContact O-N 2.87Å; T747-Q749 VanDerWaalsContact O-N 3.13Å; T747-A750 PolarHBondContact O-N 3.22Å; T747-A750 WeakPolarHBondContact OG1-CB 3.31Å; T747-A750 PolarHBondContact OG1-N 2.9Å; T747-A751 PolarHBondContact O-N 3.44Å
748	R	76.9	Confident	74.8	Confident	155 Å²	155	81.2 Å²	81.2	59%	0.585	43%	0.431	S	S	*	.	H	α-helix	trans	-53.2	-35.7	177.4	176.8	164.2	-169.9	-175.8	8.2	113.2	L752 H851	R748-L752 HydrophobicContact CG-CD1 4.32Å; R748-L752 WeakPolarHBondContact O-CG 3.32Å; R748-L752 PolarHBondContact O-N 2.95Å; R748-H851 VanDerWaalsContact CG-O 3.29Å; R748-H851 WeakPolarHBondContact CG-O 3.23Å
749	Q	77.4	Confident	75.5	Confident	153 Å²	153	78.9 Å²	78.9	72%	0.715	41%	0.411	S	S	*	.	H	α-helix	trans	-70.6	-43.9	176.6	-71	179.9	-17.9	0	0	112.1	T747 L752 Q753	T747-Q749 PolarHBondContact O-N 2.87Å; T747-Q749 VanDerWaalsContact O-N 3.13Å; Q749-L752 PolarHBondContact O-N 3.47Å; Q749-Q753 WeakPolarHBondContact O-CG 3.44Å; Q749-Q753 PolarHBondContact O-N 2.76Å
750	A	75.6	Confident	76.3	Confident	19 Å²	19	73.9 Å²	73.9	16%	0.157	40%	0.396	C	S	.	.	H	α-helix	trans	-64.8	-38.9	176.5	0	0	0	0	0	112.1	L746 T747 L752 Q753 L754	L746-A750 HydrophobicContact CD2-CB 4.19Å; T747-A750 PolarHBondContact O-N 3.22Å; T747-A750 WeakPolarHBondContact OG1-CB 3.31Å; T747-A750 PolarHBondContact OG1-N 2.9Å; A750-L752 PolarHBondContact O-N 3.43Å; A750-Q753 PolarHBondContact O-N 2.85Å; A750-L754 VanDerWaalsContact O-CB 3.31Å; A750-L754 WeakPolarHBondContact O-CB 3.5Å; A750-L754 PolarHBondContact O-N 2.86Å
751	A	77.4	Confident	77.1	Confident	0 Å²	0	72.7 Å²	72.7	0%	0	39%	0.391	C	S	.	.	H	α-helix	trans	-63.9	-39.9	175.5	0	0	0	0	0	112.6	T747 R755 L848 H851 L852	T747-A751 PolarHBondContact O-N 3.44Å; A751-R755 PolarHBondContact O-N 3.12Å; A751-L848 HydrophobicContact CB-CD2 3.75Å; A751-H851 HydrophobicContact CB-CB 3.61Å; A751-L852 HydrophobicContact CB-CD2 4.16Å; A751-L852 HydrophobicContact CB-CG 4.42Å
752	L	79.9	Confident	78	Confident	64 Å²	64	71.7 Å²	71.7	34%	0.335	37%	0.37	S	S	.	.	H	α-helix	trans	-66.1	-42.2	174.8	-79.4	166	0	0	0	112	R748 Q749 A750 N756 L852	R748-L752 HydrophobicContact CG-CD1 4.32Å; R748-L752 WeakPolarHBondContact O-CG 3.32Å; R748-L752 PolarHBondContact O-N 2.95Å; Q749-L752 PolarHBondContact O-N 3.47Å; A750-L752 PolarHBondContact O-N 3.43Å; L752-N756 WeakPolarHBondContact O-CB 3.43Å; L752-N756 PolarHBondContact O-N 2.86Å; L752-N756 PolarHBondContact O-ND2 2.96Å; L752-L852 HydrophobicContact CB-CD2 4.25Å; L752-L852 HydrophobicContact CD2-CD2 3.46Å; L752-L852 VanDerWaalsContact CD2-CD2 3.46Å; L752-L852 HydrophobicContact CG-CD2 3.63Å
753	Q	81.3	Confident	79.2	Confident	118 Å²	118	72 Å²	72	55%	0.551	37%	0.366	S	S	*	.	H	α-helix	trans	-62.4	-48.7	174.9	-75	175.6	-25.8	0	0	110.9	Q749 A750 R755 N756 D757	Q749-Q753 WeakPolarHBondContact O-CG 3.44Å; Q749-Q753 PolarHBondContact O-N 2.76Å; A750-Q753 PolarHBondContact O-N 2.85Å; Q753-R755 VanDerWaalsContact C-N 3.32Å; Q753-R755 PolarHBondContact O-N 3.41Å; Q753-N756 PolarHBondContact O-N 3.39Å; Q753-D757 WeakPolarHBondContact O-CB 3.3Å; Q753-D757 VanDerWaalsContact O-CG 3.23Å; Q753-D757 PolarHBondContact O-N 2.99Å
754	L	82	Confident	80.2	Confident	2 Å²	2	73.8 Å²	73.8	1%	0.01	37%	0.37	C	S	.	.	H	α-helix	trans	-57.2	-43.9	178.9	-166.4	75.5	0	0	0	112.4	L733 L736 L737 L740 L746 A750 C758 L848	L733-L754 HydrophobicContact CD2-CD2 3.84Å; L733-L754 HydrophobicContact CD2-CG 3.97Å; L736-L754 HydrophobicContact CB-CD1 3.45Å; L736-L754 VanDerWaalsContact CB-CD1 3.45Å; L737-L754 HydrophobicContact CD2-CD1 4.23Å; L737-L754 HydrophobicContact CD2-CD2 3.5Å; L737-L754 VanDerWaalsContact CD2-CD2 3.5Å; L737-L754 HydrophobicContact CG-CD1 4.36Å; L737-L754 HydrophobicContact CG-CD2 3.9Å; L740-L754 HydrophobicContact CD1-CD1 3.79Å; L746-L754 HydrophobicContact CD2-CD2 4.33Å; A750-L754 VanDerWaalsContact O-CB 3.31Å; A750-L754 WeakPolarHBondContact O-CB 3.5Å; A750-L754 PolarHBondContact O-N 2.86Å; L754-C758 WeakPolarHBondContact O-CB 3.4Å; L754-C758 PolarHBondContact O-N 3.14Å; L754-L848 HydrophobicContact CD2-CD2 4.06Å
755	R	83.9	Confident	81.4	Confident	37 Å²	37	72 Å²	72	14%	0.14	36%	0.355	C	S	.	.	H	α-helix	trans	-60.9	-47.1	174.1	171.7	175.2	171.3	-144.9	0.1	111.7	A751 Q753 C758 L759 D839 L842 L852	A751-R755 PolarHBondContact O-N 3.12Å; Q753-R755 VanDerWaalsContact C-N 3.32Å; Q753-R755 PolarHBondContact O-N 3.41Å; R755-C758 PolarHBondContact O-N 3.28Å; R755-L759 HydrophobicContact CG-CD1 4.01Å; R755-L759 WeakPolarHBondContact O-CB 3.31Å; R755-L759 WeakPolarHBondContact O-CG 3.38Å; R755-L759 PolarHBondContact O-N 3.06Å; R755-D839 IonicContact CZ-OD1 3.29Å; R755-D839 VanDerWaalsContact CZ-OD1 3.29Å; R755-D839 IonicContact NE-OD1 3.03Å; R755-D839 PolarHBondContact NE-OD1 3.26Å; R755-D839 IonicContact NH2-OD1 2.72Å; R755-D839 PolarHBondContact NH2-OD1 3.5Å; R755-D839 IonicContact NH2-OD2 3.44Å; R755-D839 PolarHBondContact NH2-OD2 3.03Å; R755-L842 HydrophobicContact CG-CD1 4.35Å; R755-L852 HydrophobicContact CB-CD1 4.2Å; R755-L852 HydrophobicContact CG-CD1 4.49Å
756	N	84.6	Confident	82.6	Confident	89 Å²	89	66.7 Å²	66.7	48%	0.476	33%	0.326	S	S	.	.	H	α-helix	trans	-65.3	-41.6	-177.7	-71.4	-20.1	0	0	0	111.3	L752 Q753 L759 A760	L752-N756 WeakPolarHBondContact O-CB 3.43Å; L752-N756 PolarHBondContact O-N 2.86Å; L752-N756 PolarHBondContact O-ND2 2.96Å; Q753-N756 PolarHBondContact O-N 3.39Å; N756-L759 PolarHBondContact O-N 3.45Å; N756-A760 WeakPolarHBondContact O-CB 3.42Å; N756-A760 PolarHBondContact O-N 3.42Å
757	D	84.3	Confident	83.4	Confident	88 Å²	88	68.8 Å²	68.8	47%	0.471	34%	0.337	S	S	.	.	H	α-helix	trans	-66.8	-41.3	178.7	-65	-21.2	0	0	0	111.2	L736 Q753 A760 D761	L736-D757 HydrophobicContact CD2-CB 4.44Å; Q753-D757 WeakPolarHBondContact O-CB 3.3Å; Q753-D757 VanDerWaalsContact O-CG 3.23Å; Q753-D757 PolarHBondContact O-N 2.99Å; D757-A760 PolarHBondContact O-N 2.92Å; D757-D761 WeakPolarHBondContact O-CB 3.37Å; D757-D761 PolarHBondContact O-N 3.37Å
758	C	84.3	Confident	83.9	Confident	6 Å²	6	68.2 Å²	68.2	4%	0.041	33%	0.331	C	S	.	.	H	α-helix	trans	-65.9	-40.9	177.5	-156.4	0	0	0	0	112	F732 L733 L736 L754 R755 L762 L842	F732-C758 PolarHBondContact O-SG 3.45Å; F732-C758 VanDerWaalsContact O-SG 3.4Å; L733-C758 HydrophobicContact CD2-CB 4.28Å; L736-C758 HydrophobicContact CD1-CB 3.42Å; L736-C758 VanDerWaalsContact CD1-CB 3.42Å; L754-C758 WeakPolarHBondContact O-CB 3.4Å; L754-C758 PolarHBondContact O-N 3.14Å; R755-C758 PolarHBondContact O-N 3.28Å; C758-L762 PolarHBondContact O-N 3.03Å; C758-L762 VanDerWaalsContact O-N 3.16Å; C758-L842 HydrophobicContact CB-CD1 4.31Å
759	L	87.3	Confident	84.3	Confident	8 Å²	8	66.2 Å²	66.2	4%	0.042	33%	0.326	C	S	.	.	H	α-helix	trans	-69.7	-37.4	173.2	-71.4	175.7	0	0	0	112.4	R755 N756 K763 Y835 L838 D839 L842	R755-L759 HydrophobicContact CG-CD1 4.01Å; R755-L759 WeakPolarHBondContact O-CB 3.31Å; R755-L759 WeakPolarHBondContact O-CG 3.38Å; R755-L759 PolarHBondContact O-N 3.06Å; N756-L759 PolarHBondContact O-N 3.45Å; L759-K763 VanDerWaalsContact O-CB 3.3Å; L759-K763 WeakPolarHBondContact O-CB 3.47Å; L759-K763 PolarHBondContact O-N 3.5Å; L759-Y835 HydrophobicContact CB-CE2 3.98Å; L759-Y835 HydrophobicContact CD2-CE2 4.16Å; L759-Y835 WeakPolarHBondContact O-CE2 3.22Å; L759-L838 HydrophobicContact CD2-CB 4.45Å; L759-L838 HydrophobicContact CD2-CD2 4.26Å; L759-L838 HydrophobicContact CD2-CG 4.28Å; L759-D839 HydrophobicContact CD1-CB 4.36Å; L759-D839 WeakPolarHBondContact CD1-OD1 3.28Å; L759-D839 HydrophobicContact CD2-CB 4.04Å; L759-L842 HydrophobicContact CD2-CD1 3.84Å; L759-L842 HydrophobicContact CG-CD1 3.82Å
760	A	87.2	Confident	84.8	Confident	54 Å²	54	60 Å²	60	45%	0.446	30%	0.3	S	S	.	.	H	α-helix	trans	-65.3	-43.3	177	0	0	0	0	0	111.7	N756 D757 K763 Q764	N756-A760 WeakPolarHBondContact O-CB 3.42Å; N756-A760 PolarHBondContact O-N 3.42Å; D757-A760 PolarHBondContact O-N 2.92Å; A760-K763 WeakPolarHBondContact O-CB 3.41Å; A760-K763 PolarHBondContact O-N 3.46Å; A760-Q764 WeakPolarHBondContact O-CB 3.49Å; A760-Q764 PolarHBondContact O-N 2.91Å
761	D	86.6	Confident	85.5	Confident	63 Å²	63	63.5 Å²	63.5	34%	0.337	32%	0.317	S	S	.	.	H	α-helix	trans	-62.3	-47	175.9	-179.8	49.2	0	0	0	111.4	D757 K763 Q764 R765	D757-D761 WeakPolarHBondContact O-CB 3.37Å; D757-D761 PolarHBondContact O-N 3.37Å; D761-K763 VanDerWaalsContact C-N 3.31Å; D761-K763 PolarHBondContact O-N 2.89Å; D761-Q764 PolarHBondContact O-N 3.29Å; D761-R765 WeakPolarHBondContact O-CG 3.44Å; D761-R765 PolarHBondContact O-N 3.38Å; D761-R765 IonicContact OD1-CZ 3.72Å; D761-R765 IonicContact OD1-NE 3.95Å; D761-R765 PolarHBondContact OD1-NE 3.26Å; D761-R765 IonicContact OD1-NH2 2.99Å; D761-R765 IonicContact OD2-CZ 2.86Å; D761-R765 IonicContact OD2-NE 2.73Å; D761-R765 PolarHBondContact OD2-NE 2.87Å; D761-R765 IonicContact OD2-NH2 2.79Å; D761-R765 PolarHBondContact OD2-NH2 3.44Å
762	L	86.3	Confident	86	Confident	40 Å²	40	67.9 Å²	67.9	21%	0.209	34%	0.339	C	S	.	.	H	α-helix	trans	-59.7	-43.8	174.9	179.9	65.7	0	0	0	111.5	C758 Q764 R765 L766 L838	C758-L762 PolarHBondContact O-N 3.03Å; C758-L762 VanDerWaalsContact O-N 3.16Å; L762-Q764 VanDerWaalsContact C-N 3.33Å; L762-Q764 PolarHBondContact O-N 2.95Å; L762-R765 PolarHBondContact O-N 3.02Å; L762-L766 HydrophobicContact CD1-CD1 4.37Å; L762-L766 HydrophobicContact CD1-CG 4.32Å; L762-L766 HydrophobicContact CD2-CD1 4.46Å; L762-L766 HydrophobicContact CG-CD1 4.02Å; L762-L766 HydrophobicContact CG-CG 4.4Å; L762-L766 VanDerWaalsContact O-CG 3.28Å; L762-L766 WeakPolarHBondContact O-CG 3.34Å; L762-L766 PolarHBondContact O-N 2.93Å; L762-L838 HydrophobicContact CB-CD2 3.79Å; L762-L838 HydrophobicContact CD2-CB 3.66Å; L762-L838 HydrophobicContact CD2-CD2 3.38Å; L762-L838 HydrophobicContact CD2-CG 4.13Å; L762-L838 HydrophobicContact CG-CD2 4.1Å
763	K	88.1	Confident	86.4	Confident	117 Å²	117	66 Å²	66	51%	0.509	33%	0.329	S	S	.	.	H	α-helix	trans	-59.5	-45.5	177.7	-178.8	-178.9	176	-175.2	0	111	L759 A760 D761 L766 I767 Y835	L759-K763 VanDerWaalsContact O-CB 3.3Å; L759-K763 WeakPolarHBondContact O-CB 3.47Å; L759-K763 PolarHBondContact O-N 3.5Å; A760-K763 WeakPolarHBondContact O-CB 3.41Å; A760-K763 PolarHBondContact O-N 3.46Å; D761-K763 VanDerWaalsContact C-N 3.31Å; D761-K763 PolarHBondContact O-N 2.89Å; K763-L766 PolarHBondContact O-N 3.31Å; K763-I767 HydrophobicContact CG-CD1 3.95Å; K763-I767 VanDerWaalsContact O-CG1 3.3Å; K763-I767 WeakPolarHBondContact O-CG1 3.41Å; K763-I767 PolarHBondContact O-N 3.46Å; K763-Y835 HydrophobicContact CB-CD2 4.28Å; K763-Y835 HydrophobicContact CB-CE2 4.02Å
764	Q	88.2	Confident	86.8	Confident	96 Å²	96	63.1 Å²	63.1	45%	0.449	32%	0.316	S	S	.	.	H	α-helix	trans	-62.5	-46.7	178.8	-169.2	59.6	29.5	0	0	111.2	A760 D761 L762 L766 I767 D768	A760-Q764 WeakPolarHBondContact O-CB 3.49Å; A760-Q764 PolarHBondContact O-N 2.91Å; D761-Q764 PolarHBondContact O-N 3.29Å; L762-Q764 VanDerWaalsContact C-N 3.33Å; L762-Q764 PolarHBondContact O-N 2.95Å; Q764-L766 VanDerWaalsContact C-N 3.31Å; Q764-L766 PolarHBondContact O-N 3.06Å; Q764-I767 WeakPolarHBondContact O-CB 3.29Å; Q764-I767 PolarHBondContact O-N 3.25Å; Q764-D768 PolarHBondContact NE2-OD1 2.95Å; Q764-D768 VanDerWaalsContact O-CG 3.24Å; Q764-D768 PolarHBondContact O-N 3.47Å
765	R	86.1	Confident	87.2	Confident	156 Å²	156	65 Å²	65	59%	0.589	33%	0.332	S	S	*	.	H	α-helix	trans	-59.7	-38.5	176.3	-68	178.5	-166.4	-166.3	5.2	113	D761 L762 K769	D761-R765 WeakPolarHBondContact O-CG 3.44Å; D761-R765 PolarHBondContact O-N 3.38Å; D761-R765 IonicContact OD1-CZ 3.72Å; D761-R765 IonicContact OD1-NE 3.95Å; D761-R765 PolarHBondContact OD1-NE 3.26Å; D761-R765 IonicContact OD1-NH2 2.99Å; D761-R765 IonicContact OD2-CZ 2.86Å; D761-R765 IonicContact OD2-NE 2.73Å; D761-R765 PolarHBondContact OD2-NE 2.87Å; D761-R765 IonicContact OD2-NH2 2.79Å; D761-R765 PolarHBondContact OD2-NH2 3.44Å; L762-R765 PolarHBondContact O-N 3.02Å; R765-K769 VanDerWaalsContact O-CB 3.27Å; R765-K769 WeakPolarHBondContact O-CB 3.21Å; R765-K769 PolarHBondContact O-N 3.32Å
766	L	88.4	Confident	87.4	Confident	23 Å²	23	69.2 Å²	69.2	12%	0.12	35%	0.348	C	S	.	.	H	α-helix	trans	-66.8	-39.2	175.5	-70.6	171.4	0	0	0	111.4	L762 K763 Q764 A770 H827 A831 K834	L762-L766 HydrophobicContact CD1-CD1 4.37Å; L762-L766 HydrophobicContact CD1-CG 4.32Å; L762-L766 HydrophobicContact CD2-CD1 4.46Å; L762-L766 HydrophobicContact CG-CD1 4.02Å; L762-L766 HydrophobicContact CG-CG 4.4Å; L762-L766 VanDerWaalsContact O-CG 3.28Å; L762-L766 WeakPolarHBondContact O-CG 3.34Å; L762-L766 PolarHBondContact O-N 2.93Å; K763-L766 PolarHBondContact O-N 3.31Å; Q764-L766 VanDerWaalsContact C-N 3.31Å; Q764-L766 PolarHBondContact O-N 3.06Å; L766-A770 PolarHBondContact O-N 3.49Å; L766-A770 VanDerWaalsContact O-N 3.09Å; L766-H827 PolarHBondContact O-CE1 2.93Å; L766-A831 HydrophobicContact CB-CB 4.43Å; L766-A831 HydrophobicContact CD1-CB 4.19Å; L766-A831 HydrophobicContact CD2-CB 4.16Å; L766-K834 HydrophobicContact CD2-CD 4.5Å
767	I	88.8	Confident	87.8	Confident	67 Å²	67	67.2 Å²	67.2	34%	0.344	34%	0.335	S	S	.	.	H	α-helix	trans	-66.1	-49.2	175.5	-69.1	166.1	0	0	0	110.5	K763 Q764 K769 A770 N771	K763-I767 HydrophobicContact CG-CD1 3.95Å; K763-I767 VanDerWaalsContact O-CG1 3.3Å; K763-I767 WeakPolarHBondContact O-CG1 3.41Å; K763-I767 PolarHBondContact O-N 3.46Å; Q764-I767 WeakPolarHBondContact O-CB 3.29Å; Q764-I767 PolarHBondContact O-N 3.25Å; I767-K769 PolarHBondContact O-N 3.47Å; I767-A770 WeakPolarHBondContact O-CB 3.44Å; I767-A770 PolarHBondContact O-N 3.32Å; I767-N771 VanDerWaalsContact O-CG 3.32Å; I767-N771 PolarHBondContact O-N 2.96Å
768	D	86.5	Confident	88.1	Confident	78 Å²	78	67.2 Å²	67.2	42%	0.417	33%	0.332	S	S	.	.	H	α-helix	trans	-59.6	-39.1	-180	-65.8	-21.1	0	0	0	111.3	Q764 N771 L772	Q764-D768 PolarHBondContact NE2-OD1 2.95Å; Q764-D768 VanDerWaalsContact O-CG 3.24Å; Q764-D768 PolarHBondContact O-N 3.47Å; D768-N771 PolarHBondContact O-N 2.83Å; D768-L772 WeakPolarHBondContact O-CB 3.33Å; D768-L772 PolarHBondContact O-N 3.27Å
769	K	86.8	Confident	88.5	Confident	113 Å²	113	73.3 Å²	73.3	49%	0.491	36%	0.355	S	S	.	.	H	α-helix	trans	-65.6	-40.4	174.6	-174.1	165.7	-178.9	167.9	0	112.7	R765 I767 L772 I773	R765-K769 VanDerWaalsContact O-CB 3.27Å; R765-K769 WeakPolarHBondContact O-CB 3.21Å; R765-K769 PolarHBondContact O-N 3.32Å; I767-K769 PolarHBondContact O-N 3.47Å; K769-L772 PolarHBondContact O-N 2.97Å; K769-I773 HydrophobicContact CG-CD1 4.25Å; K769-I773 VanDerWaalsContact O-CG1 3.28Å; K769-I773 WeakPolarHBondContact O-CG1 3.4Å; K769-I773 PolarHBondContact O-N 3.41Å; K769-I773 VanDerWaalsContact O-N 3.11Å
770	A	88.1	Confident	88.6	Confident	21 Å²	21	74.8 Å²	74.8	17%	0.174	36%	0.361	C	S	.	.	H	α-helix	trans	-64.8	-43.9	174.9	0	0	0	0	0	111.1	L766 I767 L772 I773 Q774 L824	L766-A770 PolarHBondContact O-N 3.49Å; L766-A770 VanDerWaalsContact O-N 3.09Å; I767-A770 WeakPolarHBondContact O-CB 3.44Å; I767-A770 PolarHBondContact O-N 3.32Å; A770-L772 VanDerWaalsContact C-N 3.34Å; A770-L772 PolarHBondContact O-N 3.34Å; A770-I773 PolarHBondContact O-N 3.34Å; A770-Q774 WeakPolarHBondContact O-CB 3.33Å; A770-Q774 PolarHBondContact O-N 3.21Å; A770-L824 HydrophobicContact CB-CD1 4.43Å; A770-L824 WeakPolarHBondContact O-CD1 3.33Å
771	N	89.1	Confident	88.8	Confident	94 Å²	94	74.6 Å²	74.6	50%	0.503	36%	0.355	S	S	.	.	H	α-helix	trans	-62.4	-39.8	176.7	-68.6	-18.5	0	0	0	111.8	I767 D768 Q774 A775	I767-N771 VanDerWaalsContact O-CG 3.32Å; I767-N771 PolarHBondContact O-N 2.96Å; D768-N771 PolarHBondContact O-N 2.83Å; N771-Q774 PolarHBondContact O-N 3.48Å; N771-A775 VanDerWaalsContact O-CB 3.32Å; N771-A775 WeakPolarHBondContact O-CB 3.28Å; N771-A775 PolarHBondContact O-N 2.87Å
772	L	88.8	Confident	89.1	Confident	91 Å²	91	76.8 Å²	76.8	48%	0.476	36%	0.363	S	S	.	.	H	α-helix	trans	-64.7	-42.6	176.6	-177	67.4	0	0	0	112.1	D768 K769 A770 R776	D768-L772 WeakPolarHBondContact O-CB 3.33Å; D768-L772 PolarHBondContact O-N 3.27Å; K769-L772 PolarHBondContact O-N 2.97Å; A770-L772 VanDerWaalsContact C-N 3.34Å; A770-L772 PolarHBondContact O-N 3.34Å; L772-R776 WeakPolarHBondContact O-CG 3.39Å; L772-R776 PolarHBondContact O-N 3.22Å; L772-R776 VanDerWaalsContact O-N 3.1Å
773	I	87.3	Confident	89.3	Confident	24 Å²	24	78.2 Å²	78.2	12%	0.123	37%	0.369	C	S	.	.	H	α-helix	trans	-66.2	-42.1	176.9	-64.2	165.3	0	0	0	110	K769 A770 R776 F777 L820 R823 L824 H827	K769-I773 HydrophobicContact CG-CD1 4.25Å; K769-I773 VanDerWaalsContact O-CG1 3.28Å; K769-I773 WeakPolarHBondContact O-CG1 3.4Å; K769-I773 PolarHBondContact O-N 3.41Å; K769-I773 VanDerWaalsContact O-N 3.11Å; A770-I773 PolarHBondContact O-N 3.34Å; I773-R776 PolarHBondContact O-N 3.04Å; I773-F777 WeakPolarHBondContact O-CB 3.36Å; I773-F777 PolarHBondContact O-N 3.12Å; I773-L820 HydrophobicContact CG2-CD2 4.46Å; I773-R823 HydrophobicContact CG2-CB 4.45Å; I773-L824 HydrophobicContact CB-CD1 4.07Å; I773-L824 HydrophobicContact CG2-CB 3.85Å; I773-L824 HydrophobicContact CG2-CD1 3.99Å; I773-H827 HydrophobicContact CD1-CB 4.38Å
774	Q	89.8	Confident	89.5	Confident	59 Å²	59	73.4 Å²	73.4	28%	0.276	35%	0.348	S	S	.	.	H	α-helix	trans	-61	-47.9	176.1	-177.6	66.4	29.5	0	0	111.7	A770 N771 R776 F777 E778	A770-Q774 WeakPolarHBondContact O-CB 3.33Å; A770-Q774 PolarHBondContact O-N 3.21Å; N771-Q774 PolarHBondContact O-N 3.48Å; Q774-R776 VanDerWaalsContact C-N 3.3Å; Q774-R776 PolarHBondContact O-N 2.89Å; Q774-F777 WeakPolarHBondContact O-CB 3.47Å; Q774-F777 PolarHBondContact O-N 3.35Å; Q774-F777 VanDerWaalsContact O-N 3.12Å; Q774-E778 WeakPolarHBondContact CG-OE1 3.49Å; Q774-E778 PolarHBondContact NE2-OE1 3.03Å; Q774-E778 WeakPolarHBondContact O-CG 3.38Å; Q774-E778 PolarHBondContact O-N 3.3Å
775	A	89.9	Confident	89.6	Confident	42 Å²	42	73.9 Å²	73.9	35%	0.347	35%	0.35	S	S	.	.	H	α-helix	trans	-62.2	-36.6	178.7	0	0	0	0	0	112.5	N771 R779	N771-A775 VanDerWaalsContact O-CB 3.32Å; N771-A775 WeakPolarHBondContact O-CB 3.28Å; N771-A775 PolarHBondContact O-N 2.87Å; A775-R779 WeakPolarHBondContact O-CB 3.35Å; A775-R779 PolarHBondContact O-N 3.43Å
776	R	90	Very high	89.8	Confident	125 Å²	125	72.4 Å²	72.4	47%	0.472	35%	0.35	S	S	.	.	H	α-helix	trans	-68.4	-40.9	173.7	-71.8	177.5	-173.1	-160.3	1.3	111.8	L772 I773 Q774 R779 E780 L820	L772-R776 WeakPolarHBondContact O-CG 3.39Å; L772-R776 PolarHBondContact O-N 3.22Å; L772-R776 VanDerWaalsContact O-N 3.1Å; I773-R776 PolarHBondContact O-N 3.04Å; Q774-R776 VanDerWaalsContact C-N 3.3Å; Q774-R776 PolarHBondContact O-N 2.89Å; R776-R779 PolarHBondContact O-N 3.03Å; R776-E780 WeakPolarHBondContact O-CG 3.27Å; R776-E780 PolarHBondContact O-N 3.12Å; R776-L820 HydrophobicContact CB-CD1 4.28Å; R776-L820 HydrophobicContact CB-CD2 4.22Å
777	F	91.6	Very high	89.7	Confident	47 Å²	47	73.7 Å²	73.7	21%	0.206	36%	0.355	C	S	.	.	H	α-helix	trans	-60.5	-46.5	175.3	171.6	-92	0	0	0	111.4	I773 Q774 T781 I817 L820 K821	I773-F777 WeakPolarHBondContact O-CB 3.36Å; I773-F777 PolarHBondContact O-N 3.12Å; Q774-F777 WeakPolarHBondContact O-CB 3.47Å; Q774-F777 PolarHBondContact O-N 3.35Å; Q774-F777 VanDerWaalsContact O-N 3.12Å; F777-T781 WeakPolarHBondContact O-CB 3.46Å; F777-T781 PolarHBondContact O-N 2.96Å; F777-T781 PolarHBondContact O-OG1 3.35Å; F777-I817 HydrophobicContact CD2-CG2 4.04Å; F777-I817 HydrophobicContact CE2-CG2 3.44Å; F777-I817 VanDerWaalsContact CE2-CG2 3.44Å; F777-I817 HydrophobicContact CZ-CG2 4.18Å; F777-L820 HydrophobicContact CB-CB 4.11Å; F777-L820 HydrophobicContact CD2-CB 4.12Å; F777-K821 HydrophobicContact CD2-CB 4.33Å; F777-K821 HydrophobicContact CE2-CB 3.98Å
778	E	90.9	Very high	89.7	Confident	88 Å²	88	74.2 Å²	74.2	41%	0.411	36%	0.356	S	S	.	.	H	α-helix	trans	-63.3	-42.4	178.3	-73	168.4	-174.4	0	0	111.8	Q774 T781 Q782	Q774-E778 WeakPolarHBondContact CG-OE1 3.49Å; Q774-E778 PolarHBondContact NE2-OE1 3.03Å; Q774-E778 WeakPolarHBondContact O-CG 3.38Å; Q774-E778 PolarHBondContact O-N 3.3Å; E778-T781 PolarHBondContact O-N 2.71Å; E778-Q782 WeakPolarHBondContact O-CB 3.38Å; E778-Q782 VanDerWaalsContact O-CG 3.27Å; E778-Q782 WeakPolarHBondContact O-CG 3.38Å; E778-Q782 PolarHBondContact O-N 3.38Å
779	R	92.6	Very high	89.8	Confident	134 Å²	134	75 Å²	75	51%	0.506	36%	0.357	S	S	.	.	H	α-helix	trans	-60.4	-53.1	176.7	-173.7	-172.1	-52.9	149.6	3.5	112.4	A775 R776 T781 Q782 E783	A775-R779 WeakPolarHBondContact O-CB 3.35Å; A775-R779 PolarHBondContact O-N 3.43Å; R776-R779 PolarHBondContact O-N 3.03Å; R779-T781 PolarHBondContact O-N 2.89Å; R779-Q782 PolarHBondContact O-N 3.1Å; R779-Q782 VanDerWaalsContact O-N 3.12Å; R779-E783 HydrophobicContact CG-CG 4.49Å; R779-E783 WeakPolarHBondContact CG-OE1 3.38Å; R779-E783 WeakPolarHBondContact O-CG 3.42Å; R779-E783 PolarHBondContact O-N 3.48Å
780	E	90.4	Very high	89.8	Confident	38 Å²	38	75 Å²	75	18%	0.178	35%	0.354	C	S	.	.	H	α-helix	trans	-60.8	-36	179.5	-69.9	-78.9	171.6	0	0	111.4	R776 L784 R816 I817 L820	R776-E780 WeakPolarHBondContact O-CG 3.27Å; R776-E780 PolarHBondContact O-N 3.12Å; E780-L784 WeakPolarHBondContact O-CB 3.32Å; E780-L784 PolarHBondContact O-N 3.36Å; E780-R816 IonicContact OE1-CZ 2.78Å; E780-R816 IonicContact OE1-NE 3.34Å; E780-R816 IonicContact OE1-NH2 3.58Å; E780-R816 IonicContact OE2-CZ 3.87Å; E780-R816 IonicContact OE2-NE 3.98Å; E780-R816 PolarHBondContact OE2-NE 3.09Å; E780-R816 IonicContact OE2-NH2 3.58Å; E780-R816 PolarHBondContact OE2-NH2 3.45Å; E780-I817 HydrophobicContact CB-CG1 3.85Å; E780-L820 HydrophobicContact CB-CD1 4.41Å; E780-L820 HydrophobicContact CG-CD1 3.91Å
781	T	91.1	Very high	89.6	Confident	51 Å²	51	75.9 Å²	75.9	31%	0.313	35%	0.353	S	S	.	.	H	α-helix	trans	-66.9	-42.6	175.5	-54.3	0	0	0	0	111.7	F777 E778 R779 Q785	F777-T781 WeakPolarHBondContact O-CB 3.46Å; F777-T781 PolarHBondContact O-N 2.96Å; F777-T781 PolarHBondContact O-OG1 3.35Å; E778-T781 PolarHBondContact O-N 2.71Å; R779-T781 PolarHBondContact O-N 2.89Å; T781-Q785 WeakPolarHBondContact O-CB 3.44Å; T781-Q785 PolarHBondContact O-N 2.9Å
782	Q	92.3	Very high	89.4	Confident	109 Å²	109	78.2 Å²	78.2	51%	0.509	36%	0.361	S	S	.	.	H	α-helix	trans	-66.2	-42.3	176.6	-74.5	172.7	7.2	0	0	111.9	E778 R779 Q785 Q786	E778-Q782 WeakPolarHBondContact O-CB 3.38Å; E778-Q782 VanDerWaalsContact O-CG 3.27Å; E778-Q782 WeakPolarHBondContact O-CG 3.38Å; E778-Q782 PolarHBondContact O-N 3.38Å; R779-Q782 PolarHBondContact O-N 3.1Å; R779-Q782 VanDerWaalsContact O-N 3.12Å; Q782-Q785 PolarHBondContact O-N 2.95Å; Q782-Q786 WeakPolarHBondContact O-CG 3.47Å; Q782-Q786 PolarHBondContact O-N 3.3Å
783	E	90.9	Very high	89.2	Confident	70 Å²	70	81.9 Å²	81.9	33%	0.327	37%	0.373	S	S	.	.	H	α-helix	trans	-62.8	-42.1	177.1	-74.2	173	-171.2	0	0	111.5	R779 Q786 K787	R779-E783 HydrophobicContact CG-CG 4.49Å; R779-E783 WeakPolarHBondContact CG-OE1 3.38Å; R779-E783 WeakPolarHBondContact O-CG 3.42Å; R779-E783 PolarHBondContact O-N 3.48Å; E783-Q786 PolarHBondContact O-N 3.36Å; E783-K787 PolarHBondContact O-N 3.5Å
784	L	91.4	Very high	89	Confident	15 Å²	15	83 Å²	83	8%	0.079	38%	0.379	C	S	.	.	H	α-helix	trans	-60.9	-44.8	173.1	-179.8	59.6	0	0	0	111.3	E780 Q786 K787 Q788 C810 A813 M814 I817	E780-L784 WeakPolarHBondContact O-CB 3.32Å; E780-L784 PolarHBondContact O-N 3.36Å; L784-Q786 PolarHBondContact O-N 3.11Å; L784-K787 PolarHBondContact O-N 3.36Å; L784-Q788 HydrophobicContact CD1-CG 4.44Å; L784-Q788 WeakPolarHBondContact O-CB 3.35Å; L784-Q788 VanDerWaalsContact O-CG 3.29Å; L784-Q788 WeakPolarHBondContact O-CG 3.28Å; L784-Q788 PolarHBondContact O-N 2.99Å; L784-C810 HydrophobicContact CD1-CB 4.45Å; L784-A813 HydrophobicContact CB-CB 4.38Å; L784-A813 HydrophobicContact CD1-CB 3.97Å; L784-A813 HydrophobicContact CD2-CB 4.49Å; L784-M814 HydrophobicContact CD2-CG 3.98Å; L784-I817 HydrophobicContact CB-CD1 4.25Å; L784-I817 HydrophobicContact CD2-CD1 3.71Å
785	Q	90	Very high	88.4	Confident	106 Å²	106	85.3 Å²	85.3	50%	0.495	39%	0.39	S	S	.	.	H	α-helix	trans	-64	-39.6	178.7	-168.8	177.9	13.6	0	0	112.3	T781 Q782 Q788 Q789	T781-Q785 WeakPolarHBondContact O-CB 3.44Å; T781-Q785 PolarHBondContact O-N 2.9Å; Q782-Q785 PolarHBondContact O-N 2.95Å; Q785-Q788 PolarHBondContact O-N 3.32Å; Q785-Q789 WeakPolarHBondContact O-CG 3.44Å; Q785-Q789 PolarHBondContact O-N 2.91Å
786	Q	90.9	Very high	87.7	Confident	125 Å²	125	92 Å²	92	58%	0.584	42%	0.419	S	S	*	.	H	α-helix	trans	-64.7	-42.9	174.9	-73.4	177.2	20.8	0	0	111.5	Q782 E783 L784 Q788 Q789 W790	Q782-Q786 WeakPolarHBondContact O-CG 3.47Å; Q782-Q786 PolarHBondContact O-N 3.3Å; E783-Q786 PolarHBondContact O-N 3.36Å; L784-Q786 PolarHBondContact O-N 3.11Å; Q786-Q788 VanDerWaalsContact C-N 3.34Å; Q786-Q788 PolarHBondContact O-N 2.9Å; Q786-Q789 PolarHBondContact O-N 2.95Å; Q786-W790 WeakPolarHBondContact O-CB 3.28Å; Q786-W790 PolarHBondContact O-N 3.21Å
787	K	87.4	Confident	87	Confident	51 Å²	51	91.5 Å²	91.5	22%	0.222	43%	0.43	C	S	.	.	H	α-helix	trans	-68.2	-34.5	178.3	-149.3	178.3	-173	178.4	0	112.1	E783 L784 W790 Y791 Y806 Y809	E783-K787 PolarHBondContact O-N 3.5Å; L784-K787 PolarHBondContact O-N 3.36Å; K787-W790 PolarHBondContact O-N 3.07Å; K787-Y791 WeakPolarHBondContact O-CB 3.27Å; K787-Y791 PolarHBondContact O-N 2.68Å; K787-Y806 HydrophobicContact CG-CD2 4.37Å; K787-Y806 HydrophobicContact CG-CE2 4.4Å; K787-Y809 HydrophobicContact CB-CE1 4.08Å; K787-Y809 HydrophobicContact CD-CD1 3.15Å; K787-Y809 HydrophobicContact CD-CD2 4.07Å; K787-Y809 HydrophobicContact CD-CE1 3.2Å; K787-Y809 HydrophobicContact CD-CE2 4.08Å; K787-Y809 HydrophobicContact CD-CG 3.6Å; K787-Y809 HydrophobicContact CG-CD1 4.37Å; K787-Y809 HydrophobicContact CG-CE1 4.24Å; K787-Y809 VanDerWaalsContact NZ-CB 3.34Å
788	Q	87.5	Confident	86.3	Confident	77 Å²	77	91.3 Å²	91.3	36%	0.36	43%	0.43	S	S	.	.	H	α-helix	trans	-62.5	-43.5	170.8	-74.7	173.2	-5.5	0	0	112.3	L784 Q785 Q786 Y791 Q792 Y806	L784-Q788 HydrophobicContact CD1-CG 4.44Å; L784-Q788 WeakPolarHBondContact O-CB 3.35Å; L784-Q788 VanDerWaalsContact O-CG 3.29Å; L784-Q788 WeakPolarHBondContact O-CG 3.28Å; L784-Q788 PolarHBondContact O-N 2.99Å; Q785-Q788 PolarHBondContact O-N 3.32Å; Q786-Q788 VanDerWaalsContact C-N 3.34Å; Q786-Q788 PolarHBondContact O-N 2.9Å; Q788-Y791 PolarHBondContact O-N 3.23Å; Q788-Q792 WeakPolarHBondContact O-CG 3.34Å; Q788-Q792 PolarHBondContact O-N 3.3Å; Q788-Y806 WeakPolarHBondContact CG-OH 3.36Å
789	Q	88.3	Confident	85.9	Confident	94 Å²	94	90.9 Å²	90.9	44%	0.439	43%	0.434	S	S	.	.	H	α-helix	trans	-67.1	-35.9	175.8	-72.3	176.6	8.4	0	0	112.5	Q785 Q786 K793	Q785-Q789 WeakPolarHBondContact O-CG 3.44Å; Q785-Q789 PolarHBondContact O-N 2.91Å; Q786-Q789 PolarHBondContact O-N 2.95Å; Q789-K793 WeakPolarHBondContact O-CG 3.43Å; Q789-K793 PolarHBondContact O-N 3.09Å
790	W	87.2	Confident	85.2	Confident	114 Å²	114	92.8 Å²	92.8	43%	0.432	45%	0.446	S	S	.	.	H	α-helix	trans	-63.9	-46.6	173.9	177.2	91.1	0	0	0	111.1	Q786 K787 Q792 K793 N794 M798	Q786-W790 WeakPolarHBondContact O-CB 3.28Å; Q786-W790 PolarHBondContact O-N 3.21Å; K787-W790 PolarHBondContact O-N 3.07Å; W790-Q792 PolarHBondContact O-N 3.39Å; W790-K793 PolarHBondContact O-N 2.71Å; W790-K793 VanDerWaalsContact O-N 3.14Å; W790-N794 WeakPolarHBondContact CZ2-ND2 3.37Å; W790-N794 PolarHBondContact NE1-ND2 2.82Å; W790-N794 PolarHBondContact O-N 3.48Å; W790-M798 HydrophobicContact CH2-CE 3.27Å; W790-M798 HydrophobicContact CH2-SD 3.84Å; W790-M798 HydrophobicContact CZ2-CE 3.52Å; W790-M798 HydrophobicContact CZ3-CE 4.11Å; W790-M798 HydrophobicContact CZ3-SD 4.44Å
791	Y	84.8	Confident	84.7	Confident	39 Å²	39	98.7 Å²	98.7	15%	0.153	47%	0.473	C	S	.	.	H	α-helix	trans	-59.3	-46.3	177.3	-178.3	-99.4	0	0	0	111.7	K787 Q788 K793 N794 Q795 E803 Y806	K787-Y791 WeakPolarHBondContact O-CB 3.27Å; K787-Y791 PolarHBondContact O-N 2.68Å; Q788-Y791 PolarHBondContact O-N 3.23Å; Y791-K793 PolarHBondContact O-N 3.01Å; Y791-N794 PolarHBondContact O-N 2.78Å; Y791-N794 VanDerWaalsContact O-N 3.13Å; Y791-Q795 HydrophobicContact CE1-CG 4.35Å; Y791-Q795 WeakPolarHBondContact O-CB 3.42Å; Y791-Q795 PolarHBondContact O-N 3.46Å; Y791-E803 HydrophobicContact CE2-CG 4.44Å; Y791-Y806 VanDerWaalsContact CB-CE2 3.47Å; Y791-Y806 HydrophobicContact CD1-CD1 4.23Å; Y791-Y806 AromaticContact CD1-CE1 3.68Å; Y791-Y806 HydrophobicContact CD1-CE1 3.68Å; Y791-Y806 AromaticContact CD1-CZ 3.85Å; Y791-Y806 AromaticContact CD2-CD1 3.46Å; Y791-Y806 HydrophobicContact CD2-CD1 3.46Å; Y791-Y806 VanDerWaalsContact CD2-CD1 3.46Å; Y791-Y806 AromaticContact CD2-CD2 3.85Å; Y791-Y806 HydrophobicContact CD2-CD2 3.85Å; Y791-Y806 AromaticContact CD2-CE1 3.75Å; Y791-Y806 HydrophobicContact CD2-CE1 3.75Å; Y791-Y806 HydrophobicContact CD2-CE2 4.12Å; Y791-Y806 AromaticContact CD2-CG 3.51Å; Y791-Y806 HydrophobicContact CD2-CG 3.51Å; Y791-Y806 HydrophobicContact CE1-CD1 4.31Å; Y791-Y806 AromaticContact CE1-CE1 3.95Å; Y791-Y806 HydrophobicContact CE1-CE1 3.95Å; Y791-Y806 AromaticContact CE2-CD1 3.55Å; Y791-Y806 HydrophobicContact CE2-CD1 3.55Å; Y791-Y806 HydrophobicContact CE2-CE1 4Å; Y791-Y806 AromaticContact CE2-CG 3.92Å; Y791-Y806 HydrophobicContact CE2-CG 3.92Å; Y791-Y806 AromaticContact CG-CD1 3.82Å; Y791-Y806 HydrophobicContact CG-CD1 3.82Å; Y791-Y806 HydrophobicContact CG-CD2 4.04Å; Y791-Y806 AromaticContact CG-CE1 3.57Å; Y791-Y806 HydrophobicContact CG-CE1 3.57Å; Y791-Y806 AromaticContact CG-CE2 3.81Å; Y791-Y806 HydrophobicContact CG-CE2 3.81Å; Y791-Y806 HydrophobicContact CG-CG 4.03Å; Y791-Y806 AromaticContact CG-CZ 3.56Å; Y791-Y806 AromaticContact CZ-CD1 3.98Å
792	Q	84.1	Confident	84.1	Confident	143 Å²	143	99.2 Å²	99.2	67%	0.668	47%	0.474	S	S	*	.	H	α-helix	trans	-58.3	-32.7	176.4	-74.3	176.3	5.1	0	0	113.8	Q788 W790	Q788-Q792 WeakPolarHBondContact O-CG 3.34Å; Q788-Q792 PolarHBondContact O-N 3.3Å; W790-Q792 PolarHBondContact O-N 3.39Å
793	K	84.9	Confident	83.6	Confident	168 Å²	168	97.2 Å²	97.2	73%	0.73	47%	0.465	S	S	*	.	H	α-helix	trans	-79.3	-31.1	178.4	-73.1	177.2	-178.3	178.1	0	112.8	Q789 W790 Y791	Q789-K793 WeakPolarHBondContact O-CG 3.43Å; Q789-K793 PolarHBondContact O-N 3.09Å; W790-K793 PolarHBondContact O-N 2.71Å; W790-K793 VanDerWaalsContact O-N 3.14Å; Y791-K793 PolarHBondContact O-N 3.01Å
794	N	83.3	Confident	83.1	Confident	49 Å²	49	99 Å²	99	26%	0.262	48%	0.477	S	S	.	.	H	α-helix	trans	-105.1	-2.4	-170.1	-66.6	15.6	0	0	0	113.7	W790 Y791 L796 T797 M798	W790-N794 WeakPolarHBondContact CZ2-ND2 3.37Å; W790-N794 PolarHBondContact NE1-ND2 2.82Å; W790-N794 PolarHBondContact O-N 3.48Å; Y791-N794 PolarHBondContact O-N 2.78Å; Y791-N794 VanDerWaalsContact O-N 3.13Å; N794-L796 PolarHBondContact O-N 3.47Å; N794-T797 PolarHBondContact O-N 2.85Å; N794-T797 PolarHBondContact O-OG1 3.39Å; N794-M798 HydrophobicContact CB-CE 3.5Å; N794-M798 VanDerWaalsContact CB-CE 3.5Å; N794-M798 HydrophobicContact CB-CG 4.42Å; N794-M798 WeakPolarHBondContact O-CG 3.34Å
795	Q	76.6	Confident	82.8	Confident	106 Å²	106	104.7 Å²	104.7	50%	0.495	50%	0.503	S	S	.	.	G	3₁₀ helix	trans	-50.3	-32	-173.9	-164.8	174.3	5.6	0	0	115.1	Y791 T797	Y791-Q795 HydrophobicContact CE1-CG 4.35Å; Y791-Q795 WeakPolarHBondContact O-CB 3.42Å; Y791-Q795 PolarHBondContact O-N 3.46Å; Q795-T797 VanDerWaalsContact C-N 3.29Å; Q795-T797 PolarHBondContact O-N 2.86Å
796	L	75.4	Confident	82.6	Confident	182 Å²	182	100.9 Å²	100.9	95%	0.953	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-81.3	-6.4	-179.1	-67.7	167.5	0	0	0	114.1	N794	N794-L796 PolarHBondContact O-N 3.47Å
797	T	76.5	Confident	82.3	Confident	115 Å²	115	99.9 Å²	99.9	71%	0.706	48%	0.482	S	S	*	.	G	3₁₀ helix	trans	-121.9	2.5	-172.1	9.5	0	0	0	0	113.1	N794 Q795	N794-T797 PolarHBondContact O-N 2.85Å; N794-T797 PolarHBondContact O-OG1 3.39Å; Q795-T797 VanDerWaalsContact C-N 3.29Å; Q795-T797 PolarHBondContact O-N 2.86Å
798	M	75.9	Confident	82.2	Confident	44 Å²	44	99.9 Å²	99.9	22%	0.217	49%	0.492	C	S	.	.			trans	-91.5	146.2	-174.5	-71.8	-66.8	147.9	0	0	112	W790 N794 D802 E803	W790-M798 HydrophobicContact CH2-CE 3.27Å; W790-M798 HydrophobicContact CH2-SD 3.84Å; W790-M798 HydrophobicContact CZ2-CE 3.52Å; W790-M798 HydrophobicContact CZ3-CE 4.11Å; W790-M798 HydrophobicContact CZ3-SD 4.44Å; N794-M798 HydrophobicContact CB-CE 3.5Å; N794-M798 VanDerWaalsContact CB-CE 3.5Å; N794-M798 HydrophobicContact CB-CG 4.42Å; N794-M798 WeakPolarHBondContact O-CG 3.34Å; M798-D802 HydrophobicContact CB-CB 4.16Å; M798-D802 HydrophobicContact CG-CB 4.39Å; M798-D802 HydrophobicContact SD-CB 3.55Å; M798-D802 VanDerWaalsContact SD-CB 3.55Å; M798-E803 HydrophobicContact CB-CG 4.47Å
799	T	82.8	Confident	82.3	Confident	78 Å²	78	99 Å²	99	48%	0.479	49%	0.486	S	S	.	.			trans	-86.6	165.9	171.9	67.1	0	0	0	0	110.8	E801 D802 E803	T799-E801 PolarHBondContact O-N 3.04Å; T799-D802 WeakPolarHBondContact CB-OD2 3.35Å; T799-D802 PolarHBondContact N-OD2 2.99Å; T799-D802 WeakPolarHBondContact O-CB 3.33Å; T799-D802 PolarHBondContact O-N 3.43Å; T799-D802 VanDerWaalsContact O-N 3.13Å; T799-D802 VanDerWaalsContact OG1-CG 3.22Å; T799-D802 PolarHBondContact OG1-N 3.24Å; T799-D802 PolarHBondContact OG1-OD2 3.06Å; T799-E803 PolarHBondContact O-N 2.94Å; T799-E803 VanDerWaalsContact O-N 3.1Å
800	K	78.1	Confident	82.2	Confident	175 Å²	175	95.2 Å²	95.2	76%	0.761	47%	0.469	S	S	*	.	H	α-helix	trans	-58.3	-36.7	176.3	-78.9	-172.2	172.3	-173.1	0	112.7	D802 E803 D804	K800-D802 VanDerWaalsContact C-N 3.35Å; K800-D802 PolarHBondContact O-N 3.03Å; K800-E803 PolarHBondContact O-N 3.09Å; K800-D804 PolarHBondContact O-N 3.29Å; K800-D804 VanDerWaalsContact O-N 3.08Å
801	E	78.6	Confident	82	Confident	162 Å²	162	92.6 Å²	92.6	76%	0.757	47%	0.468	S	S	*	.	H	α-helix	trans	-64.4	-39.1	176.6	-65.5	175.8	-175	0	0	111.7	T799 E803 D804 E805	T799-E801 PolarHBondContact O-N 3.04Å; E801-E803 VanDerWaalsContact C-N 3.34Å; E801-D804 PolarHBondContact O-N 3.02Å; E801-E805 PolarHBondContact O-N 2.81Å
802	D	80.3	Confident	82.2	Confident	61 Å²	61	95.4 Å²	95.4	33%	0.326	49%	0.486	S	S	.	.	H	α-helix	trans	-68.9	-32.1	176.5	-58.9	-52.9	0	0	0	112.4	M798 T799 K800 Y806	M798-D802 HydrophobicContact CB-CB 4.16Å; M798-D802 HydrophobicContact CG-CB 4.39Å; M798-D802 HydrophobicContact SD-CB 3.55Å; M798-D802 VanDerWaalsContact SD-CB 3.55Å; T799-D802 WeakPolarHBondContact CB-OD2 3.35Å; T799-D802 PolarHBondContact N-OD2 2.99Å; T799-D802 WeakPolarHBondContact O-CB 3.33Å; T799-D802 PolarHBondContact O-N 3.43Å; T799-D802 VanDerWaalsContact O-N 3.13Å; T799-D802 VanDerWaalsContact OG1-CG 3.22Å; T799-D802 PolarHBondContact OG1-N 3.24Å; T799-D802 PolarHBondContact OG1-OD2 3.06Å; K800-D802 VanDerWaalsContact C-N 3.35Å; K800-D802 PolarHBondContact O-N 3.03Å; D802-Y806 WeakPolarHBondContact O-CB 3.38Å; D802-Y806 PolarHBondContact O-N 3.31Å; D802-Y806 VanDerWaalsContact O-N 3.1Å
803	E	80.2	Confident	82.4	Confident	67 Å²	67	88.6 Å²	88.6	31%	0.313	45%	0.454	S	S	.	.	H	α-helix	trans	-67.8	-44.5	174.8	-69.9	-177	162.7	0	0	111.2	Y791 M798 T799 K800 E801 Y806 L807	Y791-E803 HydrophobicContact CE2-CG 4.44Å; M798-E803 HydrophobicContact CB-CG 4.47Å; T799-E803 PolarHBondContact O-N 2.94Å; T799-E803 VanDerWaalsContact O-N 3.1Å; K800-E803 PolarHBondContact O-N 3.09Å; E801-E803 VanDerWaalsContact C-N 3.34Å; E803-Y806 PolarHBondContact O-N 2.98Å; E803-L807 WeakPolarHBondContact O-CG 3.49Å; E803-L807 PolarHBondContact O-N 3.16Å
804	D	81.8	Confident	82.5	Confident	108 Å²	108	85.7 Å²	85.7	58%	0.578	44%	0.444	S	S	*	.	H	α-helix	trans	-65.4	-41.1	177.4	-71.8	-24.3	0	0	0	111.9	K800 E801 Y806 L807 A808	K800-D804 PolarHBondContact O-N 3.29Å; K800-D804 VanDerWaalsContact O-N 3.08Å; E801-D804 PolarHBondContact O-N 3.02Å; D804-Y806 VanDerWaalsContact C-N 3.32Å; D804-Y806 PolarHBondContact O-N 3.31Å; D804-L807 PolarHBondContact O-N 2.94Å; D804-A808 WeakPolarHBondContact O-CB 3.42Å; D804-A808 PolarHBondContact O-N 3.29Å
805	E	83.6	Confident	82.7	Confident	134 Å²	134	89.6 Å²	89.6	63%	0.626	46%	0.459	S	S	*	.	H	α-helix	trans	-64.3	-37.5	175.6	-166.2	-173.9	166	0	0	111.8	E801 Y809	E801-E805 PolarHBondContact O-N 2.81Å; E805-Y809 WeakPolarHBondContact O-CB 3.44Å; E805-Y809 PolarHBondContact O-N 3.07Å
806	Y	86.7	Confident	83.4	Confident	27 Å²	27	89 Å²	89	11%	0.106	45%	0.452	C	S	.	.	H	α-helix	trans	-65	-44.8	173.8	170.8	-101.2	0	0	0	112	K787 Q788 Y791 D802 E803 D804 Y809 C810	K787-Y806 HydrophobicContact CG-CD2 4.37Å; K787-Y806 HydrophobicContact CG-CE2 4.4Å; Q788-Y806 WeakPolarHBondContact CG-OH 3.36Å; Y791-Y806 VanDerWaalsContact CB-CE2 3.47Å; Y791-Y806 HydrophobicContact CD1-CD1 4.23Å; Y791-Y806 AromaticContact CD1-CE1 3.68Å; Y791-Y806 HydrophobicContact CD1-CE1 3.68Å; Y791-Y806 AromaticContact CD1-CZ 3.85Å; Y791-Y806 AromaticContact CD2-CD1 3.46Å; Y791-Y806 HydrophobicContact CD2-CD1 3.46Å; Y791-Y806 VanDerWaalsContact CD2-CD1 3.46Å; Y791-Y806 AromaticContact CD2-CD2 3.85Å; Y791-Y806 HydrophobicContact CD2-CD2 3.85Å; Y791-Y806 AromaticContact CD2-CE1 3.75Å; Y791-Y806 HydrophobicContact CD2-CE1 3.75Å; Y791-Y806 HydrophobicContact CD2-CE2 4.12Å; Y791-Y806 AromaticContact CD2-CG 3.51Å; Y791-Y806 HydrophobicContact CD2-CG 3.51Å; Y791-Y806 HydrophobicContact CE1-CD1 4.31Å; Y791-Y806 AromaticContact CE1-CE1 3.95Å; Y791-Y806 HydrophobicContact CE1-CE1 3.95Å; Y791-Y806 AromaticContact CE2-CD1 3.55Å; Y791-Y806 HydrophobicContact CE2-CD1 3.55Å; Y791-Y806 HydrophobicContact CE2-CE1 4Å; Y791-Y806 AromaticContact CE2-CG 3.92Å; Y791-Y806 HydrophobicContact CE2-CG 3.92Å; Y791-Y806 AromaticContact CG-CD1 3.82Å; Y791-Y806 HydrophobicContact CG-CD1 3.82Å; Y791-Y806 HydrophobicContact CG-CD2 4.04Å; Y791-Y806 AromaticContact CG-CE1 3.57Å; Y791-Y806 HydrophobicContact CG-CE1 3.57Å; Y791-Y806 AromaticContact CG-CE2 3.81Å; Y791-Y806 HydrophobicContact CG-CE2 3.81Å; Y791-Y806 HydrophobicContact CG-CG 4.03Å; Y791-Y806 AromaticContact CG-CZ 3.56Å; Y791-Y806 AromaticContact CZ-CD1 3.98Å; D802-Y806 WeakPolarHBondContact O-CB 3.38Å; D802-Y806 PolarHBondContact O-N 3.31Å; D802-Y806 VanDerWaalsContact O-N 3.1Å; E803-Y806 PolarHBondContact O-N 2.98Å; D804-Y806 VanDerWaalsContact C-N 3.32Å; D804-Y806 PolarHBondContact O-N 3.31Å; Y806-Y809 PolarHBondContact O-N 2.89Å; Y806-C810 VanDerWaalsContact CE2-SG 3.55Å; Y806-C810 PolarHBondContact O-N 3.38Å; Y806-C810 PolarHBondContact O-SG 3.09Å
807	L	84.4	Confident	84.1	Confident	104 Å²	104	81.5 Å²	81.5	55%	0.545	41%	0.413	S	S	.	.	H	α-helix	trans	-61.7	-45	177.6	-71.4	174.5	0	0	0	111.5	E803 D804 Y809 C810 S811	E803-L807 WeakPolarHBondContact O-CG 3.49Å; E803-L807 PolarHBondContact O-N 3.16Å; D804-L807 PolarHBondContact O-N 2.94Å; L807-Y809 PolarHBondContact O-N 3.38Å; L807-C810 PolarHBondContact O-N 3.16Å; L807-S811 PolarHBondContact O-N 3.34Å; L807-S811 PolarHBondContact O-OG 3.34Å
808	A	85.6	Confident	84.8	Confident	51 Å²	51	81.7 Å²	81.7	42%	0.421	41%	0.406	S	S	.	.	H	α-helix	trans	-60.4	-43	175	0	0	0	0	0	112	D804 C810 S811 D812	D804-A808 WeakPolarHBondContact O-CB 3.42Å; D804-A808 PolarHBondContact O-N 3.29Å; A808-C810 VanDerWaalsContact C-N 3.35Å; A808-C810 PolarHBondContact O-N 3.37Å; A808-S811 WeakPolarHBondContact CA-OG 3.28Å; A808-S811 PolarHBondContact O-N 3.02Å; A808-S811 PolarHBondContact O-OG 3Å; A808-D812 WeakPolarHBondContact O-CB 3.47Å; A808-D812 PolarHBondContact O-N 3.43Å
809	Y	89.6	Confident	85.4	Confident	59 Å²	59	81.9 Å²	81.9	23%	0.231	41%	0.407	C	S	.	.	H	α-helix	trans	-63.9	-40.6	175	-178.7	-84.1	0	0	0	112.2	K787 E805 Y806 L807 D812 A813	K787-Y809 HydrophobicContact CB-CE1 4.08Å; K787-Y809 HydrophobicContact CD-CD1 3.15Å; K787-Y809 HydrophobicContact CD-CD2 4.07Å; K787-Y809 HydrophobicContact CD-CE1 3.2Å; K787-Y809 HydrophobicContact CD-CE2 4.08Å; K787-Y809 HydrophobicContact CD-CG 3.6Å; K787-Y809 HydrophobicContact CG-CD1 4.37Å; K787-Y809 HydrophobicContact CG-CE1 4.24Å; K787-Y809 VanDerWaalsContact NZ-CB 3.34Å; E805-Y809 WeakPolarHBondContact O-CB 3.44Å; E805-Y809 PolarHBondContact O-N 3.07Å; Y806-Y809 PolarHBondContact O-N 2.89Å; L807-Y809 PolarHBondContact O-N 3.38Å; Y809-D812 PolarHBondContact O-N 3.42Å; Y809-A813 HydrophobicContact CD1-CB 4.33Å; Y809-A813 HydrophobicContact CE1-CB 4.09Å; Y809-A813 VanDerWaalsContact O-CB 3.22Å; Y809-A813 WeakPolarHBondContact O-CB 3.45Å; Y809-A813 PolarHBondContact O-N 3.41Å
810	C	85.4	Confident	85.8	Confident	13 Å²	13	79 Å²	79	9%	0.088	39%	0.388	C	S	.	.	H	α-helix	trans	-64.1	-42.9	177.8	-79.5	0	0	0	0	111.7	L784 Y806 L807 A808 M814	L784-C810 HydrophobicContact CD1-CB 4.45Å; Y806-C810 VanDerWaalsContact CE2-SG 3.55Å; Y806-C810 PolarHBondContact O-N 3.38Å; Y806-C810 PolarHBondContact O-SG 3.09Å; L807-C810 PolarHBondContact O-N 3.16Å; A808-C810 VanDerWaalsContact C-N 3.35Å; A808-C810 PolarHBondContact O-N 3.37Å; C810-M814 HydrophobicContact CB-CE 4.37Å; C810-M814 VanDerWaalsContact O-CB 3.31Å; C810-M814 WeakPolarHBondContact O-CB 3.43Å; C810-M814 WeakPolarHBondContact O-CE 3.46Å; C810-M814 VanDerWaalsContact O-CG 3.23Å; C810-M814 WeakPolarHBondContact O-CG 3.12Å; C810-M814 PolarHBondContact O-N 2.99Å
811	S	83.9	Confident	86.3	Confident	60 Å²	60	77.1 Å²	77.1	42%	0.42	38%	0.381	S	S	.	.	H	α-helix	trans	-62	-44.6	175.4	53.8	0	0	0	0	111.9	L807 A808 M814 F815	L807-S811 PolarHBondContact O-N 3.34Å; L807-S811 PolarHBondContact O-OG 3.34Å; A808-S811 WeakPolarHBondContact CA-OG 3.28Å; A808-S811 PolarHBondContact O-N 3.02Å; A808-S811 PolarHBondContact O-OG 3Å; S811-M814 PolarHBondContact O-N 3.47Å; S811-F815 WeakPolarHBondContact O-CB 3.17Å; S811-F815 PolarHBondContact O-N 3.49Å
812	D	87.7	Confident	86.8	Confident	97 Å²	97	72.9 Å²	72.9	52%	0.519	36%	0.362	S	S	.	.	H	α-helix	trans	-65.7	-46.9	179.6	-83.9	5.6	0	0	0	112.1	A808 Y809 M814 F815 R816	A808-D812 WeakPolarHBondContact O-CB 3.47Å; A808-D812 PolarHBondContact O-N 3.43Å; Y809-D812 PolarHBondContact O-N 3.42Å; D812-M814 PolarHBondContact O-N 3.47Å; D812-F815 WeakPolarHBondContact O-CB 3.41Å; D812-F815 PolarHBondContact O-N 3.21Å; D812-R816 WeakPolarHBondContact O-CG 3.49Å; D812-R816 PolarHBondContact O-N 3.25Å
813	A	88.9	Confident	87.1	Confident	0 Å²	0	77 Å²	77	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-62.2	-42.9	177.5	0	0	0	0	0	111.4	L784 Y809 F815 R816 I817	L784-A813 HydrophobicContact CB-CB 4.38Å; L784-A813 HydrophobicContact CD1-CB 3.97Å; L784-A813 HydrophobicContact CD2-CB 4.49Å; Y809-A813 HydrophobicContact CD1-CB 4.33Å; Y809-A813 HydrophobicContact CE1-CB 4.09Å; Y809-A813 VanDerWaalsContact O-CB 3.22Å; Y809-A813 WeakPolarHBondContact O-CB 3.45Å; Y809-A813 PolarHBondContact O-N 3.41Å; A813-F815 VanDerWaalsContact C-N 3.33Å; A813-F815 PolarHBondContact O-N 3.43Å; A813-R816 PolarHBondContact O-N 3.24Å; A813-I817 WeakPolarHBondContact O-CB 3.3Å; A813-I817 WeakPolarHBondContact O-CG1 3.48Å; A813-I817 PolarHBondContact O-N 3.05Å
814	M	87	Confident	87.6	Confident	107 Å²	107	74.7 Å²	74.7	53%	0.527	36%	0.363	S	S	.	.	H	α-helix	trans	-61.5	-40.4	174.9	-76.4	-171.5	-71.1	0	0	112	L784 C810 S811 D812 I817 H818	L784-M814 HydrophobicContact CD2-CG 3.98Å; C810-M814 HydrophobicContact CB-CE 4.37Å; C810-M814 VanDerWaalsContact O-CB 3.31Å; C810-M814 WeakPolarHBondContact O-CB 3.43Å; C810-M814 WeakPolarHBondContact O-CE 3.46Å; C810-M814 VanDerWaalsContact O-CG 3.23Å; C810-M814 WeakPolarHBondContact O-CG 3.12Å; C810-M814 PolarHBondContact O-N 2.99Å; S811-M814 PolarHBondContact O-N 3.47Å; D812-M814 PolarHBondContact O-N 3.47Å; M814-I817 PolarHBondContact O-N 3.29Å; M814-H818 WeakPolarHBondContact O-CB 3.31Å; M814-H818 PolarHBondContact O-N 2.94Å
815	F	88.6	Confident	87.9	Confident	131 Å²	131	72.5 Å²	72.5	58%	0.575	36%	0.356	S	S	*	.	H	α-helix	trans	-63.8	-45.3	175.4	-178.1	-108.8	0	0	0	112.1	S811 D812 A813 I817 H818 I819	S811-F815 WeakPolarHBondContact O-CB 3.17Å; S811-F815 PolarHBondContact O-N 3.49Å; D812-F815 WeakPolarHBondContact O-CB 3.41Å; D812-F815 PolarHBondContact O-N 3.21Å; A813-F815 VanDerWaalsContact C-N 3.33Å; A813-F815 PolarHBondContact O-N 3.43Å; F815-I817 PolarHBondContact O-N 3.4Å; F815-H818 PolarHBondContact O-N 3.05Å; F815-I819 HydrophobicContact CD1-CD1 3.79Å; F815-I819 HydrophobicContact CE1-CD1 3.29Å; F815-I819 HydrophobicContact CE1-CG1 4.37Å; F815-I819 HydrophobicContact CE2-CD1 4.15Å; F815-I819 HydrophobicContact CG-CD1 4.42Å; F815-I819 HydrophobicContact CZ-CD1 3.51Å; F815-I819 HydrophobicContact CZ-CG1 4.32Å; F815-I819 WeakPolarHBondContact O-CG1 3.33Å; F815-I819 PolarHBondContact O-N 3.05Å
816	R	90.4	Very high	88.1	Confident	93 Å²	93	73 Å²	73	35%	0.351	35%	0.353	S	S	.	.	H	α-helix	trans	-60.5	-45.7	175.7	-68.4	-169.6	-53.6	-139.3	8.2	111.8	E780 D812 A813 H818 I819 L820	E780-R816 IonicContact OE1-CZ 2.78Å; E780-R816 IonicContact OE1-NE 3.34Å; E780-R816 IonicContact OE1-NH2 3.58Å; E780-R816 IonicContact OE2-CZ 3.87Å; E780-R816 IonicContact OE2-NE 3.98Å; E780-R816 PolarHBondContact OE2-NE 3.09Å; E780-R816 IonicContact OE2-NH2 3.58Å; E780-R816 PolarHBondContact OE2-NH2 3.45Å; D812-R816 WeakPolarHBondContact O-CG 3.49Å; D812-R816 PolarHBondContact O-N 3.25Å; A813-R816 PolarHBondContact O-N 3.24Å; R816-H818 VanDerWaalsContact C-N 3.33Å; R816-H818 PolarHBondContact O-N 3.48Å; R816-I819 PolarHBondContact O-N 3.27Å; R816-L820 WeakPolarHBondContact O-CG 3.49Å; R816-L820 PolarHBondContact O-N 3.46Å
817	I	91.3	Very high	88.1	Confident	26 Å²	26	72.9 Å²	72.9	13%	0.133	35%	0.353	C	S	.	.	H	α-helix	trans	-59.5	-44.3	176	-70.1	168	0	0	0	110.5	F777 E780 L784 A813 M814 F815 L820 K821	F777-I817 HydrophobicContact CD2-CG2 4.04Å; F777-I817 HydrophobicContact CE2-CG2 3.44Å; F777-I817 VanDerWaalsContact CE2-CG2 3.44Å; F777-I817 HydrophobicContact CZ-CG2 4.18Å; E780-I817 HydrophobicContact CB-CG1 3.85Å; L784-I817 HydrophobicContact CB-CD1 4.25Å; L784-I817 HydrophobicContact CD2-CD1 3.71Å; A813-I817 WeakPolarHBondContact O-CB 3.3Å; A813-I817 WeakPolarHBondContact O-CG1 3.48Å; A813-I817 PolarHBondContact O-N 3.05Å; M814-I817 PolarHBondContact O-N 3.29Å; F815-I817 PolarHBondContact O-N 3.4Å; I817-L820 PolarHBondContact O-N 3.19Å; I817-K821 WeakPolarHBondContact O-CB 3.37Å; I817-K821 PolarHBondContact O-N 3.42Å
818	H	89.6	Confident	88.2	Confident	119 Å²	119	74.2 Å²	74.2	55%	0.551	35%	0.354	S	S	*	.	H	α-helix	trans	-61.4	-46.1	177.7	-175.3	77.7	0	0	0	112.2	M814 F815 R816 L820 K821 L822	M814-H818 WeakPolarHBondContact O-CB 3.31Å; M814-H818 PolarHBondContact O-N 2.94Å; F815-H818 PolarHBondContact O-N 3.05Å; R816-H818 VanDerWaalsContact C-N 3.33Å; R816-H818 PolarHBondContact O-N 3.48Å; H818-L820 PolarHBondContact O-N 2.86Å; H818-K821 PolarHBondContact O-N 3.07Å; H818-L822 PolarHBondContact O-N 3.18Å
819	I	89.8	Confident	88.2	Confident	47 Å²	47	76.8 Å²	76.8	24%	0.241	36%	0.361	C	S	.	.	H	α-helix	trans	-60.9	-44.8	175.9	-71.6	175	0	0	0	111.2	F815 R816 K821 L822 R823	F815-I819 HydrophobicContact CD1-CD1 3.79Å; F815-I819 HydrophobicContact CE1-CD1 3.29Å; F815-I819 HydrophobicContact CE1-CG1 4.37Å; F815-I819 HydrophobicContact CE2-CD1 4.15Å; F815-I819 HydrophobicContact CG-CD1 4.42Å; F815-I819 HydrophobicContact CZ-CD1 3.51Å; F815-I819 HydrophobicContact CZ-CG1 4.32Å; F815-I819 WeakPolarHBondContact O-CG1 3.33Å; F815-I819 PolarHBondContact O-N 3.05Å; R816-I819 PolarHBondContact O-N 3.27Å; I819-K821 VanDerWaalsContact C-N 3.34Å; I819-K821 PolarHBondContact O-N 3.35Å; I819-L822 PolarHBondContact O-N 2.92Å; I819-R823 HydrophobicContact CG2-CG 4.19Å; I819-R823 VanDerWaalsContact CG2-NE 3.32Å; I819-R823 WeakPolarHBondContact O-CB 3.3Å; I819-R823 VanDerWaalsContact O-CG 3.28Å; I819-R823 WeakPolarHBondContact O-CG 3.47Å; I819-R823 PolarHBondContact O-N 3.47Å
820	L	89.5	Confident	88	Confident	17 Å²	17	79.7 Å²	79.7	9%	0.089	38%	0.375	C	S	.	.	H	α-helix	trans	-63.4	-41	-179.8	-73.4	168.6	0	0	0	111.5	I773 R776 F777 E780 R816 I817 H818 R823 L824	I773-L820 HydrophobicContact CG2-CD2 4.46Å; R776-L820 HydrophobicContact CB-CD1 4.28Å; R776-L820 HydrophobicContact CB-CD2 4.22Å; F777-L820 HydrophobicContact CB-CB 4.11Å; F777-L820 HydrophobicContact CD2-CB 4.12Å; E780-L820 HydrophobicContact CB-CD1 4.41Å; E780-L820 HydrophobicContact CG-CD1 3.91Å; R816-L820 WeakPolarHBondContact O-CG 3.49Å; R816-L820 PolarHBondContact O-N 3.46Å; I817-L820 PolarHBondContact O-N 3.19Å; H818-L820 PolarHBondContact O-N 2.86Å; L820-R823 PolarHBondContact O-N 2.88Å; L820-L824 WeakPolarHBondContact O-CB 3.47Å; L820-L824 PolarHBondContact O-N 3.47Å
821	K	88.9	Confident	88	Confident	137 Å²	137	79.9 Å²	79.9	60%	0.596	38%	0.377	S	S	*	.	H	α-helix	trans	-60.2	-47	173	-172.7	178.3	-179.7	179.3	0	111.8	F777 I817 H818 I819 R823 L824 S825	F777-K821 HydrophobicContact CD2-CB 4.33Å; F777-K821 HydrophobicContact CE2-CB 3.98Å; I817-K821 WeakPolarHBondContact O-CB 3.37Å; I817-K821 PolarHBondContact O-N 3.42Å; H818-K821 PolarHBondContact O-N 3.07Å; I819-K821 VanDerWaalsContact C-N 3.34Å; I819-K821 PolarHBondContact O-N 3.35Å; K821-R823 PolarHBondContact O-N 3.15Å; K821-L824 PolarHBondContact O-N 3.01Å; K821-S825 PolarHBondContact O-N 3.12Å
822	L	88.9	Confident	88.2	Confident	72 Å²	72	80.5 Å²	80.5	38%	0.377	38%	0.38	S	S	.	.	H	α-helix	trans	-63.8	-41.5	178	-174	66.8	0	0	0	111.8	H818 I819 S825 R826	H818-L822 PolarHBondContact O-N 3.18Å; I819-L822 PolarHBondContact O-N 2.92Å; L822-S825 PolarHBondContact O-N 2.94Å; L822-R826 WeakPolarHBondContact O-CB 3.3Å; L822-R826 WeakPolarHBondContact O-CG 3.49Å; L822-R826 PolarHBondContact O-N 3.33Å
823	R	88.2	Confident	88.1	Confident	148 Å²	148	82.2 Å²	82.2	56%	0.558	39%	0.385	S	S	*	.	H	α-helix	trans	-62.8	-42.2	176.1	-76.7	176.5	-178.8	179	2.7	111.6	I773 I819 L820 K821 H827	I773-R823 HydrophobicContact CG2-CB 4.45Å; I819-R823 HydrophobicContact CG2-CG 4.19Å; I819-R823 VanDerWaalsContact CG2-NE 3.32Å; I819-R823 WeakPolarHBondContact O-CB 3.3Å; I819-R823 VanDerWaalsContact O-CG 3.28Å; I819-R823 WeakPolarHBondContact O-CG 3.47Å; I819-R823 PolarHBondContact O-N 3.47Å; L820-R823 PolarHBondContact O-N 2.88Å; K821-R823 PolarHBondContact O-N 3.15Å; R823-H827 VanDerWaalsContact O-CB 3.28Å; R823-H827 WeakPolarHBondContact O-CB 3.43Å; R823-H827 PolarHBondContact O-N 2.87Å
824	L	90.4	Very high	87.9	Confident	18 Å²	18	87.8 Å²	87.8	9%	0.094	41%	0.409	C	S	.	.	H	α-helix	trans	-64.9	-45	177.4	-171.6	71.2	0	0	0	111.5	A770 I773 L820 K821 H827 K828	A770-L824 HydrophobicContact CB-CD1 4.43Å; A770-L824 WeakPolarHBondContact O-CD1 3.33Å; I773-L824 HydrophobicContact CB-CD1 4.07Å; I773-L824 HydrophobicContact CG2-CB 3.85Å; I773-L824 HydrophobicContact CG2-CD1 3.99Å; L820-L824 WeakPolarHBondContact O-CB 3.47Å; L820-L824 PolarHBondContact O-N 3.47Å; K821-L824 PolarHBondContact O-N 3.01Å; L824-H827 PolarHBondContact O-N 3.22Å; L824-K828 WeakPolarHBondContact O-CG 3.48Å; L824-K828 PolarHBondContact O-N 3.28Å
825	S	86.9	Confident	87.9	Confident	62 Å²	62	86.5 Å²	86.5	43%	0.434	40%	0.399	S	S	.	.	H	α-helix	trans	-59	-52.9	176.2	-166.5	0	0	0	0	111.2	K821 L822 H827 K828 D829	K821-S825 PolarHBondContact O-N 3.12Å; L822-S825 PolarHBondContact O-N 2.94Å; S825-H827 PolarHBondContact O-N 3.3Å; S825-K828 WeakPolarHBondContact O-CB 3.47Å; S825-K828 PolarHBondContact O-N 2.94Å; S825-D829 VanDerWaalsContact O-CG 3.29Å; S825-D829 PolarHBondContact O-N 3.03Å
826	R	87.4	Confident	87.8	Confident	146 Å²	146	85.2 Å²	85.2	55%	0.551	40%	0.397	S	S	*	.	H	α-helix	trans	-59	-34.5	177.5	-72.6	176.6	178.1	178.4	0.5	112.5	L822 K830	L822-R826 WeakPolarHBondContact O-CB 3.3Å; L822-R826 WeakPolarHBondContact O-CG 3.49Å; L822-R826 PolarHBondContact O-N 3.33Å; R826-K830 WeakPolarHBondContact O-CB 3.18Å; R826-K830 WeakPolarHBondContact O-CG 3.48Å; R826-K830 PolarHBondContact O-N 2.86Å
827	H	88.5	Confident	87.5	Confident	24 Å²	24	83.1 Å²	83.1	11%	0.111	40%	0.4	C	S	.	.	H	α-helix	trans	-68.6	-43	176.4	-170.8	-84.9	0	0	0	111.6	L766 I773 R823 L824 S825 D829 K830 A831	L766-H827 PolarHBondContact O-CE1 2.93Å; I773-H827 HydrophobicContact CD1-CB 4.38Å; R823-H827 VanDerWaalsContact O-CB 3.28Å; R823-H827 WeakPolarHBondContact O-CB 3.43Å; R823-H827 PolarHBondContact O-N 2.87Å; L824-H827 PolarHBondContact O-N 3.22Å; S825-H827 PolarHBondContact O-N 3.3Å; H827-D829 VanDerWaalsContact C-N 3.29Å; H827-D829 PolarHBondContact O-N 3.32Å; H827-K830 PolarHBondContact O-N 2.82Å; H827-A831 WeakPolarHBondContact O-CB 3.46Å; H827-A831 PolarHBondContact O-N 3Å
828	K	86.1	Confident	87.2	Confident	132 Å²	132	83 Å²	83	57%	0.574	40%	0.399	S	S	*	.	H	α-helix	trans	-59.9	-39.1	174.8	-73.2	179.1	177.8	-178.1	0	111.8	L824 S825 P832	L824-K828 WeakPolarHBondContact O-CG 3.48Å; L824-K828 PolarHBondContact O-N 3.28Å; S825-K828 WeakPolarHBondContact O-CB 3.47Å; S825-K828 PolarHBondContact O-N 2.94Å; K828-P832 WeakPolarHBondContact O-CD 3.37Å
829	D	85.6	Confident	86.9	Confident	104 Å²	104	78 Å²	78	56%	0.556	38%	0.377	S	S	*	.	H	α-helix	trans	-71.5	-40.4	179	-58.3	-27.2	0	0	0	112.6	S825 H827	S825-D829 VanDerWaalsContact O-CG 3.29Å; S825-D829 PolarHBondContact O-N 3.03Å; H827-D829 VanDerWaalsContact C-N 3.29Å; H827-D829 PolarHBondContact O-N 3.32Å
830	K	84.1	Confident	86.6	Confident	121 Å²	121	80.9 Å²	80.9	53%	0.526	39%	0.389	S	S	.	.	H	α-helix	trans	-86	-24.7	-175.1	-69.4	-176.2	178	-170.6	0	114.2	R826 H827 Q833 K834	R826-K830 WeakPolarHBondContact O-CB 3.18Å; R826-K830 WeakPolarHBondContact O-CG 3.48Å; R826-K830 PolarHBondContact O-N 2.86Å; H827-K830 PolarHBondContact O-N 2.82Å; K830-Q833 WeakPolarHBondContact O-CB 3.36Å; K830-Q833 PolarHBondContact O-N 3.05Å; K830-K834 PolarHBondContact O-N 3Å
831	A	86.4	Confident	86.2	Confident	17 Å²	17	88 Å²	88	14%	0.14	42%	0.415	C	S	.	.	H	α-helix	trans	-59.7	-44.5	-176.6	0	0	0	0	0	113.3	L766 H827 Q833 K834 Y835	L766-A831 HydrophobicContact CB-CB 4.43Å; L766-A831 HydrophobicContact CD1-CB 4.19Å; L766-A831 HydrophobicContact CD2-CB 4.16Å; H827-A831 WeakPolarHBondContact O-CB 3.46Å; H827-A831 PolarHBondContact O-N 3Å; A831-Q833 VanDerWaalsContact C-N 3.34Å; A831-Q833 PolarHBondContact O-N 2.91Å; A831-K834 PolarHBondContact O-N 3.46Å; A831-Y835 PolarHBondContact O-N 2.98Å
832	P	87.6	Confident	85.8	Confident	73 Å²	73	81.5 Å²	81.5	47%	0.474	39%	0.386	S	S	.	.	H	α-helix	trans	-61.6	-39.7	174.8	-23	33.6	0	0	0	112.9	K828 K834 Y835 L836	K828-P832 WeakPolarHBondContact O-CD 3.37Å; P832-K834 VanDerWaalsContact C-N 3.34Å; P832-K834 PolarHBondContact O-N 3.45Å; P832-Y835 PolarHBondContact O-N 3.16Å; P832-L836 WeakPolarHBondContact O-CG 3.19Å; P832-L836 PolarHBondContact O-N 3.3Å
833	Q	86.7	Confident	85.3	Confident	132 Å²	132	83.2 Å²	83.2	62%	0.617	39%	0.388	S	S	*	.	H	α-helix	trans	-62.8	-41.1	178.1	-62.4	176.6	-10.5	0	0	111.6	K830 A831 L836 A837	K830-Q833 WeakPolarHBondContact O-CB 3.36Å; K830-Q833 PolarHBondContact O-N 3.05Å; A831-Q833 VanDerWaalsContact C-N 3.34Å; A831-Q833 PolarHBondContact O-N 2.91Å; Q833-L836 PolarHBondContact O-N 3.23Å; Q833-A837 VanDerWaalsContact O-CB 3.3Å; Q833-A837 WeakPolarHBondContact O-CB 3.31Å; Q833-A837 PolarHBondContact O-N 3.49Å
834	K	83.3	Confident	84.9	Confident	117 Å²	117	85.7 Å²	85.7	51%	0.509	40%	0.397	S	S	.	.	H	α-helix	trans	-66.5	-38.6	176	-71.6	-174.1	176	-166.6	0	112.7	L766 K830 A831 P832 L838	L766-K834 HydrophobicContact CD2-CD 4.5Å; K830-K834 PolarHBondContact O-N 3Å; A831-K834 PolarHBondContact O-N 3.46Å; P832-K834 VanDerWaalsContact C-N 3.34Å; P832-K834 PolarHBondContact O-N 3.45Å; K834-L838 PolarHBondContact O-N 3.01Å; K834-L838 VanDerWaalsContact O-N 3.09Å
835	Y	88.6	Confident	84.4	Confident	81 Å²	81	86 Å²	86	32%	0.318	40%	0.399	S	S	.	.	H	α-helix	trans	-63.8	-46.6	175.6	-176.2	-88.1	0	0	0	111.4	L759 K763 A831 P832 L838 D839	L759-Y835 HydrophobicContact CB-CE2 3.98Å; L759-Y835 HydrophobicContact CD2-CE2 4.16Å; L759-Y835 WeakPolarHBondContact O-CE2 3.22Å; K763-Y835 HydrophobicContact CB-CD2 4.28Å; K763-Y835 HydrophobicContact CB-CE2 4.02Å; A831-Y835 PolarHBondContact O-N 2.98Å; P832-Y835 PolarHBondContact O-N 3.16Å; Y835-L838 PolarHBondContact O-N 3.22Å; Y835-D839 PolarHBondContact O-N 3.38Å
836	L	85.7	Confident	83.8	Confident	103 Å²	103	87.8 Å²	87.8	54%	0.539	41%	0.409	S	S	.	.	H	α-helix	trans	-63.8	-41.4	176.8	-70.3	171.5	0	0	0	112.2	P832 Q833 L838 D839 E840	P832-L836 WeakPolarHBondContact O-CG 3.19Å; P832-L836 PolarHBondContact O-N 3.3Å; Q833-L836 PolarHBondContact O-N 3.23Å; L836-L838 VanDerWaalsContact C-N 3.32Å; L836-L838 PolarHBondContact O-N 3.46Å; L836-D839 PolarHBondContact O-N 2.79Å; L836-E840 PolarHBondContact O-N 3.07Å
837	A	84.4	Confident	83.1	Confident	49 Å²	49	86.3 Å²	86.3	41%	0.405	40%	0.404	S	S	.	.	H	α-helix	trans	-63	-36.7	177.1	0	0	0	0	0	112.7	Q833 R841	Q833-A837 VanDerWaalsContact O-CB 3.3Å; Q833-A837 WeakPolarHBondContact O-CB 3.31Å; Q833-A837 PolarHBondContact O-N 3.49Å; A837-R841 WeakPolarHBondContact O-CB 3.34Å; A837-R841 WeakPolarHBondContact O-CG 3.25Å; A837-R841 PolarHBondContact O-N 2.83Å
838	L	84.1	Confident	82.4	Confident	24 Å²	24	85.1 Å²	85.1	13%	0.126	40%	0.398	C	S	.	.	H	α-helix	trans	-70	-41.2	173.7	-175.8	64.3	0	0	0	111.3	F732 L759 L762 K834 Y835 L836 E840 R841 L842	F732-L838 HydrophobicContact CD2-CD1 3.98Å; F732-L838 HydrophobicContact CE2-CD1 4.34Å; F732-L838 HydrophobicContact CG-CD1 4.14Å; L759-L838 HydrophobicContact CD2-CB 4.45Å; L759-L838 HydrophobicContact CD2-CD2 4.26Å; L759-L838 HydrophobicContact CD2-CG 4.28Å; L762-L838 HydrophobicContact CB-CD2 3.79Å; L762-L838 HydrophobicContact CD2-CB 3.66Å; L762-L838 HydrophobicContact CD2-CD2 3.38Å; L762-L838 HydrophobicContact CD2-CG 4.13Å; L762-L838 HydrophobicContact CG-CD2 4.1Å; K834-L838 PolarHBondContact O-N 3.01Å; K834-L838 VanDerWaalsContact O-N 3.09Å; Y835-L838 PolarHBondContact O-N 3.22Å; L836-L838 VanDerWaalsContact C-N 3.32Å; L836-L838 PolarHBondContact O-N 3.46Å; L838-E840 VanDerWaalsContact C-N 3.34Å; L838-E840 PolarHBondContact O-N 3.02Å; L838-R841 PolarHBondContact O-N 3.06Å; L838-L842 HydrophobicContact CD1-CG 4.37Å; L838-L842 HydrophobicContact CD2-CD1 4.45Å; L838-L842 HydrophobicContact CG-CD1 4Å; L838-L842 HydrophobicContact CG-CG 4.3Å; L838-L842 WeakPolarHBondContact O-CB 3.45Å; L838-L842 WeakPolarHBondContact O-CG 3.18Å; L838-L842 PolarHBondContact O-N 2.85Å
839	D	83.7	Confident	81.8	Confident	15 Å²	15	80.2 Å²	80.2	8%	0.08	38%	0.382	C	S	.	.	H	α-helix	trans	-60.3	-43.8	175.6	-172.4	50.6	0	0	0	111.4	R755 L759 Y835 L836 R841 L842 R843	R755-D839 IonicContact CZ-OD1 3.29Å; R755-D839 VanDerWaalsContact CZ-OD1 3.29Å; R755-D839 IonicContact NE-OD1 3.03Å; R755-D839 PolarHBondContact NE-OD1 3.26Å; R755-D839 IonicContact NH2-OD1 2.72Å; R755-D839 PolarHBondContact NH2-OD1 3.5Å; R755-D839 IonicContact NH2-OD2 3.44Å; R755-D839 PolarHBondContact NH2-OD2 3.03Å; L759-D839 HydrophobicContact CD1-CB 4.36Å; L759-D839 WeakPolarHBondContact CD1-OD1 3.28Å; L759-D839 HydrophobicContact CD2-CB 4.04Å; Y835-D839 PolarHBondContact O-N 3.38Å; L836-D839 PolarHBondContact O-N 2.79Å; D839-R841 VanDerWaalsContact C-N 3.35Å; D839-R841 PolarHBondContact O-N 3.35Å; D839-L842 PolarHBondContact O-N 3.03Å; D839-R843 VanDerWaalsContact O-CG 3.25Å; D839-R843 WeakPolarHBondContact O-CG 3.47Å; D839-R843 PolarHBondContact O-N 2.99Å; D839-R843 IonicContact OD1-NE 3.9Å; D839-R843 IonicContact OD2-CZ 3.25Å; D839-R843 VanDerWaalsContact OD2-CZ 3.25Å; D839-R843 IonicContact OD2-NE 3.08Å; D839-R843 PolarHBondContact OD2-NE 3.33Å; D839-R843 VanDerWaalsContact OD2-NE 3.08Å; D839-R843 IonicContact OD2-NH2 2.7Å; D839-R843 PolarHBondContact OD2-NH2 3.33Å
840	E	82.6	Confident	81.1	Confident	106 Å²	106	81.6 Å²	81.6	50%	0.495	39%	0.39	S	S	.	.	H	α-helix	trans	-62.8	-38.6	174.4	-74.5	-169.4	169.9	0	0	113.1	L836 L838 R843 R844	L836-E840 PolarHBondContact O-N 3.07Å; L838-E840 VanDerWaalsContact C-N 3.34Å; L838-E840 PolarHBondContact O-N 3.02Å; E840-R843 PolarHBondContact O-N 3.44Å; E840-R844 WeakPolarHBondContact O-CG 3.42Å; E840-R844 PolarHBondContact O-N 2.7Å
841	R	81	Confident	80.3	Confident	167 Å²	167	78.6 Å²	78.6	63%	0.63	38%	0.377	S	S	*	.	H	α-helix	trans	-64.7	-45.4	175	-81.3	179.2	163.2	-167.9	-6.4	111.8	A837 L838 D839 R843 R844 D845	A837-R841 WeakPolarHBondContact O-CB 3.34Å; A837-R841 WeakPolarHBondContact O-CG 3.25Å; A837-R841 PolarHBondContact O-N 2.83Å; L838-R841 PolarHBondContact O-N 3.06Å; D839-R841 VanDerWaalsContact C-N 3.35Å; D839-R841 PolarHBondContact O-N 3.35Å; R841-R843 PolarHBondContact O-N 3.08Å; R841-R844 PolarHBondContact O-N 2.72Å; R841-R844 VanDerWaalsContact O-N 3.12Å; R841-D845 PolarHBondContact O-N 3.17Å
842	L	82	Confident	79.2	Confident	0 Å²	0	78.3 Å²	78.3	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-62.3	-31.6	176.5	-71.8	169.1	0	0	0	112.4	F732 L733 R755 C758 L759 L838 D839 L848	F732-L842 HydrophobicContact CD2-CD2 3.95Å; F732-L842 HydrophobicContact CE2-CD2 3.67Å; F732-L842 HydrophobicContact CE2-CG 4.34Å; L733-L842 HydrophobicContact CD1-CD2 4.08Å; L733-L842 HydrophobicContact CD2-CD2 3.65Å; L733-L842 HydrophobicContact CG-CD2 4.02Å; R755-L842 HydrophobicContact CG-CD1 4.35Å; C758-L842 HydrophobicContact CB-CD1 4.31Å; L759-L842 HydrophobicContact CD2-CD1 3.84Å; L759-L842 HydrophobicContact CG-CD1 3.82Å; L838-L842 HydrophobicContact CD1-CG 4.37Å; L838-L842 HydrophobicContact CD2-CD1 4.45Å; L838-L842 HydrophobicContact CG-CD1 4Å; L838-L842 HydrophobicContact CG-CG 4.3Å; L838-L842 WeakPolarHBondContact O-CB 3.45Å; L838-L842 WeakPolarHBondContact O-CG 3.18Å; L838-L842 PolarHBondContact O-N 2.85Å; D839-L842 PolarHBondContact O-N 3.03Å; L842-L848 HydrophobicContact CB-CD1 4.47Å; L842-L848 HydrophobicContact CD2-CD1 3.72Å
843	R	78.9	Confident	77.8	Confident	108 Å²	108	83.6 Å²	83.6	41%	0.408	38%	0.384	S	S	.	.	H	α-helix	trans	-70.1	-33	174.6	-71.7	-178.4	-163.6	-165.5	5	113.6	D839 E840 R841 W853	D839-R843 VanDerWaalsContact O-CG 3.25Å; D839-R843 WeakPolarHBondContact O-CG 3.47Å; D839-R843 PolarHBondContact O-N 2.99Å; D839-R843 IonicContact OD1-NE 3.9Å; D839-R843 IonicContact OD2-CZ 3.25Å; D839-R843 VanDerWaalsContact OD2-CZ 3.25Å; D839-R843 IonicContact OD2-NE 3.08Å; D839-R843 PolarHBondContact OD2-NE 3.33Å; D839-R843 VanDerWaalsContact OD2-NE 3.08Å; D839-R843 IonicContact OD2-NH2 2.7Å; D839-R843 PolarHBondContact OD2-NH2 3.33Å; E840-R843 PolarHBondContact O-N 3.44Å; R841-R843 PolarHBondContact O-N 3.08Å; R843-W853 HydrophobicContact CG-CZ2 3.64Å
844	R	78.9	Confident	77.4	Confident	200 Å²	200	81.2 Å²	81.2	76%	0.755	37%	0.372	S	S	*	.	H	α-helix	trans	-91.5	-7.2	-179	-66.5	179.4	-175.8	168.2	7.3	112.9	E840 R841	E840-R844 WeakPolarHBondContact O-CG 3.42Å; E840-R844 PolarHBondContact O-N 2.7Å; R841-R844 PolarHBondContact O-N 2.72Å; R841-R844 VanDerWaalsContact O-N 3.12Å
845	D	79.3	Confident	77	Confident	26 Å²	26	79.3 Å²	79.3	14%	0.139	37%	0.365	C	S	.	.			trans	-70.4	124.3	-178.8	-167.7	-62	0	0	0	110.7	R841 R847 L848 A849	R841-D845 PolarHBondContact O-N 3.17Å; D845-R847 PolarHBondContact O-N 2.89Å; D845-R847 VanDerWaalsContact O-N 3.15Å; D845-R847 VanDerWaalsContact OD1-CB 3.31Å; D845-R847 WeakPolarHBondContact OD1-CB 3.41Å; D845-R847 PolarHBondContact OD1-N 3.13Å; D845-L848 PolarHBondContact O-N 3.4Å; D845-L848 VanDerWaalsContact O-N 3.07Å; D845-A849 WeakPolarHBondContact O-CB 3.29Å; D845-A849 PolarHBondContact O-N 3.03Å
846	P	74.2	Confident	76.4	Confident	99 Å²	99	79.2 Å²	79.2	64%	0.643	37%	0.368	S	S	*	.	H	α-helix	trans	-60.8	-25.4	-176.3	24.9	-34.4	0	0	0	113.8	L848	P846-L848 VanDerWaalsContact C-N 3.3Å; P846-L848 PolarHBondContact O-N 3.03Å
847	R	73.3	Confident	75.9	Confident	114 Å²	114	77.8 Å²	77.8	43%	0.43	36%	0.358	S	S	.	.	H	α-helix	trans	-73.4	-22.9	178.8	-57.7	-179.7	-175.1	164.8	6.3	112.7	D731 D845	D731-R847 IonicContact OD1-NH1 3.29Å; D731-R847 PolarHBondContact OD1-NH1 3.28Å; D731-R847 IonicContact OD2-CZ 3.09Å; D731-R847 IonicContact OD2-NH1 3.48Å; D731-R847 PolarHBondContact OD2-NH1 3.47Å; D731-R847 IonicContact OD2-NH2 2.71Å; D731-R847 PolarHBondContact OD2-NH2 3.35Å; D731-R847 VanDerWaalsContact OD2-NH2 3.09Å; D845-R847 PolarHBondContact O-N 2.89Å; D845-R847 VanDerWaalsContact O-N 3.15Å; D845-R847 VanDerWaalsContact OD1-CB 3.31Å; D845-R847 WeakPolarHBondContact OD1-CB 3.41Å; D845-R847 PolarHBondContact OD1-N 3.13Å
848	L	74.6	Confident	75.3	Confident	0 Å²	0	79.6 Å²	79.6	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-114.8	-30.2	-176.2	-74.9	179.6	0	0	0	113.1	L733 A751 L754 L842 D845 P846 N850 H851 L852	L733-L848 HydrophobicContact CD1-CD1 3.67Å; L733-L848 HydrophobicContact CD1-CG 4.13Å; L733-L848 HydrophobicContact CD2-CD1 3.96Å; L733-L848 HydrophobicContact CG-CD1 4.47Å; A751-L848 HydrophobicContact CB-CD2 3.75Å; L754-L848 HydrophobicContact CD2-CD2 4.06Å; L842-L848 HydrophobicContact CB-CD1 4.47Å; L842-L848 HydrophobicContact CD2-CD1 3.72Å; D845-L848 PolarHBondContact O-N 3.4Å; D845-L848 VanDerWaalsContact O-N 3.07Å; P846-L848 VanDerWaalsContact C-N 3.3Å; P846-L848 PolarHBondContact O-N 3.03Å; L848-N850 VanDerWaalsContact C-N 3.3Å; L848-N850 PolarHBondContact O-N 3.28Å; L848-H851 PolarHBondContact O-N 3.09Å; L848-H851 VanDerWaalsContact O-N 3.09Å; L848-L852 HydrophobicContact CB-CD1 3.73Å; L848-L852 HydrophobicContact CB-CG 4.32Å; L848-L852 HydrophobicContact CD1-CD1 4.39Å; L848-L852 HydrophobicContact CD2-CD1 4.36Å; L848-L852 HydrophobicContact CG-CD1 4.4Å; L848-L852 WeakPolarHBondContact O-CB 3.39Å; L848-L852 VanDerWaalsContact O-CG 3.29Å; L848-L852 WeakPolarHBondContact O-CG 3.29Å; L848-L852 PolarHBondContact O-N 3.27Å
849	A	73.8	Confident	74.7	Confident	28 Å²	28	83.3 Å²	83.3	23%	0.231	37%	0.37	C	S	.	.	H	α-helix	trans	-58	-38.9	-174.4	0	0	0	0	0	113	D845 H851	D845-A849 WeakPolarHBondContact O-CB 3.29Å; D845-A849 PolarHBondContact O-N 3.03Å; A849-H851 VanDerWaalsContact C-N 3.26Å; A849-H851 PolarHBondContact O-N 3.33Å
850	N	70.5	Confident	74.1	Confident	134 Å²	134	88.1 Å²	88.1	72%	0.717	39%	0.391	S	S	*	.	H	α-helix	trans	-72.7	-14.7	-178.9	-67.3	-19.7	0	0	0	114.1	L848	L848-N850 VanDerWaalsContact C-N 3.3Å; L848-N850 PolarHBondContact O-N 3.28Å
851	H	67.7	Low	73.4	Confident	58 Å²	58	86.8 Å²	86.8	27%	0.269	38%	0.382	S	S	.	.	H	α-helix	trans	-113.1	-26.5	-174.5	-63.3	-63.5	0	0	0	113.1	L746 R748 A751 L848 A849	L746-H851 PolarHBondContact O-CE1 3.19Å; L746-H851 PolarHBondContact O-ND1 3.46Å; L746-H851 PolarHBondContact O-NE2 2.95Å; R748-H851 VanDerWaalsContact CG-O 3.29Å; R748-H851 WeakPolarHBondContact CG-O 3.23Å; A751-H851 HydrophobicContact CB-CB 3.61Å; L848-H851 PolarHBondContact O-N 3.09Å; L848-H851 VanDerWaalsContact O-N 3.09Å; A849-H851 VanDerWaalsContact C-N 3.26Å; A849-H851 PolarHBondContact O-N 3.33Å
852	L	62.8	Low	72.8	Confident	11 Å²	11	80.1 Å²	80.1	6%	0.058	36%	0.362	C	S	.	.	H	α-helix	trans	-87.8	-20.3	-174.7	-70	-179.5	0	0	0	114	A751 L752 R755 L848	A751-L852 HydrophobicContact CB-CD2 4.16Å; A751-L852 HydrophobicContact CB-CG 4.42Å; L752-L852 HydrophobicContact CB-CD2 4.25Å; L752-L852 HydrophobicContact CD2-CD2 3.46Å; L752-L852 VanDerWaalsContact CD2-CD2 3.46Å; L752-L852 HydrophobicContact CG-CD2 3.63Å; R755-L852 HydrophobicContact CB-CD1 4.2Å; R755-L852 HydrophobicContact CG-CD1 4.49Å; L848-L852 HydrophobicContact CB-CD1 3.73Å; L848-L852 HydrophobicContact CB-CG 4.32Å; L848-L852 HydrophobicContact CD1-CD1 4.39Å; L848-L852 HydrophobicContact CD2-CD1 4.36Å; L848-L852 HydrophobicContact CG-CD1 4.4Å; L848-L852 WeakPolarHBondContact O-CB 3.39Å; L848-L852 VanDerWaalsContact O-CG 3.29Å; L848-L852 WeakPolarHBondContact O-CG 3.29Å; L848-L852 PolarHBondContact O-N 3.27Å
853	W	57.8	Low	72	Confident	183 Å²	183	87.4 Å²	87.4	69%	0.693	40%	0.395	S	S	*	.			trans	-124.5	0	-171.6	-57.6	107.4	0	0	0	112.1	R843	R843-W853 HydrophobicContact CG-CZ2 3.64Å

Retrieved 853 of 853 residues in 993.2 ms (Link to these results)

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