A0A5K4F0V5_SCHMA Loading...

SAM domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F0V5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 998 aa.

						>A0A5K4F0V5_SCHMA|A0A5K4F0V5
MESDDSCEISSVITRADTKSDLSDNQISGWSSHQNLRKANYPSCDGYLSNVEVLSDSCPNKQFHIFSLKLREQRKKIKLLEQERIGFLEQIASLCSSLEKKQQELVDVLKLSEEKAKYHAHYMTEVSSLLAELKTLFSEHSNCFNPENQVLIDQGELEDKNEVSNGTGTEKVPFNSTSGSTKGALRSEFQQDHRSRALINALSTTVSAAKNMNSKKLSKSGHPPQTQQIFDTLSSKPLNSSDPINASTNQLPNKLNRHVQVTKNPIASDVCILPSFCWNTDHVLYWLREYVCLPGGCLEAASRLRLDGKQLTSVFDRKIEKQLHLNDEGLRKKFFTALEDLRIHGPPGISRHPGPSHISYQWICDIWLKHHLGLVQLIPIFSIRRVDGRMLSSLITYKRSKHYIQHKNRRKSKDIHHNCNNDNNSHNIIISNPNGDIPVSNPSQQNLINLKNNQINGSSSSNNDNISNHSSIKSISSVSSTSSLTNAVQDSSSHINSSNKYDNDNEYIERNWQVAGRREMLHILLGLSHTSSSSSSSGADLSIDSRYLLGKKEAESLRTAIELLHHHNFNIELIEQIRAKSDLSELDLLYWTNDHIVKWLSDLGLSDFVHGINASGLHGAYMVLDTTFDFNTLIKRLHIPLNVAVVCKLEENLQRILKPARIREGISTKQHRIFRRRSISRLNCTNSIMQRSMTSTNTINGSCSSLINSSEFQTKSSTDNNSYKHLKMNGDVYNMNHNKNTVITSLTKTDVIRDAESLDLTVKDIDLTLNNPIGLTPRREKRRILTVTGDLMNSNRLTRVFTRGHKTSNVNEQSNKSLLNTQVSKQLSVMGLNNNNNNGINVNSSNDNLDWSSDIEDKSSTLVRKTSDKSSDNSSALKQLNSLDCKKTTPPRQVVQPHEAPLLDPFGSDCGKPRLRILLGQTNRLNSLSGISSNMKFNPNTTYKNISDHKNNLASHQSLAKSCMTSTFTATSLVSKGSTNSINSISSSYIIPISKTDF
					

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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	42.1	Very low	35.5	Very low	193 Å²	193	133.9 Å²	133.9	95%	0.951	76%	0.761	S	S	*	*				0	-29.8	0	-86.8	-178.5	69.2	0	0	111.6
2	E	38.1	Very low	35.1	Very low	150 Å²	150	132.7 Å²	132.7	70%	0.701	76%	0.758	S	S	*	*			trans	-103.2	37.3	169.1	-61.1	176.8	149.1	0	0	111.9	P243	E2-P243 WeakPolarHBondContact OE2-CB 3.35Å
3	S	42.4	Very low	34.9	Very low	87 Å²	87	134.5 Å²	134.5	61%	0.608	76%	0.761	S	S	*	*	S	Bend	trans	-147.8	1.7	-167.8	62.4	0	0	0	0	115.7
4	D	40.6	Very low	34.8	Very low	113 Å²	113	134.8 Å²	134.8	60%	0.604	77%	0.768	S	S	*	*			trans	-102.7	-6.6	-170.8	-59.3	-27.5	0	0	0	112.4	S6	D4-S6 PolarHBondContact O-N 3.26Å
5	D	36.6	Very low	34.2	Very low	165 Å²	165	142.9 Å²	142.9	88%	0.882	78%	0.781	S	S	*	*	S	Bend	trans	-94.2	39.2	-176.9	-63.5	-29	0	0	0	114.1
6	S	32.8	Very low	34	Very low	99 Å²	99	138.9 Å²	138.9	69%	0.692	77%	0.773	S	S	*	*			trans	-159.1	92.8	164.9	67.4	0	0	0	0	113.3	D4	D4-S6 PolarHBondContact O-N 3.26Å
7	C	35.1	Very low	33.9	Very low	108 Å²	108	139.1 Å²	139.1	73%	0.73	77%	0.772	S	S	*	*			trans	177.3	75	136.8	-100.7	0	0	0	0	112.1	I9	C7-I9 PolarHBondContact O-N 3.11Å
8	E	29.9	Very low	34.2	Very low	196 Å²	196	138.6 Å²	138.6	92%	0.916	77%	0.774	S	S	*	*			trans	-68.7	62.7	156.2	-69.3	-167.8	123.8	0	0	111
9	I	30.1	Very low	34.1	Very low	131 Å²	131	141.4 Å²	141.4	67%	0.672	78%	0.777	S	S	*	*			trans	-137.1	68.1	180	-46.5	179.3	0	0	0	110.2	C7	C7-I9 PolarHBondContact O-N 3.11Å
10	S	32.5	Very low	34.2	Very low	117 Å²	117	139.3 Å²	139.3	82%	0.818	77%	0.773	S	S	*	*			trans	-164.4	17.9	161	-81.8	0	0	0	0	114	V12	S10-V12 PolarHBondContact O-N 2.82Å
11	S	29.8	Very low	34.2	Very low	114 Å²	114	139.3 Å²	139.3	80%	0.797	77%	0.772	S	S	*	*			trans	-82.6	17.4	175.8	50.7	0	0	0	0	113.8
12	V	31.3	Very low	33.8	Very low	119 Å²	119	137.3 Å²	137.3	72%	0.721	76%	0.764	S	S	*	*			trans	-123.8	139.4	-178.9	-170.5	0	0	0	0	108.3	S10	S10-V12 PolarHBondContact O-N 2.82Å
13	I	31.9	Very low	33.6	Very low	156 Å²	156	134.2 Å²	134.2	80%	0.8	76%	0.759	S	S	*	*	S	Bend	trans	76.3	66.4	-173.3	-39	167.5	0	0	0	114.3
14	T	33.5	Very low	33.2	Very low	139 Å²	139	136.4 Å²	136.4	85%	0.853	76%	0.764	S	S	*	*				-172	85.9	112.6	41.1	0	0	0	0	109.5
15	R	26.9	Very low	32.8	Very low	256 Å²	256	137.4 Å²	137.4	97%	0.966	77%	0.769	S	S	*	*			trans	-83.2	104.6	156.4	-82	-176.8	169.1	98.1	-2.3	107.4
16	A	30.4	Very low	32.7	Very low	80 Å²	80	137.9 Å²	137.9	66%	0.661	77%	0.766	S	S	*	*			trans	-157.7	126.9	157.7	0	0	0	0	0	109.3
17	D	33	Very low	32.5	Very low	142 Å²	142	139.6 Å²	139.6	76%	0.759	77%	0.766	S	S	*	*			trans	70.8	91.1	152	-50.2	-26.9	0	0	0	120.6
18	T	38.8	Very low	32.2	Very low	130 Å²	130	140 Å²	140	80%	0.798	77%	0.77	S	S	*	*			trans	62.1	140	134.6	62.2	0	0	0	0	120.2
19	K	31.9	Very low	32	Very low	191 Å²	191	133.3 Å²	133.3	83%	0.83	75%	0.754	S	S	*	*			cis	170.1	160.9	-22.6	-126.6	-170.9	176.1	-173.8	0	104.2
20	S	35.8	Very low	32	Very low	99 Å²	99	139.4 Å²	139.4	69%	0.692	77%	0.769	S	S	*	*			trans	63.3	109.5	178.8	42.2	0	0	0	0	115.7
21	D	34.3	Very low	31.7	Very low	141 Å²	141	138.7 Å²	138.7	75%	0.754	76%	0.763	S	S	*	*				70.7	132.7	57.5	-56.4	-38.8	0	0	0	111.2
22	L	35	Very low	31.7	Very low	151 Å²	151	137.7 Å²	137.7	79%	0.791	76%	0.756	S	S	*	*			cis	-156.4	-170.6	3.4	-117.4	164.4	0	0	0	109.7
23	S	32.6	Very low	31.7	Very low	85 Å²	85	139.5 Å²	139.5	59%	0.594	76%	0.757	S	S	*	*			trans	-46.3	166.7	176.7	66.2	0	0	0	0	115.7
24	D	35.3	Very low	31.7	Very low	132 Å²	132	138.9 Å²	138.9	71%	0.706	75%	0.75	S	S	*	*			cis	-162.5	174.9	41.8	-124.6	-56.7	0	0	0	115.6
25	N	31.1	Very low	31.6	Very low	135 Å²	135	138.6 Å²	138.6	72%	0.722	74%	0.744	S	S	*	*			trans	-52	144.8	178.6	-63.6	-85.3	0	0	0	115.7
26	Q	34.3	Very low	32	Very low	174 Å²	174	134 Å²	134	81%	0.813	74%	0.738	S	S	*	*				-179	128.5	113.3	-98.4	179	61.3	0	0	115.9
27	I	28.7	Very low	32	Very low	136 Å²	136	140.4 Å²	140.4	70%	0.697	75%	0.745	S	S	*	*				53.9	108	127	-60.2	173.6	0	0	0	120.1
28	S	28.3	Very low	32.1	Very low	116 Å²	116	142.8 Å²	142.8	81%	0.811	75%	0.748	S	S	*	*			trans	48.9	137.9	140.6	80.4	0	0	0	0	122.6
29	G	26.9	Very low	31.9	Very low	56 Å²	56	140.5 Å²	140.5	58%	0.577	74%	0.742	S	S	*	*			trans	136.5	124.2	136.9	0	0	0	0	0	116.5
30	W	29.6	Very low	32	Very low	259 Å²	259	137.5 Å²	137.5	98%	0.981	74%	0.735	S	S	*	*			trans	71.3	112.2	153.1	-47.7	-18.6	0	0	0	115.9
31	S	26.9	Very low	31.8	Very low	101 Å²	101	142.8 Å²	142.8	71%	0.706	74%	0.742	S	S	*	*				83.9	107.4	64.1	-171.9	0	0	0	0	113.8
32	S	29.2	Very low	32.2	Very low	93 Å²	93	141.7 Å²	141.7	65%	0.65	74%	0.742	S	S	*	*			trans	75.6	156.1	141.8	-55.3	0	0	0	0	120.2
33	H	31.4	Very low	32	Very low	157 Å²	157	139.7 Å²	139.7	73%	0.727	74%	0.741	S	S	*	*			trans	72.5	137.6	175.1	-59.8	-83.2	0	0	0	116.6
34	Q	31.9	Very low	32.2	Very low	143 Å²	143	140.5 Å²	140.5	67%	0.668	75%	0.745	S	S	*	*			cis	167.1	142.4	-21.5	-117.2	178.2	-1	0	0	104
35	N	31.2	Very low	32	Very low	133 Å²	133	141.8 Å²	141.8	71%	0.711	75%	0.752	S	S	*	*			trans	56.4	121.9	150.3	-58.3	-37.7	0	0	0	120.4
36	L	36	Very low	32	Very low	160 Å²	160	138.6 Å²	138.6	84%	0.838	75%	0.751	S	S	*	*				170	95.4	122.4	-88	153	0	0	0	108.1
37	R	30.7	Very low	31.9	Very low	215 Å²	215	141.6 Å²	141.6	81%	0.811	76%	0.757	S	S	*	*				62.7	116.9	96.7	-84.8	-167.8	175	-167.1	2.6	116.3
38	K	33.4	Very low	32.3	Very low	192 Å²	192	143 Å²	143	84%	0.835	76%	0.764	S	S	*	*			trans	45.7	129.7	135.9	-59.8	-176.2	171.7	-171.9	0	117.8
39	A	35.8	Very low	32.4	Very low	81 Å²	81	141.4 Å²	141.4	67%	0.669	75%	0.754	S	S	*	*				179.6	164.8	56.3	0	0	0	0	0	112
40	N	33	Very low	32.6	Very low	128 Å²	128	146.4 Å²	146.4	68%	0.684	77%	0.767	S	S	*	*			trans	30.8	139.4	145.8	-46.1	-6.5	0	0	0	120.2
41	Y	33	Very low	32.8	Very low	211 Å²	211	140.2 Å²	140.2	83%	0.827	76%	0.758	S	S	*	*			cis	-162.4	161.3	48.5	-91.2	-89.2	0	0	0	112.6
42	P	41.3	Very low	33	Very low	118 Å²	118	144.8 Å²	144.8	77%	0.766	77%	0.768	S	S	*	*			trans	-108	153	167.2	38.5	-30	0	0	0	113.7
43	S	32.2	Very low	33.4	Very low	108 Å²	108	145.9 Å²	145.9	76%	0.755	77%	0.77	S	S	*	*			trans	-170.4	162.4	159.8	-162.6	0	0	0	0	114.4
44	C	35.9	Very low	33.4	Very low	102 Å²	102	146.3 Å²	146.3	69%	0.689	78%	0.777	S	S	*	*			trans	77	111	167.2	-56.3	0	0	0	0	116
45	D	32.2	Very low	33.6	Very low	160 Å²	160	144.8 Å²	144.8	86%	0.856	78%	0.782	S	S	*	*				65.8	136.3	63.1	-60	-40.6	0	0	0	112.5
46	G	30.4	Very low	33.7	Very low	68 Å²	68	146.1 Å²	146.1	70%	0.701	79%	0.789	S	S	*	*			cis	-175.4	172.1	0.9	0	0	0	0	0	110.3
47	Y	33	Very low	33.6	Very low	236 Å²	236	143.6 Å²	143.6	93%	0.925	79%	0.785	S	S	*	*			trans	-50.1	142.5	-177.4	-72.4	-102.5	0	0	0	115.1
48	L	35.4	Very low	33.7	Very low	165 Å²	165	138.7 Å²	138.7	86%	0.864	78%	0.783	S	S	*	*			trans	-160.3	114.1	142.5	-106.9	165.2	0	0	0	113.5
49	S	31.4	Very low	34.4	Very low	84 Å²	84	133.4 Å²	133.4	59%	0.587	77%	0.768	S	S	*	*			trans	25.1	123	148.4	60	0	0	0	0	122.9
50	N	30.3	Very low	34.8	Very low	161 Å²	161	135.5 Å²	135.5	86%	0.861	77%	0.768	S	S	*	*				30.3	104.1	123.9	-56.5	-1.5	0	0	0	118.7
51	V	33.4	Very low	35.7	Very low	128 Å²	128	138 Å²	138	78%	0.776	77%	0.773	S	S	*	*			trans	-133.3	102.8	149.8	174	0	0	0	0	108	V53	V51-V53 HydrophobicContact CG1-CG2 3.79Å; V51-V53 PolarHBondContact O-N 3.2Å
52	E	31.3	Very low	36.7	Very low	198 Å²	198	134.5 Å²	134.5	93%	0.925	76%	0.764	S	S	*	*			trans	-73	115.7	162.7	-73.7	-178.8	126.7	0	0	108.4
53	V	38.2	Very low	37.9	Very low	115 Å²	115	135.8 Å²	135.8	70%	0.697	76%	0.758	S	S	*	*			trans	-122	111.6	161.1	168.7	0	0	0	0	108.3	V51 S55	V51-V53 HydrophobicContact CG1-CG2 3.79Å; V51-V53 PolarHBondContact O-N 3.2Å; V53-S55 PolarHBondContact O-N 2.87Å
54	L	32.4	Very low	39.6	Very low	167 Å²	167	136.4 Å²	136.4	87%	0.874	75%	0.748	S	S	*	*			trans	-57.8	125.6	172.7	-68.7	159.4	0	0	0	110.3
55	S	35.2	Very low	41.5	Very low	111 Å²	111	135.9 Å²	135.9	78%	0.776	74%	0.738	S	S	*	*			trans	-153.7	80	157.6	38.9	0	0	0	0	109.4	V53 S57	V53-S55 PolarHBondContact O-N 2.87Å; S55-S57 PolarHBondContact O-N 2.91Å
56	D	34.3	Very low	43.5	Very low	160 Å²	160	134.5 Å²	134.5	86%	0.856	72%	0.724	S	S	*	*			trans	-61.8	116.6	161.5	-94.5	-39.5	0	0	0	109.2
57	S	32.4	Very low	45.8	Very low	108 Å²	108	133.7 Å²	133.7	76%	0.755	71%	0.708	S	S	*	*			trans	-176.5	122.9	143.5	-88.1	0	0	0	0	112.9	S55	S55-S57 PolarHBondContact O-N 2.91Å
58	C	33.3	Very low	48.1	Very low	112 Å²	112	126.8 Å²	126.8	76%	0.757	69%	0.686	S	S	*	*	S	Bend	trans	63.9	-168.4	142.3	-138.3	0	0	0	0	115.3	N60	C58-N60 VanDerWaalsContact C-N 3.26Å; C58-N60 PolarHBondContact O-N 2.7Å
59	P	47.7	Very low	50.3	Low	81 Å²	81	125 Å²	125	53%	0.526	67%	0.672	S	S	.	*	T	Hydrogen-bonded Turn		-72.6	-0.9	-117.6	-13.2	30	0	0	0	117.4	K61 Q62 F63	P59-K61 PolarHBondContact O-N 2.82Å; P59-Q62 PolarHBondContact O-N 2.93Å; P59-Q62 VanDerWaalsContact O-N 3.07Å; P59-F63 PolarHBondContact O-N 2.74Å
60	N	45.5	Very low	52.7	Low	124 Å²	124	126 Å²	126	66%	0.663	67%	0.67	S	S	*	*	H	α-helix	trans	-61.3	-37.4	-163.2	-81.3	-24.4	0	0	0	114.9	C58 Q62 F63 H64	C58-N60 VanDerWaalsContact C-N 3.26Å; C58-N60 PolarHBondContact O-N 2.7Å; N60-Q62 VanDerWaalsContact C-N 3.32Å; N60-Q62 PolarHBondContact O-N 2.82Å; N60-F63 PolarHBondContact O-N 3.1Å; N60-H64 VanDerWaalsContact O-CB 3.22Å; N60-H64 WeakPolarHBondContact O-CB 3.06Å; N60-H64 PolarHBondContact O-N 2.75Å
61	K	51.7	Low	55.2	Low	182 Å²	182	126.7 Å²	126.7	79%	0.791	66%	0.661	S	S	*	*	H	α-helix	trans	-63.6	-39.1	176.1	-77	179	179.2	169.8	0	111.9	P59 I65	P59-K61 PolarHBondContact O-N 2.82Å; K61-I65 WeakPolarHBondContact O-CD1 3.47Å; K61-I65 VanDerWaalsContact O-CG1 3.27Å; K61-I65 WeakPolarHBondContact O-CG1 3.5Å; K61-I65 PolarHBondContact O-N 2.85Å
62	Q	53.4	Low	57.6	Low	137 Å²	137	126.3 Å²	126.3	64%	0.64	65%	0.65	S	S	*	*	H	α-helix	trans	-73.2	-41.4	179.1	-144.2	169.2	18.1	0	0	110.7	P59 N60 H64 I65 F66	P59-Q62 PolarHBondContact O-N 2.93Å; P59-Q62 VanDerWaalsContact O-N 3.07Å; N60-Q62 VanDerWaalsContact C-N 3.32Å; N60-Q62 PolarHBondContact O-N 2.82Å; Q62-H64 VanDerWaalsContact C-N 3.32Å; Q62-H64 PolarHBondContact O-N 3.1Å; Q62-I65 PolarHBondContact O-N 2.8Å; Q62-F66 WeakPolarHBondContact O-CD2 3.22Å; Q62-F66 PolarHBondContact O-N 2.84Å
63	F	65.9	Low	60.2	Low	145 Å²	145	121.8 Å²	121.8	64%	0.636	63%	0.629	S	S	*	*	H	α-helix	trans	-62.5	-37.6	173.9	-153	-86.6	0	0	0	112.4	P59 N60 F66 S67	P59-F63 PolarHBondContact O-N 2.74Å; N60-F63 PolarHBondContact O-N 3.1Å; F63-F66 PolarHBondContact O-N 2.84Å; F63-S67 VanDerWaalsContact O-CB 3.31Å; F63-S67 WeakPolarHBondContact O-CB 3.44Å; F63-S67 PolarHBondContact O-N 2.88Å; F63-S67 PolarHBondContact O-OG 3.11Å
64	H	68.4	Low	62.5	Low	120 Å²	120	125 Å²	125	56%	0.556	63%	0.629	S	S	*	*	H	α-helix	trans	-70.8	-36.9	176.9	-158	-26.8	0	0	0	112	N60 Q62 S67 L68	N60-H64 VanDerWaalsContact O-CB 3.22Å; N60-H64 WeakPolarHBondContact O-CB 3.06Å; N60-H64 PolarHBondContact O-N 2.75Å; Q62-H64 VanDerWaalsContact C-N 3.32Å; Q62-H64 PolarHBondContact O-N 3.1Å; H64-S67 PolarHBondContact O-N 2.67Å; H64-L68 WeakPolarHBondContact O-CB 3.46Å; H64-L68 VanDerWaalsContact O-CG 3.28Å; H64-L68 WeakPolarHBondContact O-CG 3.45Å; H64-L68 PolarHBondContact O-N 3.02Å
65	I	75.1	Confident	65.2	Low	92 Å²	92	124 Å²	124	47%	0.472	62%	0.618	S	S	.	*	H	α-helix	trans	-65.7	-43.2	171.8	-70.3	164.5	0	0	0	111.1	K61 Q62 L68 K69	K61-I65 WeakPolarHBondContact O-CD1 3.47Å; K61-I65 VanDerWaalsContact O-CG1 3.27Å; K61-I65 WeakPolarHBondContact O-CG1 3.5Å; K61-I65 PolarHBondContact O-N 2.85Å; Q62-I65 PolarHBondContact O-N 2.8Å; I65-L68 PolarHBondContact O-N 3.3Å; I65-K69 PolarHBondContact O-N 3.29Å
66	F	74.1	Confident	67.6	Low	130 Å²	130	124.4 Å²	124.4	57%	0.57	61%	0.605	S	S	*	*	H	α-helix	trans	-63.6	-41.6	174.3	-93.3	-76.1	0	0	0	112	Q62 F63 L68 K69 L70	Q62-F66 WeakPolarHBondContact O-CD2 3.22Å; Q62-F66 PolarHBondContact O-N 2.84Å; F63-F66 PolarHBondContact O-N 2.84Å; F66-L68 VanDerWaalsContact C-N 3.35Å; F66-L68 PolarHBondContact O-N 2.89Å; F66-K69 PolarHBondContact O-N 3.39Å; F66-L70 WeakPolarHBondContact O-CB 3.45Å; F66-L70 WeakPolarHBondContact O-CG 3.24Å; F66-L70 PolarHBondContact O-N 2.89Å
67	S	78.8	Confident	70.1	Confident	51 Å²	51	121.1 Å²	121.1	36%	0.357	59%	0.587	S	S	.	*	H	α-helix	trans	-62.5	-38.9	174.9	-62.9	0	0	0	0	112.6	F63 H64 R71	F63-S67 VanDerWaalsContact O-CB 3.31Å; F63-S67 WeakPolarHBondContact O-CB 3.44Å; F63-S67 PolarHBondContact O-N 2.88Å; F63-S67 PolarHBondContact O-OG 3.11Å; H64-S67 PolarHBondContact O-N 2.67Å; S67-R71 WeakPolarHBondContact O-CB 3.43Å; S67-R71 PolarHBondContact O-N 3.41Å
68	L	81.1	Confident	72.7	Confident	91 Å²	91	122.8 Å²	122.8	48%	0.476	58%	0.58	S	S	.	*	H	α-helix	trans	-66.6	-46.1	173.7	-74.1	169.3	0	0	0	111.5	H64 I65 F66 L70 R71 E72	H64-L68 WeakPolarHBondContact O-CB 3.46Å; H64-L68 VanDerWaalsContact O-CG 3.28Å; H64-L68 WeakPolarHBondContact O-CG 3.45Å; H64-L68 PolarHBondContact O-N 3.02Å; I65-L68 PolarHBondContact O-N 3.3Å; F66-L68 VanDerWaalsContact C-N 3.35Å; F66-L68 PolarHBondContact O-N 2.89Å; L68-L70 PolarHBondContact O-N 3.35Å; L68-R71 CarbonylContact O-C 3.6Å; L68-R71 WeakPolarHBondContact O-CB 3.32Å; L68-R71 PolarHBondContact O-N 3.44Å; L68-R71 VanDerWaalsContact O-N 3.12Å; L68-E72 PolarHBondContact O-N 3.04Å
69	K	82.1	Confident	75.3	Confident	127 Å²	127	122.3 Å²	122.3	55%	0.552	57%	0.57	S	S	*	*	H	α-helix	trans	-59.8	-42.7	174.2	-76.1	-177.7	176.6	-178.1	0	112.3	I65 F66 R71 E72 Q73	I65-K69 PolarHBondContact O-N 3.29Å; F66-K69 PolarHBondContact O-N 3.39Å; K69-R71 VanDerWaalsContact C-N 3.33Å; K69-R71 PolarHBondContact O-N 3.04Å; K69-E72 PolarHBondContact O-N 3.24Å; K69-Q73 WeakPolarHBondContact O-CG 3.44Å; K69-Q73 PolarHBondContact O-N 3.2Å
70	L	82.6	Confident	77.1	Confident	106 Å²	106	123.5 Å²	123.5	56%	0.555	57%	0.571	S	S	*	*	H	α-helix	trans	-62.3	-39	173.9	-82.1	164	0	0	0	111.8	F66 L68 Q73 R74	F66-L70 WeakPolarHBondContact O-CB 3.45Å; F66-L70 WeakPolarHBondContact O-CG 3.24Å; F66-L70 PolarHBondContact O-N 2.89Å; L68-L70 PolarHBondContact O-N 3.35Å; L70-Q73 PolarHBondContact O-N 3.4Å; L70-R74 WeakPolarHBondContact O-CB 3.46Å; L70-R74 WeakPolarHBondContact O-CG 3.06Å; L70-R74 PolarHBondContact O-N 3.46Å
71	R	83.1	Confident	79.1	Confident	175 Å²	175	122.2 Å²	122.2	66%	0.66	56%	0.561	S	S	*	*	H	α-helix	trans	-68.2	-35.1	175.8	-163.9	174.1	-171.3	174.1	2.7	112.3	S67 L68 K69 K75	S67-R71 WeakPolarHBondContact O-CB 3.43Å; S67-R71 PolarHBondContact O-N 3.41Å; L68-R71 CarbonylContact O-C 3.6Å; L68-R71 WeakPolarHBondContact O-CB 3.32Å; L68-R71 PolarHBondContact O-N 3.44Å; L68-R71 VanDerWaalsContact O-N 3.12Å; K69-R71 VanDerWaalsContact C-N 3.33Å; K69-R71 PolarHBondContact O-N 3.04Å; R71-K75 WeakPolarHBondContact O-CG 3.32Å; R71-K75 PolarHBondContact O-N 3.38Å
72	E	83.5	Confident	80.7	Confident	120 Å²	120	120.4 Å²	120.4	56%	0.561	56%	0.556	S	S	*	*	H	α-helix	trans	-69.3	-44	171.6	-72.7	-172.9	156.9	0	0	112.5	L68 K69 K75 K76	L68-E72 PolarHBondContact O-N 3.04Å; K69-E72 PolarHBondContact O-N 3.24Å; E72-K75 WeakPolarHBondContact O-CB 3.49Å; E72-K75 PolarHBondContact O-N 3.42Å; E72-K75 VanDerWaalsContact O-N 3.13Å; E72-K76 PolarHBondContact O-N 3.34Å
73	Q	84.7	Confident	82.3	Confident	103 Å²	103	118.7 Å²	118.7	48%	0.481	55%	0.547	S	S	.	.	H	α-helix	trans	-64.1	-41.8	176.6	-67.3	-66.1	10.1	0	0	111.4	K69 L70 K75 K76 I77	K69-Q73 WeakPolarHBondContact O-CG 3.44Å; K69-Q73 PolarHBondContact O-N 3.2Å; L70-Q73 PolarHBondContact O-N 3.4Å; Q73-K75 VanDerWaalsContact C-N 3.27Å; Q73-K75 PolarHBondContact O-N 3.04Å; Q73-K76 PolarHBondContact O-N 3.32Å; Q73-K76 VanDerWaalsContact O-N 3.1Å; Q73-I77 WeakPolarHBondContact O-CG1 3.5Å; Q73-I77 PolarHBondContact O-N 3.35Å
74	R	87.1	Confident	83.2	Confident	183 Å²	183	118.4 Å²	118.4	69%	0.691	54%	0.542	S	S	*	.	H	α-helix	trans	-58.6	-35.9	171.3	-76.9	-176.9	-179.3	-174.2	1.8	112.8	L70 K78	L70-R74 WeakPolarHBondContact O-CB 3.46Å; L70-R74 WeakPolarHBondContact O-CG 3.06Å; L70-R74 PolarHBondContact O-N 3.46Å; R74-K78 WeakPolarHBondContact O-CG 3.24Å; R74-K78 PolarHBondContact O-N 2.81Å; R74-K78 VanDerWaalsContact O-N 3.12Å
75	K	88.7	Confident	84.1	Confident	147 Å²	147	117.1 Å²	117.1	64%	0.639	54%	0.538	S	S	*	.	H	α-helix	trans	-67.7	-41.5	173.2	-75.5	175.7	177.1	-175.3	0	112.1	R71 E72 Q73 L79	R71-K75 WeakPolarHBondContact O-CG 3.32Å; R71-K75 PolarHBondContact O-N 3.38Å; E72-K75 WeakPolarHBondContact O-CB 3.49Å; E72-K75 PolarHBondContact O-N 3.42Å; E72-K75 VanDerWaalsContact O-N 3.13Å; Q73-K75 VanDerWaalsContact C-N 3.27Å; Q73-K75 PolarHBondContact O-N 3.04Å; K75-L79 PolarHBondContact O-N 2.71Å
76	K	86.3	Confident	84.7	Confident	118 Å²	118	113.8 Å²	113.8	51%	0.513	53%	0.527	S	S	.	.	H	α-helix	trans	-65.1	-43.9	176.6	-71.9	179.7	178.7	179.2	0	112.2	E72 Q73 L79 L80	E72-K76 PolarHBondContact O-N 3.34Å; Q73-K76 PolarHBondContact O-N 3.32Å; Q73-K76 VanDerWaalsContact O-N 3.1Å; K76-L79 WeakPolarHBondContact O-CB 3.34Å; K76-L79 PolarHBondContact O-N 3.44Å; K76-L80 WeakPolarHBondContact O-CG 3.35Å; K76-L80 PolarHBondContact O-N 2.99Å
77	I	86.8	Confident	85.2	Confident	92 Å²	92	113.8 Å²	113.8	47%	0.472	53%	0.527	S	S	.	.	H	α-helix	trans	-59.9	-48.8	176.2	-67.9	165.8	0	0	0	110.1	Q73 L79 L80 E81	Q73-I77 WeakPolarHBondContact O-CG1 3.5Å; Q73-I77 PolarHBondContact O-N 3.35Å; I77-L79 VanDerWaalsContact C-N 3.29Å; I77-L79 PolarHBondContact O-N 3.35Å; I77-L80 PolarHBondContact O-N 3.26Å; I77-L80 VanDerWaalsContact O-N 3.11Å; I77-E81 HydrophobicContact CG2-CG 4.35Å; I77-E81 WeakPolarHBondContact O-CG 3.5Å; I77-E81 PolarHBondContact O-N 3.25Å
78	K	87.4	Confident	85.5	Confident	143 Å²	143	115.9 Å²	115.9	62%	0.622	53%	0.534	S	S	*	.	H	α-helix	trans	-60.2	-34.5	175.8	-74.7	-168.7	173.6	-154.2	0	114.1	R74 E81 Q82	R74-K78 WeakPolarHBondContact O-CG 3.24Å; R74-K78 PolarHBondContact O-N 2.81Å; R74-K78 VanDerWaalsContact O-N 3.12Å; K78-E81 WeakPolarHBondContact CA-OE2 3.45Å; K78-Q82 WeakPolarHBondContact O-CB 3.19Å; K78-Q82 PolarHBondContact O-N 3.44Å; K78-Q82 VanDerWaalsContact O-N 3.11Å
79	L	86.9	Confident	85.9	Confident	102 Å²	102	117.9 Å²	117.9	53%	0.534	54%	0.541	S	S	.	.	H	α-helix	trans	-65.5	-46.9	173.9	-165.6	93.2	0	0	0	110.9	K75 K76 I77 Q82 E83	K75-L79 PolarHBondContact O-N 2.71Å; K76-L79 WeakPolarHBondContact O-CB 3.34Å; K76-L79 PolarHBondContact O-N 3.44Å; I77-L79 VanDerWaalsContact C-N 3.29Å; I77-L79 PolarHBondContact O-N 3.35Å; L79-Q82 PolarHBondContact O-N 3.35Å; L79-E83 WeakPolarHBondContact O-CG 3.23Å; L79-E83 PolarHBondContact O-N 2.77Å
80	L	86.4	Confident	86.1	Confident	105 Å²	105	117.2 Å²	117.2	55%	0.55	54%	0.54	S	S	.	.	H	α-helix	trans	-66.2	-35.6	178.6	-68.6	169.4	0	0	0	112.5	K76 I77 Q82 E83 R84	K76-L80 WeakPolarHBondContact O-CG 3.35Å; K76-L80 PolarHBondContact O-N 2.99Å; I77-L80 PolarHBondContact O-N 3.26Å; I77-L80 VanDerWaalsContact O-N 3.11Å; L80-Q82 VanDerWaalsContact C-N 3.35Å; L80-E83 PolarHBondContact O-N 3.32Å; L80-R84 VanDerWaalsContact O-CB 3.25Å; L80-R84 WeakPolarHBondContact O-CB 3.36Å; L80-R84 PolarHBondContact O-N 3.02Å
81	E	86.1	Confident	86.3	Confident	97 Å²	97	116.7 Å²	116.7	45%	0.453	54%	0.536	S	S	.	.	H	α-helix	trans	-60	-44.8	170.1	-74	169.7	166.9	0	0	111.1	I77 K78 R84 I85	I77-E81 HydrophobicContact CG2-CG 4.35Å; I77-E81 WeakPolarHBondContact O-CG 3.5Å; I77-E81 PolarHBondContact O-N 3.25Å; K78-E81 WeakPolarHBondContact CA-OE2 3.45Å; E81-R84 WeakPolarHBondContact O-CB 3.21Å; E81-R84 PolarHBondContact O-N 2.62Å; E81-I85 VanDerWaalsContact O-CG1 3.32Å; E81-I85 WeakPolarHBondContact O-CG1 3.27Å; E81-I85 PolarHBondContact O-N 2.78Å
82	Q	86.8	Confident	86.4	Confident	145 Å²	145	111 Å²	111	68%	0.678	53%	0.526	S	S	*	.	H	α-helix	trans	-70.5	-36.6	179.6	-166.6	163.5	7.7	0	0	112.6	K78 L79 L80 I85 G86	K78-Q82 WeakPolarHBondContact O-CB 3.19Å; K78-Q82 PolarHBondContact O-N 3.44Å; K78-Q82 VanDerWaalsContact O-N 3.11Å; L79-Q82 PolarHBondContact O-N 3.35Å; L80-Q82 VanDerWaalsContact C-N 3.35Å; Q82-I85 PolarHBondContact O-N 3.39Å; Q82-G86 PolarHBondContact O-N 3.47Å
83	E	86.5	Confident	86.6	Confident	100 Å²	100	108.4 Å²	108.4	47%	0.467	52%	0.522	S	S	.	.	H	α-helix	trans	-63.2	-44.4	169.5	-72.7	-178.8	169.2	0	0	111.5	L79 L80 I85 G86 F87	L79-E83 WeakPolarHBondContact O-CG 3.23Å; L79-E83 PolarHBondContact O-N 2.77Å; L80-E83 PolarHBondContact O-N 3.32Å; E83-I85 PolarHBondContact O-N 3.34Å; E83-G86 CarbonylContact O-C 3.14Å; E83-G86 PolarHBondContact O-N 2.8Å; E83-G86 VanDerWaalsContact O-N 3.17Å; E83-F87 HydrophobicContact CB-CE2 4.39Å; E83-F87 WeakPolarHBondContact O-CD2 3.41Å; E83-F87 PolarHBondContact O-N 3.1Å
84	R	85	Confident	86.7	Confident	139 Å²	139	107.2 Å²	107.2	53%	0.525	52%	0.518	S	S	.	.	H	α-helix	trans	-59.5	-43.3	175.4	173	-177.6	160.4	-159.1	-5.2	112.1	L80 E81 G86 F87 L88	L80-R84 VanDerWaalsContact O-CB 3.25Å; L80-R84 WeakPolarHBondContact O-CB 3.36Å; L80-R84 PolarHBondContact O-N 3.02Å; E81-R84 WeakPolarHBondContact O-CB 3.21Å; E81-R84 PolarHBondContact O-N 2.62Å; R84-G86 VanDerWaalsContact C-N 3.35Å; R84-F87 PolarHBondContact O-N 3.03Å; R84-L88 HydrophobicContact CG-CD1 4.29Å; R84-L88 WeakPolarHBondContact O-CG 3.46Å; R84-L88 PolarHBondContact O-N 2.77Å
85	I	87.9	Confident	86.7	Confident	93 Å²	93	101.6 Å²	101.6	48%	0.477	51%	0.506	S	S	.	.	H	α-helix	trans	-60.2	-46.8	174.2	-69.4	163.5	0	0	0	109.9	E81 Q82 E83 F87 L88 E89	E81-I85 VanDerWaalsContact O-CG1 3.32Å; E81-I85 WeakPolarHBondContact O-CG1 3.27Å; E81-I85 PolarHBondContact O-N 2.78Å; Q82-I85 PolarHBondContact O-N 3.39Å; E83-I85 PolarHBondContact O-N 3.34Å; I85-F87 VanDerWaalsContact C-N 3.27Å; I85-F87 PolarHBondContact O-N 3.33Å; I85-L88 PolarHBondContact O-N 3.17Å; I85-E89 HydrophobicContact CG2-CG 4.44Å; I85-E89 WeakPolarHBondContact O-CG 3.44Å; I85-E89 PolarHBondContact O-N 3.08Å
86	G	86.4	Confident	86.6	Confident	23 Å²	23	98 Å²	98	24%	0.237	50%	0.5	C	S	.	.	H	α-helix	trans	-60.7	-30.6	175.7	0	0	0	0	0	114.2	Q82 E83 R84 Q90	Q82-G86 PolarHBondContact O-N 3.47Å; E83-G86 CarbonylContact O-C 3.14Å; E83-G86 PolarHBondContact O-N 2.8Å; E83-G86 VanDerWaalsContact O-N 3.17Å; R84-G86 VanDerWaalsContact C-N 3.35Å; G86-Q90 WeakPolarHBondContact O-CG 3.38Å; G86-Q90 PolarHBondContact O-N 2.91Å; G86-Q90 PolarHBondContact O-NE2 3.11Å
87	F	84.8	Confident	86.7	Confident	129 Å²	129	94.3 Å²	94.3	57%	0.566	49%	0.488	S	S	*	.	H	α-helix	trans	-73.9	-39.3	170.9	-72.4	-61.8	0	0	0	112.7	E83 R84 I85 Q90 I91	E83-F87 HydrophobicContact CB-CE2 4.39Å; E83-F87 WeakPolarHBondContact O-CD2 3.41Å; E83-F87 PolarHBondContact O-N 3.1Å; R84-F87 PolarHBondContact O-N 3.03Å; I85-F87 VanDerWaalsContact C-N 3.27Å; I85-F87 PolarHBondContact O-N 3.33Å; F87-Q90 WeakPolarHBondContact O-CB 3.05Å; F87-Q90 PolarHBondContact O-N 3.16Å; F87-I91 WeakPolarHBondContact O-CG1 3.4Å; F87-I91 PolarHBondContact O-N 3Å
88	L	85.8	Confident	86.6	Confident	96 Å²	96	95.5 Å²	95.5	50%	0.503	50%	0.495	S	S	.	.	H	α-helix	trans	-65.3	-40.1	176.1	-70.9	171.4	0	0	0	111.9	R84 I85 Q90 I91 A92	R84-L88 HydrophobicContact CG-CD1 4.29Å; R84-L88 WeakPolarHBondContact O-CG 3.46Å; R84-L88 PolarHBondContact O-N 2.77Å; I85-L88 PolarHBondContact O-N 3.17Å; L88-Q90 VanDerWaalsContact C-N 3.34Å; L88-Q90 PolarHBondContact O-N 3.16Å; L88-I91 PolarHBondContact O-N 2.76Å; L88-A92 WeakPolarHBondContact O-CB 3.38Å; L88-A92 PolarHBondContact O-N 3.5Å
89	E	88.8	Confident	86.6	Confident	132 Å²	132	94.5 Å²	94.5	62%	0.617	49%	0.493	S	S	*	.	H	α-helix	trans	-62	-39.5	173.1	-71.4	177.6	169.1	0	0	112.1	I85 A92 S93	I85-E89 HydrophobicContact CG2-CG 4.44Å; I85-E89 WeakPolarHBondContact O-CG 3.44Å; I85-E89 PolarHBondContact O-N 3.08Å; E89-A92 PolarHBondContact O-N 3.19Å; E89-S93 WeakPolarHBondContact O-CB 3.47Å; E89-S93 PolarHBondContact O-N 3.36Å
90	Q	85.7	Confident	86.7	Confident	114 Å²	114	95.6 Å²	95.6	53%	0.533	49%	0.493	S	S	.	.	H	α-helix	trans	-64.5	-42.9	173.6	-78	169.7	83.9	0	0	112	G86 F87 L88 S93 L94	G86-Q90 WeakPolarHBondContact O-CG 3.38Å; G86-Q90 PolarHBondContact O-N 2.91Å; G86-Q90 PolarHBondContact O-NE2 3.11Å; F87-Q90 WeakPolarHBondContact O-CB 3.05Å; F87-Q90 PolarHBondContact O-N 3.16Å; L88-Q90 VanDerWaalsContact C-N 3.34Å; L88-Q90 PolarHBondContact O-N 3.16Å; Q90-S93 PolarHBondContact O-N 2.77Å; Q90-L94 WeakPolarHBondContact O-CB 3.41Å; Q90-L94 WeakPolarHBondContact O-CD1 3.11Å; Q90-L94 PolarHBondContact O-N 2.89Å
91	I	87.4	Confident	86.6	Confident	95 Å²	95	94.6 Å²	94.6	49%	0.487	49%	0.485	S	S	.	.	H	α-helix	trans	-64.1	-44.2	176.5	-68.7	165.6	0	0	0	110.6	F87 L88 S93 L94 C95	F87-I91 WeakPolarHBondContact O-CG1 3.4Å; F87-I91 PolarHBondContact O-N 3Å; L88-I91 PolarHBondContact O-N 2.76Å; I91-S93 PolarHBondContact O-N 3.29Å; I91-L94 WeakPolarHBondContact O-CB 3.24Å; I91-L94 PolarHBondContact O-N 3.3Å; I91-C95 PolarHBondContact O-N 3.16Å; I91-C95 PolarHBondContact O-SG 3.17Å
92	A	86.1	Confident	86.6	Confident	54 Å²	54	95.3 Å²	95.3	45%	0.446	49%	0.488	S	S	.	.	H	α-helix	trans	-60.6	-43.8	175.4	0	0	0	0	0	112	L88 E89 L94 C95 S96	L88-A92 WeakPolarHBondContact O-CB 3.38Å; L88-A92 PolarHBondContact O-N 3.5Å; E89-A92 PolarHBondContact O-N 3.19Å; A92-L94 VanDerWaalsContact C-N 3.34Å; A92-L94 PolarHBondContact O-N 2.91Å; A92-C95 PolarHBondContact O-N 2.93Å; A92-S96 PolarHBondContact O-N 3.27Å; A92-S96 PolarHBondContact O-OG 2.83Å
93	S	87.9	Confident	86.6	Confident	67 Å²	67	93.1 Å²	93.1	47%	0.469	48%	0.478	S	S	.	.	H	α-helix	trans	-61.5	-39.1	175	-168.8	0	0	0	0	112.7	E89 Q90 I91 S97	E89-S93 WeakPolarHBondContact O-CB 3.47Å; E89-S93 PolarHBondContact O-N 3.36Å; Q90-S93 PolarHBondContact O-N 2.77Å; I91-S93 PolarHBondContact O-N 3.29Å; S93-S97 VanDerWaalsContact O-CB 3.26Å; S93-S97 WeakPolarHBondContact O-CB 3.4Å; S93-S97 PolarHBondContact O-N 2.89Å
94	L	86.4	Confident	86.5	Confident	78 Å²	78	90.3 Å²	90.3	41%	0.408	47%	0.465	S	S	.	.	H	α-helix	trans	-62.4	-48	172	-88.7	153.3	0	0	0	111.5	Q90 I91 A92 S97 L98 H258	Q90-L94 WeakPolarHBondContact O-CB 3.41Å; Q90-L94 WeakPolarHBondContact O-CD1 3.11Å; Q90-L94 PolarHBondContact O-N 2.89Å; I91-L94 WeakPolarHBondContact O-CB 3.24Å; I91-L94 PolarHBondContact O-N 3.3Å; A92-L94 VanDerWaalsContact C-N 3.34Å; A92-L94 PolarHBondContact O-N 2.91Å; L94-S97 WeakPolarHBondContact O-CB 3.4Å; L94-S97 PolarHBondContact O-N 3.47Å; L94-L98 WeakPolarHBondContact O-CB 3.38Å; L94-L98 PolarHBondContact O-N 3.25Å; L94-H258 VanDerWaalsContact CD2-CD2 3.49Å; L94-H258 WeakPolarHBondContact CD2-CD2 3.37Å; L94-H258 WeakPolarHBondContact CD2-NE2 3.37Å
95	C	86.2	Confident	86.4	Confident	64 Å²	64	88.9 Å²	88.9	43%	0.432	47%	0.467	S	S	.	.	H	α-helix	trans	-59.9	-52	178.6	-68.7	0	0	0	0	112.1	I91 A92 S97 L98 E99	I91-C95 PolarHBondContact O-N 3.16Å; I91-C95 PolarHBondContact O-SG 3.17Å; A92-C95 PolarHBondContact O-N 2.93Å; C95-S97 PolarHBondContact O-N 3.04Å; C95-L98 WeakPolarHBondContact O-CA 3.36Å; C95-L98 WeakPolarHBondContact O-CB 3.12Å; C95-L98 PolarHBondContact O-N 3.14Å; C95-E99 WeakPolarHBondContact O-CG 3.33Å; C95-E99 PolarHBondContact O-N 3.09Å
96	S	87.4	Confident	86.4	Confident	73 Å²	73	86.6 Å²	86.6	51%	0.51	46%	0.457	S	S	.	.	H	α-helix	trans	-63.8	-30	177.6	-57.9	0	0	0	0	113.1	A92 K100	A92-S96 PolarHBondContact O-N 3.27Å; A92-S96 PolarHBondContact O-OG 2.83Å; S96-K100 WeakPolarHBondContact O-CB 3.48Å; S96-K100 PolarHBondContact O-N 3.46Å; S96-K100 VanDerWaalsContact O-N 3.1Å
97	S	87.7	Confident	86.5	Confident	39 Å²	39	89 Å²	89	27%	0.273	47%	0.465	S	S	.	.	H	α-helix	trans	-69.2	-34.1	171	-176	0	0	0	0	112.2	S93 L94 C95 K101	S93-S97 VanDerWaalsContact O-CB 3.26Å; S93-S97 WeakPolarHBondContact O-CB 3.4Å; S93-S97 PolarHBondContact O-N 2.89Å; L94-S97 WeakPolarHBondContact O-CB 3.4Å; L94-S97 PolarHBondContact O-N 3.47Å; C95-S97 PolarHBondContact O-N 3.04Å; S97-K101 VanDerWaalsContact O-CG 3.3Å; S97-K101 WeakPolarHBondContact O-CG 3.48Å; S97-K101 PolarHBondContact O-N 3.29Å
98	L	86	Confident	86.5	Confident	117 Å²	117	87.4 Å²	87.4	61%	0.613	47%	0.465	S	S	*	.	H	α-helix	trans	-74	-43.2	178.5	-161.2	153	0	0	0	111.2	L94 C95 K100 K101 Q102	L94-L98 WeakPolarHBondContact O-CB 3.38Å; L94-L98 PolarHBondContact O-N 3.25Å; C95-L98 WeakPolarHBondContact O-CA 3.36Å; C95-L98 WeakPolarHBondContact O-CB 3.12Å; C95-L98 PolarHBondContact O-N 3.14Å; L98-K100 VanDerWaalsContact C-N 3.31Å; L98-K100 PolarHBondContact O-N 3.49Å; L98-K101 CarbonylContact O-C 3.6Å; L98-K101 WeakPolarHBondContact O-CB 3.43Å; L98-K101 PolarHBondContact O-N 2.87Å; L98-K101 VanDerWaalsContact O-N 3.08Å; L98-Q102 PolarHBondContact O-N 2.74Å
99	E	86.5	Confident	86.3	Confident	122 Å²	122	87.4 Å²	87.4	57%	0.57	47%	0.465	S	S	*	.	H	α-helix	trans	-55	-45.7	169.9	-70.1	170.9	164.7	0	0	111.4	C95 K101 Q102 Q103	C95-E99 WeakPolarHBondContact O-CG 3.33Å; C95-E99 PolarHBondContact O-N 3.09Å; E99-K101 PolarHBondContact O-N 3.34Å; E99-Q102 WeakPolarHBondContact O-CB 3.18Å; E99-Q102 PolarHBondContact O-N 3.16Å; E99-Q103 PolarHBondContact O-N 3.1Å
100	K	88.9	Confident	86.2	Confident	126 Å²	126	86.8 Å²	86.8	55%	0.548	46%	0.46	S	S	.	.	H	α-helix	trans	-60.1	-44.7	174.3	-174.6	174.3	-178.9	174.5	0	111.7	S96 L98 Q102 Q103 E104	S96-K100 WeakPolarHBondContact O-CB 3.48Å; S96-K100 PolarHBondContact O-N 3.46Å; S96-K100 VanDerWaalsContact O-N 3.1Å; L98-K100 VanDerWaalsContact C-N 3.31Å; L98-K100 PolarHBondContact O-N 3.49Å; K100-Q102 VanDerWaalsContact C-N 3.3Å; K100-Q102 PolarHBondContact O-N 2.72Å; K100-Q103 PolarHBondContact O-N 2.66Å; K100-E104 HydrophobicContact CG-CG 4.49Å; K100-E104 WeakPolarHBondContact O-CG 3.44Å; K100-E104 PolarHBondContact O-N 3.25Å
101	K	84.9	Confident	86.3	Confident	84 Å²	84	84.9 Å²	84.9	37%	0.365	45%	0.453	S	S	.	.	H	α-helix	trans	-63.3	-36.1	176.4	-69.7	-66.3	175.5	-159.7	0	112.5	S97 L98 E99 E104 L105	S97-K101 VanDerWaalsContact O-CG 3.3Å; S97-K101 WeakPolarHBondContact O-CG 3.48Å; S97-K101 PolarHBondContact O-N 3.29Å; L98-K101 CarbonylContact O-C 3.6Å; L98-K101 WeakPolarHBondContact O-CB 3.43Å; L98-K101 PolarHBondContact O-N 2.87Å; L98-K101 VanDerWaalsContact O-N 3.08Å; E99-K101 PolarHBondContact O-N 3.34Å; K101-E104 IonicContact NZ-OE1 2.98Å; K101-E104 PolarHBondContact O-N 3.28Å; K101-L105 WeakPolarHBondContact O-CB 3.45Å; K101-L105 PolarHBondContact O-N 3.03Å
102	Q	84.7	Confident	85.8	Confident	112 Å²	112	83.1 Å²	83.1	52%	0.523	45%	0.45	S	S	.	.	H	α-helix	trans	-64.6	-47.7	175.4	178.9	177	-19.2	0	0	111.2	L98 E99 K100 E104 L105 V106	L98-Q102 PolarHBondContact O-N 2.74Å; E99-Q102 WeakPolarHBondContact O-CB 3.18Å; E99-Q102 PolarHBondContact O-N 3.16Å; K100-Q102 VanDerWaalsContact C-N 3.3Å; K100-Q102 PolarHBondContact O-N 2.72Å; Q102-E104 VanDerWaalsContact C-N 3.34Å; Q102-E104 PolarHBondContact O-N 3.35Å; Q102-L105 PolarHBondContact O-N 3.49Å; Q102-L105 VanDerWaalsContact O-N 3.1Å; Q102-V106 WeakPolarHBondContact O-CG2 3.18Å; Q102-V106 PolarHBondContact O-N 3.26Å
103	Q	87	Confident	85.7	Confident	99 Å²	99	85.5 Å²	85.5	46%	0.463	45%	0.451	S	S	.	.	H	α-helix	trans	-58.9	-45.6	175.1	-176.9	56.5	51.6	0	0	111.6	E99 K100 L105 V106 D107	E99-Q103 PolarHBondContact O-N 3.1Å; K100-Q103 PolarHBondContact O-N 2.66Å; Q103-L105 PolarHBondContact O-N 3.42Å; Q103-V106 WeakPolarHBondContact O-CB 3.36Å; Q103-V106 PolarHBondContact O-N 3.35Å; Q103-V106 VanDerWaalsContact O-N 3.14Å; Q103-D107 PolarHBondContact NE2-OD1 3.26Å; Q103-D107 PolarHBondContact NE2-OD2 2.99Å; Q103-D107 PolarHBondContact O-N 3.08Å
104	E	85.2	Confident	85.6	Confident	41 Å²	41	88.3 Å²	88.3	19%	0.192	46%	0.457	C	S	.	.	H	α-helix	trans	-63.3	-26.8	177.3	-67.7	179.9	-53.1	0	0	113.1	K100 K101 Q102 V108 K263	K100-E104 HydrophobicContact CG-CG 4.49Å; K100-E104 WeakPolarHBondContact O-CG 3.44Å; K100-E104 PolarHBondContact O-N 3.25Å; K101-E104 IonicContact NZ-OE1 2.98Å; K101-E104 PolarHBondContact O-N 3.28Å; Q102-E104 VanDerWaalsContact C-N 3.34Å; Q102-E104 PolarHBondContact O-N 3.35Å; E104-V108 WeakPolarHBondContact O-CG2 3.37Å; E104-V108 PolarHBondContact O-N 3.3Å; E104-K263 WeakPolarHBondContact OE1-CE 3.26Å; E104-K263 IonicContact OE1-NZ 3.4Å; E104-K263 PolarHBondContact OE1-NZ 3.12Å; E104-K263 WeakPolarHBondContact OE2-CD 3.41Å; E104-K263 WeakPolarHBondContact OE2-CE 3.49Å; E104-K263 IonicContact OE2-NZ 3.38Å; E104-K263 PolarHBondContact OE2-NZ 3.11Å
105	L	83.5	Confident	85.3	Confident	109 Å²	109	89.1 Å²	89.1	57%	0.571	46%	0.457	S	S	*	.	H	α-helix	trans	-78.4	-36.6	174.5	-169.5	143.8	0	0	0	111.7	K101 Q102 Q103 D107 V108 L109	K101-L105 WeakPolarHBondContact O-CB 3.45Å; K101-L105 PolarHBondContact O-N 3.03Å; Q102-L105 PolarHBondContact O-N 3.49Å; Q102-L105 VanDerWaalsContact O-N 3.1Å; Q103-L105 PolarHBondContact O-N 3.42Å; L105-D107 VanDerWaalsContact C-N 3.32Å; L105-D107 PolarHBondContact O-N 3.22Å; L105-V108 PolarHBondContact O-N 3.15Å; L105-L109 HydrophobicContact CD2-CD1 3.77Å; L105-L109 HydrophobicContact CD2-CG 4.28Å; L105-L109 WeakPolarHBondContact O-CG 3.35Å; L105-L109 PolarHBondContact O-N 2.74Å
106	V	87.6	Confident	84.9	Confident	45 Å²	45	88.8 Å²	88.8	27%	0.273	46%	0.459	S	S	.	.	H	α-helix	trans	-60	-42.1	170.5	170.5	0	0	0	0	111.1	Q102 Q103 L109 K110	Q102-V106 WeakPolarHBondContact O-CG2 3.18Å; Q102-V106 PolarHBondContact O-N 3.26Å; Q103-V106 WeakPolarHBondContact O-CB 3.36Å; Q103-V106 PolarHBondContact O-N 3.35Å; Q103-V106 VanDerWaalsContact O-N 3.14Å; V106-L109 PolarHBondContact O-N 3.33Å; V106-K110 HydrophobicContact CG1-CD 4.49Å; V106-K110 WeakPolarHBondContact O-CG 3.49Å; V106-K110 PolarHBondContact O-N 3.38Å
107	D	87.5	Confident	84.8	Confident	74 Å²	74	91.8 Å²	91.8	40%	0.396	46%	0.463	S	S	.	.	H	α-helix	trans	-69.1	-36.6	179.2	-62	-28.5	0	0	0	112.1	Q103 L105 K110 L111	Q103-D107 PolarHBondContact NE2-OD1 3.26Å; Q103-D107 PolarHBondContact NE2-OD2 2.99Å; Q103-D107 PolarHBondContact O-N 3.08Å; L105-D107 VanDerWaalsContact C-N 3.32Å; L105-D107 PolarHBondContact O-N 3.22Å; D107-K110 PolarHBondContact O-N 3.03Å; D107-L111 WeakPolarHBondContact O-CB 3.32Å; D107-L111 PolarHBondContact O-N 3.02Å
108	V	85.3	Confident	84.7	Confident	94 Å²	94	97.6 Å²	97.6	57%	0.57	48%	0.48	S	S	*	.	H	α-helix	trans	-64.5	-38.9	171.4	168.1	0	0	0	0	111.8	E104 L105 L111 S112	E104-V108 WeakPolarHBondContact O-CG2 3.37Å; E104-V108 PolarHBondContact O-N 3.3Å; L105-V108 PolarHBondContact O-N 3.15Å; V108-L111 PolarHBondContact O-N 3.15Å; V108-S112 WeakPolarHBondContact O-CB 3.23Å; V108-S112 PolarHBondContact O-N 3.36Å
109	L	82.4	Confident	84.4	Confident	96 Å²	96	97.5 Å²	97.5	50%	0.503	48%	0.476	S	S	.	.	H	α-helix	trans	-63.6	-47.9	175.4	-74.4	171.7	0	0	0	111.3	L105 V106 L111 S112 E113	L105-L109 HydrophobicContact CD2-CD1 3.77Å; L105-L109 HydrophobicContact CD2-CG 4.28Å; L105-L109 WeakPolarHBondContact O-CG 3.35Å; L105-L109 PolarHBondContact O-N 2.74Å; V106-L109 PolarHBondContact O-N 3.33Å; L109-L111 PolarHBondContact O-N 2.95Å; L109-S112 WeakPolarHBondContact O-CA 3.11Å; L109-S112 WeakPolarHBondContact O-CB 3.33Å; L109-S112 PolarHBondContact O-N 3.16Å; L109-S112 PolarHBondContact O-OG 3.27Å; L109-E113 PolarHBondContact O-N 3.26Å
110	K	86.4	Confident	84.2	Confident	119 Å²	119	94.6 Å²	94.6	52%	0.517	47%	0.473	S	S	.	.	H	α-helix	trans	-55.8	-47.4	174.4	-71.4	173.5	-177.9	170.5	0	112.1	V106 D107 S112 E113 E114	V106-K110 HydrophobicContact CG1-CD 4.49Å; V106-K110 WeakPolarHBondContact O-CG 3.49Å; V106-K110 PolarHBondContact O-N 3.38Å; D107-K110 PolarHBondContact O-N 3.03Å; K110-S112 VanDerWaalsContact C-N 3.25Å; K110-S112 PolarHBondContact O-N 3.18Å; K110-E113 WeakPolarHBondContact O-CB 3.46Å; K110-E113 PolarHBondContact O-N 2.81Å; K110-E113 VanDerWaalsContact O-N 3.17Å; K110-E114 PolarHBondContact O-N 3.46Å
111	L	87	Confident	84.1	Confident	74 Å²	74	94.5 Å²	94.5	39%	0.387	48%	0.475	S	S	.	.	H	α-helix	trans	-62.6	-32.4	176.5	-176.1	65.4	0	0	0	112.4	D107 V108 L109 K115	D107-L111 WeakPolarHBondContact O-CB 3.32Å; D107-L111 PolarHBondContact O-N 3.02Å; V108-L111 PolarHBondContact O-N 3.15Å; L109-L111 PolarHBondContact O-N 2.95Å; L111-K115 HydrophobicContact CG-CD 4.48Å; L111-K115 WeakPolarHBondContact O-CB 3.35Å; L111-K115 VanDerWaalsContact O-CG 3.32Å; L111-K115 WeakPolarHBondContact O-CG 3.4Å; L111-K115 PolarHBondContact O-N 2.87Å
112	S	77.5	Confident	84.1	Confident	59 Å²	59	96.3 Å²	96.3	41%	0.413	48%	0.48	S	S	.	.	H	α-helix	trans	-70.7	-36.8	175.2	82.5	0	0	0	0	112.4	V108 L109 K110 K115 A116	V108-S112 WeakPolarHBondContact O-CB 3.23Å; V108-S112 PolarHBondContact O-N 3.36Å; L109-S112 WeakPolarHBondContact O-CA 3.11Å; L109-S112 WeakPolarHBondContact O-CB 3.33Å; L109-S112 PolarHBondContact O-N 3.16Å; L109-S112 PolarHBondContact O-OG 3.27Å; K110-S112 VanDerWaalsContact C-N 3.25Å; K110-S112 PolarHBondContact O-N 3.18Å; S112-K115 PolarHBondContact O-N 2.71Å; S112-A116 WeakPolarHBondContact O-CB 3.22Å; S112-A116 PolarHBondContact O-N 3.03Å
113	E	82.8	Confident	83.9	Confident	103 Å²	103	93.1 Å²	93.1	48%	0.481	47%	0.466	S	S	.	.	H	α-helix	trans	-66.3	-42.9	173.2	-70	-173.1	179.2	0	0	112	L109 K110 A116 K117	L109-E113 PolarHBondContact O-N 3.26Å; K110-E113 WeakPolarHBondContact O-CB 3.46Å; K110-E113 PolarHBondContact O-N 2.81Å; K110-E113 VanDerWaalsContact O-N 3.17Å; E113-A116 WeakPolarHBondContact O-CB 3.41Å; E113-A116 PolarHBondContact O-N 3.18Å; E113-K117 WeakPolarHBondContact O-CG 2.73Å; E113-K117 PolarHBondContact O-N 2.84Å
114	E	85.8	Confident	83.8	Confident	126 Å²	126	92.7 Å²	92.7	59%	0.589	47%	0.47	S	S	*	.	H	α-helix	trans	-61.8	-44.1	174.7	-71.4	-170.7	151.5	0	0	111.7	K110 A116 K117 Y118	K110-E114 PolarHBondContact O-N 3.46Å; E114-A116 VanDerWaalsContact C-N 3.29Å; E114-A116 PolarHBondContact O-N 2.93Å; E114-K117 PolarHBondContact O-N 3.37Å; E114-Y118 PolarHBondContact O-N 2.88Å
115	K	81.3	Confident	83.9	Confident	95 Å²	95	95.6 Å²	95.6	41%	0.413	48%	0.483	S	S	.	.	H	α-helix	trans	-61.7	-36.5	173.7	-75.8	175.4	-179.9	178.3	0	112.2	L111 S112 H119	L111-K115 HydrophobicContact CG-CD 4.48Å; L111-K115 WeakPolarHBondContact O-CB 3.35Å; L111-K115 VanDerWaalsContact O-CG 3.32Å; L111-K115 WeakPolarHBondContact O-CG 3.4Å; L111-K115 PolarHBondContact O-N 2.87Å; S112-K115 PolarHBondContact O-N 2.71Å; K115-H119 PolarHBondContact O-N 3.48Å; K115-H119 PolarHBondContact O-ND1 3.22Å
116	A	78.5	Confident	83.9	Confident	58 Å²	58	92.2 Å²	92.2	48%	0.479	47%	0.467	S	S	.	.	H	α-helix	trans	-68	-42.4	175.3	0	0	0	0	0	112.1	S112 E113 E114 H119 A120	S112-A116 WeakPolarHBondContact O-CB 3.22Å; S112-A116 PolarHBondContact O-N 3.03Å; E113-A116 WeakPolarHBondContact O-CB 3.41Å; E113-A116 PolarHBondContact O-N 3.18Å; E114-A116 VanDerWaalsContact C-N 3.29Å; E114-A116 PolarHBondContact O-N 2.93Å; A116-H119 PolarHBondContact O-N 2.95Å; A116-A120 WeakPolarHBondContact O-CB 3.3Å; A116-A120 PolarHBondContact O-N 3.3Å
117	K	85	Confident	83.6	Confident	136 Å²	136	92.6 Å²	92.6	59%	0.591	47%	0.472	S	S	*	.	H	α-helix	trans	-60.3	-44.5	173.4	-70.8	165.8	-174.4	165.6	0	111.6	E113 E114 A120 H121	E113-K117 WeakPolarHBondContact O-CG 2.73Å; E113-K117 PolarHBondContact O-N 2.84Å; E114-K117 PolarHBondContact O-N 3.37Å; K117-A120 WeakPolarHBondContact O-CB 3.29Å; K117-A120 PolarHBondContact O-N 3.41Å; K117-H121 PolarHBondContact O-N 2.92Å
118	Y	85.4	Confident	83.5	Confident	161 Å²	161	92 Å²	92	63%	0.631	47%	0.474	S	S	*	.	H	α-helix	trans	-61.3	-46.1	175.2	-179.7	-95.1	0	0	0	112.3	E114 A120 H121 Y122	E114-Y118 PolarHBondContact O-N 2.88Å; Y118-A120 VanDerWaalsContact C-N 3.3Å; Y118-A120 PolarHBondContact O-N 2.98Å; Y118-H121 PolarHBondContact O-N 3.37Å; Y118-Y122 WeakPolarHBondContact O-CB 3.41Å; Y118-Y122 PolarHBondContact O-N 3.06Å
119	H	79.8	Confident	83.5	Confident	114 Å²	114	92 Å²	92	53%	0.528	47%	0.47	S	S	.	.	H	α-helix	trans	-62.8	-35.9	175.3	-80	77.4	0	0	0	112.4	K115 A116 M123	K115-H119 PolarHBondContact O-N 3.48Å; K115-H119 PolarHBondContact O-ND1 3.22Å; A116-H119 PolarHBondContact O-N 2.95Å; H119-M123 WeakPolarHBondContact O-CB 3.42Å; H119-M123 WeakPolarHBondContact O-CG 3.48Å; H119-M123 PolarHBondContact O-N 3.32Å
120	A	81.8	Confident	83.5	Confident	61 Å²	61	88.4 Å²	88.4	50%	0.504	45%	0.451	S	S	.	.	H	α-helix	trans	-63.8	-47.1	175	0	0	0	0	0	111.6	A116 K117 Y118 M123 T124	A116-A120 WeakPolarHBondContact O-CB 3.3Å; A116-A120 PolarHBondContact O-N 3.3Å; K117-A120 WeakPolarHBondContact O-CB 3.29Å; K117-A120 PolarHBondContact O-N 3.41Å; Y118-A120 VanDerWaalsContact C-N 3.3Å; Y118-A120 PolarHBondContact O-N 2.98Å; A120-M123 PolarHBondContact O-N 2.85Å; A120-T124 PolarHBondContact O-N 3.19Å; A120-T124 PolarHBondContact O-OG1 3.34Å
121	H	86.7	Confident	83.2	Confident	125 Å²	125	85.2 Å²	85.2	58%	0.579	45%	0.447	S	S	*	.	H	α-helix	trans	-59.7	-47	175.9	-173.8	-76.5	0	0	0	112.1	K117 Y118 M123 T124 E125	K117-H121 PolarHBondContact O-N 2.92Å; Y118-H121 PolarHBondContact O-N 3.37Å; H121-M123 VanDerWaalsContact C-N 3.34Å; H121-M123 PolarHBondContact O-N 2.85Å; H121-T124 WeakPolarHBondContact CA-OG1 3.48Å; H121-T124 PolarHBondContact O-N 3Å; H121-T124 PolarHBondContact O-OG1 3.01Å; H121-E125 IonicContact ND1-OE2 3.36Å; H121-E125 PolarHBondContact O-N 3.35Å
122	Y	85.2	Confident	83	Confident	122 Å²	122	86.4 Å²	86.4	48%	0.478	45%	0.451	S	S	.	.	H	α-helix	trans	-60.2	-42.3	176.6	-179.8	-103.6	0	0	0	112.1	Y118 T124 E125 V126	Y118-Y122 WeakPolarHBondContact O-CB 3.41Å; Y118-Y122 PolarHBondContact O-N 3.06Å; Y122-T124 VanDerWaalsContact C-N 3.33Å; Y122-T124 PolarHBondContact O-N 3.3Å; Y122-E125 PolarHBondContact O-N 3.23Å; Y122-V126 HydrophobicContact CD1-CG2 4.23Å; Y122-V126 HydrophobicContact CD2-CG2 4.49Å; Y122-V126 HydrophobicContact CE1-CG2 3.79Å; Y122-V126 HydrophobicContact CE2-CG2 4.08Å; Y122-V126 WeakPolarHBondContact O-CG2 3.22Å; Y122-V126 PolarHBondContact O-N 2.73Å
123	M	80.4	Confident	83	Confident	45 Å²	45	87 Å²	87	22%	0.222	45%	0.449	C	S	.	.	H	α-helix	trans	-67.4	-30.5	176.5	-72.3	-62.7	-61.1	0	0	113.1	H119 A120 H121 S127 V206 A209	H119-M123 WeakPolarHBondContact O-CB 3.42Å; H119-M123 WeakPolarHBondContact O-CG 3.48Å; H119-M123 PolarHBondContact O-N 3.32Å; A120-M123 PolarHBondContact O-N 2.85Å; H121-M123 VanDerWaalsContact C-N 3.34Å; H121-M123 PolarHBondContact O-N 2.85Å; M123-S127 WeakPolarHBondContact O-CB 3.37Å; M123-S127 PolarHBondContact O-N 3.44Å; M123-S127 VanDerWaalsContact O-N 3.13Å; M123-S127 PolarHBondContact O-OG 3.18Å; M123-V206 HydrophobicContact CE-CG1 4.26Å; M123-A209 HydrophobicContact CE-CB 3.86Å
124	T	85.7	Confident	82.8	Confident	90 Å²	90	86.6 Å²	86.6	55%	0.552	45%	0.445	S	S	*	.	H	α-helix	trans	-70.6	-40.5	171.2	42.4	0	0	0	0	112.3	A120 H121 Y122 S127 S128	A120-T124 PolarHBondContact O-N 3.19Å; A120-T124 PolarHBondContact O-OG1 3.34Å; H121-T124 WeakPolarHBondContact CA-OG1 3.48Å; H121-T124 PolarHBondContact O-N 3Å; H121-T124 PolarHBondContact O-OG1 3.01Å; Y122-T124 VanDerWaalsContact C-N 3.33Å; Y122-T124 PolarHBondContact O-N 3.3Å; T124-S127 WeakPolarHBondContact O-CB 3.24Å; T124-S127 PolarHBondContact O-N 3.04Å; T124-S128 PolarHBondContact O-N 3.49Å
125	E	86.1	Confident	82.4	Confident	101 Å²	101	85.2 Å²	85.2	47%	0.472	45%	0.446	S	S	.	.	H	α-helix	trans	-63.7	-47.8	176.7	-171.4	179.1	171.9	0	0	111.6	H121 Y122 S127 S128 L129	H121-E125 IonicContact ND1-OE2 3.36Å; H121-E125 PolarHBondContact O-N 3.35Å; Y122-E125 PolarHBondContact O-N 3.23Å; E125-S127 PolarHBondContact O-N 2.83Å; E125-S128 WeakPolarHBondContact O-CB 3.47Å; E125-S128 PolarHBondContact O-N 3.31Å; E125-S128 VanDerWaalsContact O-N 3.07Å; E125-L129 WeakPolarHBondContact O-CG 2.98Å; E125-L129 PolarHBondContact O-N 2.86Å
126	V	84	Confident	81.9	Confident	39 Å²	39	87.4 Å²	87.4	24%	0.236	46%	0.461	C	S	.	.	H	α-helix	trans	-58.6	-34.8	172.7	171.1	0	0	0	0	111.8	Y122 L130 V206	Y122-V126 HydrophobicContact CD1-CG2 4.23Å; Y122-V126 HydrophobicContact CD2-CG2 4.49Å; Y122-V126 HydrophobicContact CE1-CG2 3.79Å; Y122-V126 HydrophobicContact CE2-CG2 4.08Å; Y122-V126 WeakPolarHBondContact O-CG2 3.22Å; Y122-V126 PolarHBondContact O-N 2.73Å; V126-L130 VanDerWaalsContact O-CB 3.3Å; V126-L130 WeakPolarHBondContact O-CB 3.31Å; V126-L130 PolarHBondContact O-N 2.91Å; V126-L130 VanDerWaalsContact O-N 3.08Å; V126-V206 HydrophobicContact CG1-CG2 3.96Å
127	S	81.7	Confident	81.3	Confident	53 Å²	53	89 Å²	89	37%	0.371	46%	0.458	S	S	.	.	H	α-helix	trans	-71.6	-34.7	176	-59.7	0	0	0	0	112.7	M123 T124 E125 A131	M123-S127 WeakPolarHBondContact O-CB 3.37Å; M123-S127 PolarHBondContact O-N 3.44Å; M123-S127 VanDerWaalsContact O-N 3.13Å; M123-S127 PolarHBondContact O-OG 3.18Å; T124-S127 WeakPolarHBondContact O-CB 3.24Å; T124-S127 PolarHBondContact O-N 3.04Å; E125-S127 PolarHBondContact O-N 2.83Å; S127-A131 PolarHBondContact O-N 3.34Å; S127-A131 VanDerWaalsContact O-N 3.14Å
128	S	86	Confident	79.9	Confident	62 Å²	62	86.7 Å²	86.7	43%	0.434	46%	0.458	S	S	.	.	H	α-helix	trans	-66.8	-50.9	174.2	-165.1	0	0	0	0	111.2	T124 E125 L130 A131 E132	T124-S128 PolarHBondContact O-N 3.49Å; E125-S128 WeakPolarHBondContact O-CB 3.47Å; E125-S128 PolarHBondContact O-N 3.31Å; E125-S128 VanDerWaalsContact O-N 3.07Å; S128-L130 PolarHBondContact O-N 3.32Å; S128-A131 WeakPolarHBondContact O-CA 3.49Å; S128-A131 WeakPolarHBondContact O-CB 3.37Å; S128-A131 PolarHBondContact O-N 3.46Å; S128-E132 PolarHBondContact O-N 3.31Å; S128-E132 PolarHBondContact OG-OE1 3.28Å
129	L	84.2	Confident	77.9	Confident	92 Å²	92	86.8 Å²	86.8	48%	0.482	47%	0.465	S	S	.	.	H	α-helix	trans	-58.5	-37.3	177.3	-68.1	172.4	0	0	0	111.7	E125 A131 E132 L133	E125-L129 WeakPolarHBondContact O-CG 2.98Å; E125-L129 PolarHBondContact O-N 2.86Å; L129-A131 VanDerWaalsContact C-N 3.33Å; L129-A131 PolarHBondContact O-N 2.78Å; L129-E132 PolarHBondContact O-N 3.16Å; L129-L133 WeakPolarHBondContact O-CB 3.44Å; L129-L133 PolarHBondContact O-N 3.1Å
130	L	81.7	Confident	76.1	Confident	21 Å²	21	89.5 Å²	89.5	11%	0.11	48%	0.477	C	S	.	.	H	α-helix	trans	-69.6	-27.1	174.6	-174	67.3	0	0	0	113.2	V126 S128 K134 L202 V206	V126-L130 VanDerWaalsContact O-CB 3.3Å; V126-L130 WeakPolarHBondContact O-CB 3.31Å; V126-L130 PolarHBondContact O-N 2.91Å; V126-L130 VanDerWaalsContact O-N 3.08Å; S128-L130 PolarHBondContact O-N 3.32Å; L130-K134 WeakPolarHBondContact O-CG 3.45Å; L130-K134 PolarHBondContact O-N 3.16Å; L130-L202 HydrophobicContact CD1-CB 3.89Å; L130-V206 HydrophobicContact CD2-CB 4.29Å; L130-V206 HydrophobicContact CD2-CG2 4.14Å
131	A	81.2	Confident	73.8	Confident	53 Å²	53	91.5 Å²	91.5	44%	0.438	49%	0.488	S	S	.	.	H	α-helix	trans	-75	-42.9	173.1	0	0	0	0	0	111.4	S127 S128 L129 L133 K134 T135	S127-A131 PolarHBondContact O-N 3.34Å; S127-A131 VanDerWaalsContact O-N 3.14Å; S128-A131 WeakPolarHBondContact O-CA 3.49Å; S128-A131 WeakPolarHBondContact O-CB 3.37Å; S128-A131 PolarHBondContact O-N 3.46Å; L129-A131 VanDerWaalsContact C-N 3.33Å; L129-A131 PolarHBondContact O-N 2.78Å; A131-L133 VanDerWaalsContact C-N 3.33Å; A131-L133 PolarHBondContact O-N 2.91Å; A131-K134 WeakPolarHBondContact O-CA 3.32Å; A131-K134 WeakPolarHBondContact O-CB 3.42Å; A131-K134 PolarHBondContact O-N 3.13Å; A131-T135 PolarHBondContact O-N 3.04Å
132	E	82.3	Confident	71.2	Confident	98 Å²	98	93.1 Å²	93.1	46%	0.458	50%	0.501	S	S	.	.	H	α-helix	trans	-60.2	-41.3	171.6	-69.5	164.6	-144.1	0	0	111.7	S128 L129 K134 T135 L136	S128-E132 PolarHBondContact O-N 3.31Å; S128-E132 PolarHBondContact OG-OE1 3.28Å; L129-E132 PolarHBondContact O-N 3.16Å; E132-K134 PolarHBondContact O-N 3.2Å; E132-T135 PolarHBondContact O-N 3.5Å; E132-T135 PolarHBondContact O-OG1 3.25Å; E132-L136 WeakPolarHBondContact O-CG 3.37Å; E132-L136 PolarHBondContact O-N 3.12Å; E132-L136 VanDerWaalsContact O-N 3.07Å
133	L	78	Confident	68.5	Low	73 Å²	73	92.8 Å²	92.8	38%	0.382	52%	0.515	S	S	.	.	H	α-helix	trans	-66.8	-21.9	174.6	-129.8	141.1	0	0	0	112.5	L129 A131 F137 I199	L129-L133 WeakPolarHBondContact O-CB 3.44Å; L129-L133 PolarHBondContact O-N 3.1Å; A131-L133 VanDerWaalsContact C-N 3.33Å; A131-L133 PolarHBondContact O-N 2.91Å; L133-F137 HydrophobicContact CD2-CD2 4.28Å; L133-F137 HydrophobicContact CD2-CE2 3.99Å; L133-F137 WeakPolarHBondContact O-CD2 3.34Å; L133-I199 HydrophobicContact CD2-CD1 3.9Å; L133-I199 HydrophobicContact CD2-CG1 3.76Å
134	K	77.9	Confident	66	Low	93 Å²	93	100 Å²	100	40%	0.404	55%	0.545	S	S	.	.	H	α-helix	trans	-78.9	-41.6	171.1	-76.6	170.5	-177.1	178.9	0	111.8	L130 A131 E132 L136 F137 S138 I199 S203	L130-K134 WeakPolarHBondContact O-CG 3.45Å; L130-K134 PolarHBondContact O-N 3.16Å; A131-K134 WeakPolarHBondContact O-CA 3.32Å; A131-K134 WeakPolarHBondContact O-CB 3.42Å; A131-K134 PolarHBondContact O-N 3.13Å; E132-K134 PolarHBondContact O-N 3.2Å; K134-L136 VanDerWaalsContact C-N 3.32Å; K134-L136 PolarHBondContact O-N 3.4Å; K134-F137 PolarHBondContact O-N 3.47Å; K134-S138 PolarHBondContact O-N 3.41Å; K134-S138 PolarHBondContact O-OG 2.93Å; K134-I199 HydrophobicContact CG-CG2 3.76Å; K134-S203 WeakPolarHBondContact CE-OG 3.4Å; K134-S203 PolarHBondContact NZ-OG 2.95Å
135	T	77.2	Confident	63.4	Low	98 Å²	98	101.2 Å²	101.2	60%	0.601	55%	0.548	S	S	*	.	H	α-helix	trans	-65.5	-34.9	179	56.6	0	0	0	0	112.5	A131 E132 F137 S138	A131-T135 PolarHBondContact O-N 3.04Å; E132-T135 PolarHBondContact O-N 3.5Å; E132-T135 PolarHBondContact O-OG1 3.25Å; T135-F137 PolarHBondContact O-N 3.36Å; T135-S138 WeakPolarHBondContact O-CB 3.29Å; T135-S138 PolarHBondContact O-N 2.82Å
136	L	71.3	Confident	61	Low	141 Å²	141	101.8 Å²	101.8	74%	0.738	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	-19.2	176.7	-71.6	171.8	0	0	0	114.9	E132 K134	E132-L136 WeakPolarHBondContact O-CG 3.37Å; E132-L136 PolarHBondContact O-N 3.12Å; E132-L136 VanDerWaalsContact O-N 3.07Å; K134-L136 VanDerWaalsContact C-N 3.32Å; K134-L136 PolarHBondContact O-N 3.4Å
137	F	64.9	Low	58.7	Low	92 Å²	92	107.9 Å²	107.9	40%	0.404	59%	0.587	S	S	.	*	T	Hydrogen-bonded Turn	trans	-113.7	23.9	176.4	-69.2	-82.3	0	0	0	112.6	L133 K134 T135 E139 I199	L133-F137 HydrophobicContact CD2-CD2 4.28Å; L133-F137 HydrophobicContact CD2-CE2 3.99Å; L133-F137 WeakPolarHBondContact O-CD2 3.34Å; K134-F137 PolarHBondContact O-N 3.47Å; T135-F137 PolarHBondContact O-N 3.36Å; F137-E139 PolarHBondContact O-N 3.12Å; F137-I199 HydrophobicContact CB-CD1 4.21Å; F137-I199 HydrophobicContact CD2-CD1 3.6Å; F137-I199 HydrophobicContact CE2-CD1 4.23Å; F137-I199 HydrophobicContact CG-CD1 4.07Å
138	S	56.6	Low	56.5	Low	86 Å²	86	111.9 Å²	111.9	60%	0.601	60%	0.604	S	S	*	*			trans	-89.8	61.4	-177.9	-75.1	0	0	0	0	114.1	K134 T135	K134-S138 PolarHBondContact O-N 3.41Å; K134-S138 PolarHBondContact O-OG 2.93Å; T135-S138 WeakPolarHBondContact O-CB 3.29Å; T135-S138 PolarHBondContact O-N 2.82Å
139	E	44.4	Very low	54	Low	163 Å²	163	117.4 Å²	117.4	76%	0.762	62%	0.623	S	S	*	*			trans	-129.1	148.3	161.8	-69.4	-162.3	169.9	0	0	112.5	F137 R196	F137-E139 PolarHBondContact O-N 3.12Å; E139-R196 PolarHBondContact O-NH2 3.3Å
140	H	40.8	Very low	51.6	Low	172 Å²	172	119.5 Å²	119.5	80%	0.796	64%	0.639	S	S	*	*			trans	60.9	69.2	-164.6	-65.4	-53.1	0	0	0	116.4
141	S	33.8	Very low	49.4	Very low	103 Å²	103	126.7 Å²	126.7	72%	0.72	68%	0.677	S	S	*	*			trans	-58.1	162	146.1	47.6	0	0	0	0	111.9
142	N	31.9	Very low	47.2	Very low	159 Å²	159	132 Å²	132	85%	0.85	70%	0.696	S	S	*	*			trans	81	50.4	172.1	-54.5	-16.7	0	0	0	118.7
143	C	28.8	Very low	44.8	Very low	115 Å²	115	134.3 Å²	134.3	78%	0.777	71%	0.712	S	S	*	*	S	Bend	trans	-157.8	157.3	134.6	-152.5	0	0	0	0	110.4
144	F	28.2	Very low	42.7	Very low	197 Å²	197	140.1 Å²	140.1	86%	0.864	74%	0.737	S	S	*	*			trans	69.7	86.1	-171.4	-66.6	-87.7	0	0	0	116.1
145	N	31.3	Very low	40.6	Very low	114 Å²	114	139.5 Å²	139.5	61%	0.61	76%	0.756	S	S	*	*			trans	-101.7	107.7	156.5	-163.6	7	0	0	0	108.2	E147	N145-E147 VanDerWaalsContact C-N 3.29Å; N145-E147 PolarHBondContact O-N 3.42Å
146	P	34.5	Very low	38.5	Very low	113 Å²	113	143.4 Å²	143.4	73%	0.734	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	-6.9	-168.3	-18.8	33.2	0	0	0	116.2
147	E	36.5	Very low	36.8	Very low	168 Å²	168	143.3 Å²	143.3	79%	0.785	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.8	-9.7	-164.9	-64.7	-176	143.8	0	0	114.9	N145	N145-E147 VanDerWaalsContact C-N 3.29Å; N145-E147 PolarHBondContact O-N 3.42Å
148	N	35.3	Very low	35.3	Very low	136 Å²	136	146.9 Å²	146.9	73%	0.727	79%	0.785	S	S	*	*	S	Bend	trans	-99.4	26.4	-173.6	-83.9	6.2	0	0	0	115.6
149	Q	33.9	Very low	34.3	Very low	179 Å²	179	148.7 Å²	148.7	84%	0.836	79%	0.788	S	S	*	*	S	Bend	trans	-124.7	10.9	-171.6	-146.8	106.9	68.1	0	0	116
150	V	34.1	Very low	34	Very low	136 Å²	136	148 Å²	148	82%	0.824	78%	0.783	S	S	*	*	S	Bend	trans	-129.7	2.1	-174.8	-171.3	0	0	0	0	113.8
151	L	34	Very low	33.7	Very low	171 Å²	171	146.2 Å²	146.2	90%	0.895	78%	0.779	S	S	*	*	S	Bend	trans	-135.5	41.4	-172.5	-102.4	158.3	0	0	0	114.4
152	I	35.2	Very low	33.6	Very low	164 Å²	164	149.8 Å²	149.8	84%	0.841	78%	0.784	S	S	*	*			trans	-138.6	81.5	157.2	-52.2	179.1	0	0	0	108.5
153	D	32.7	Very low	33.9	Very low	148 Å²	148	147.9 Å²	147.9	79%	0.791	78%	0.778	S	S	*	*	S	Bend	trans	-166.8	132.6	140.8	-115.2	-17.8	0	0	0	109.5
154	Q	33.6	Very low	34.3	Very low	195 Å²	195	147.2 Å²	147.2	91%	0.911	78%	0.775	S	S	*	*			trans	71.5	77.6	171.1	-53.3	-179.4	26.4	0	0	117.1
155	G	33.6	Very low	34.6	Very low	79 Å²	79	145.8 Å²	145.8	81%	0.814	78%	0.776	S	S	*	*			trans	-143.9	112.9	153.1	0	0	0	0	0	108
156	E	33.6	Very low	34.8	Very low	181 Å²	181	143.3 Å²	143.3	85%	0.846	78%	0.778	S	S	*	*			trans	-74.3	162	-171.1	-74.7	172	115.5	0	0	114.2
157	L	34.1	Very low	34.9	Very low	139 Å²	139	145.2 Å²	145.2	73%	0.728	79%	0.787	S	S	*	*			trans	26.3	122.7	150	-76.3	85.8	0	0	0	117.3
158	E	33.9	Very low	34.9	Very low	167 Å²	167	140.1 Å²	140.1	78%	0.78	78%	0.78	S	S	*	*				-175.7	157	63.9	-124.4	157.4	-151.4	0	0	111.2
159	D	36	Very low	34.9	Very low	123 Å²	123	140.3 Å²	140.3	66%	0.658	79%	0.787	S	S	*	*			trans	30.3	142.3	153.2	-76.3	12.5	0	0	0	122.4
160	K	37.4	Very low	35	Very low	150 Å²	150	140.3 Å²	140.3	65%	0.652	79%	0.787	S	S	*	*			cis	169.3	166	-7.2	-109.8	-171.2	-159.8	80.4	0	104
161	N	35	Very low	35	Very low	133 Å²	133	143.3 Å²	143.3	71%	0.711	79%	0.789	S	S	*	*			trans	78.2	110.4	170.1	-49.2	-18.9	0	0	0	115.1
162	E	32.8	Very low	35	Very low	179 Å²	179	141.7 Å²	141.7	84%	0.836	79%	0.785	S	S	*	*				76.4	139.4	70.4	-77.5	-168.7	166.4	0	0	113.7
163	V	36.3	Very low	35.1	Very low	118 Å²	118	138.3 Å²	138.3	72%	0.715	77%	0.774	S	S	*	*			cis	-166.1	169.8	-15.5	113.2	0	0	0	0	107.6
164	S	38	Very low	35	Very low	102 Å²	102	140.1 Å²	140.1	71%	0.713	78%	0.775	S	S	*	*			trans	80.3	158	162.7	83	0	0	0	0	119.1
165	N	33.9	Very low	35	Very low	166 Å²	166	137.5 Å²	137.5	89%	0.888	77%	0.768	S	S	*	*			cis	-172.6	152.8	-49.8	-105	-17.1	0	0	0	108.8
166	G	36.3	Very low	34.9	Very low	63 Å²	63	138 Å²	138	65%	0.649	76%	0.759	S	S	*	*			trans	116.7	136.3	160.4	0	0	0	0	0	115.8
167	T	35.9	Very low	34.9	Very low	152 Å²	152	135 Å²	135	93%	0.933	75%	0.753	S	S	*	*			cis	164.1	135.7	-27.9	29.6	0	0	0	0	106.5
168	G	36.6	Very low	34.9	Very low	62 Å²	62	134 Å²	134	64%	0.639	76%	0.757	S	S	*	*			trans	133.8	98.4	165.7	0	0	0	0	0	113
169	T	35.6	Very low	34.8	Very low	140 Å²	140	129.8 Å²	129.8	86%	0.859	76%	0.759	S	S	*	*				59.3	129.2	81.8	61.1	0	0	0	0	113.1
170	E	36.4	Very low	34.7	Very low	179 Å²	179	129.4 Å²	129.4	84%	0.836	77%	0.766	S	S	*	*			cis	-139.7	149.8	32	-57.2	167.6	123.6	0	0	110.3
171	K	33.9	Very low	34.5	Very low	199 Å²	199	129.1 Å²	129.1	87%	0.865	78%	0.777	S	S	*	*				50.2	129.6	66.4	-65.3	-172.5	179.1	179.6	0	113.2
172	V	35.2	Very low	34.5	Very low	136 Å²	136	132.7 Å²	132.7	82%	0.824	79%	0.786	S	S	*	*				-155	156.3	53.7	166.4	0	0	0	0	113.1
173	P	35.8	Very low	34.4	Very low	94 Å²	94	128 Å²	128	61%	0.61	79%	0.787	S	S	*	*			trans	-125	-166.8	-176.8	23.7	2.3	0	0	0	115.8
174	F	32	Very low	34.4	Very low	186 Å²	186	126.4 Å²	126.4	82%	0.816	79%	0.785	S	S	*	*			trans	81.3	150.1	169.3	-60.1	-78.6	0	0	0	116.5
175	N	32.9	Very low	34.3	Very low	140 Å²	140	127.3 Å²	127.3	75%	0.749	78%	0.781	S	S	*	*			cis	-153.6	162.4	31.3	-125.6	-16.9	0	0	0	116.3
176	S	31.9	Very low	34.3	Very low	90 Å²	90	130.7 Å²	130.7	63%	0.629	78%	0.782	S	S	*	*			trans	-24.4	165.7	163.2	59.4	0	0	0	0	120.4
177	T	33.6	Very low	34.6	Very low	117 Å²	117	131.5 Å²	131.5	72%	0.718	78%	0.777	S	S	*	*				-174.3	131	63.8	-51.7	0	0	0	0	115.2
178	S	33.1	Very low	34.7	Very low	118 Å²	118	129.7 Å²	129.7	83%	0.825	76%	0.758	S	S	*	*			trans	29.9	141.5	154.3	74.3	0	0	0	0	124.6
179	G	32.5	Very low	34.9	Very low	79 Å²	79	133 Å²	133	81%	0.814	76%	0.756	S	S	*	*			trans	-170.5	14.2	166.7	0	0	0	0	0	120.8
180	S	33.8	Very low	35.4	Very low	115 Å²	115	133.8 Å²	133.8	80%	0.804	75%	0.749	S	S	*	*			trans	18.8	104.1	163.8	-178.4	0	0	0	0	122.1
181	T	33.4	Very low	36.2	Very low	144 Å²	144	132 Å²	132	88%	0.883	74%	0.741	S	S	*	*			trans	-147	99.8	132.5	47.6	0	0	0	0	111.1
182	K	35.7	Very low	37.3	Very low	207 Å²	207	124.8 Å²	124.8	90%	0.9	71%	0.712	S	S	*	*			trans	-88.6	125	173.9	-77.5	180	175.7	176	0	110.6
183	G	30.5	Very low	38.9	Very low	82 Å²	82	124.1 Å²	124.1	85%	0.845	70%	0.699	S	S	*	*	S	Bend	trans	-165.4	-34.4	173.9	0	0	0	0	0	116.5
184	A	36.4	Very low	40.6	Very low	83 Å²	83	129.2 Å²	129.2	69%	0.686	71%	0.706	S	S	*	*	S	Bend	trans	-111.6	-13.5	-165.8	0	0	0	0	0	117	R186	A184-R186 PolarHBondContact O-N 3.09Å
185	L	35	Very low	42.4	Very low	121 Å²	121	121.3 Å²	121.3	63%	0.634	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.7	35.3	-162.4	-59.5	175.6	0	0	0	116.5	E188	L185-E188 WeakPolarHBondContact CD2-OE2 3.39Å
186	R	34.5	Very low	44.3	Very low	238 Å²	238	118.6 Å²	118.6	90%	0.898	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.1	-4.7	179.6	-142.7	176.6	-175	-121.5	-0.8	115.3	A184	A184-R186 PolarHBondContact O-N 3.09Å
187	S	41.3	Very low	46.4	Very low	79 Å²	79	117.1 Å²	117.1	55%	0.552	65%	0.647	S	S	*	*	S	Bend	trans	-93.7	-36.5	173.5	49.3	0	0	0	0	113.7	F189 Q190	S187-F189 PolarHBondContact O-N 3Å; S187-Q190 PolarHBondContact O-N 3.48Å; S187-Q190 VanDerWaalsContact O-N 3.14Å
188	E	39.6	Very low	48.5	Very low	115 Å²	115	117 Å²	117	54%	0.537	64%	0.642	S	S	.	*	H	α-helix	trans	-62.8	-41.1	-172.8	-73.6	171.7	132.1	0	0	113.5	L185 Q190 Q191 D192	L185-E188 WeakPolarHBondContact CD2-OE2 3.39Å; E188-Q190 PolarHBondContact O-N 3.42Å; E188-Q191 PolarHBondContact O-N 2.9Å; E188-D192 PolarHBondContact O-N 3.22Å
189	F	40.4	Very low	50.7	Low	132 Å²	132	112 Å²	112	58%	0.579	61%	0.605	S	S	*	*	H	α-helix	trans	-54.5	-26.7	176.3	-87.6	-82.6	0	0	0	113.6	S187 H193	S187-F189 PolarHBondContact O-N 3Å; F189-H193 PolarHBondContact O-CD2 3Å
190	Q	46.7	Very low	52.8	Low	155 Å²	155	113.2 Å²	113.2	72%	0.724	59%	0.593	S	S	*	*	H	α-helix	trans	-79.8	-26.8	-179.2	-123.1	-178.6	-5	0	0	113.8	S187 E188	S187-Q190 PolarHBondContact O-N 3.48Å; S187-Q190 VanDerWaalsContact O-N 3.14Å; E188-Q190 PolarHBondContact O-N 3.42Å
191	Q	51.5	Low	54.9	Low	143 Å²	143	110 Å²	110	67%	0.668	57%	0.574	S	S	*	*	H	α-helix	trans	-71.8	-39	171.6	-81.2	172.3	-53.9	0	0	110.9	E188 H193 R194 S195	E188-Q191 PolarHBondContact O-N 2.9Å; Q191-H193 VanDerWaalsContact C-N 3.3Å; Q191-H193 PolarHBondContact O-N 3.34Å; Q191-R194 WeakPolarHBondContact O-CB 3.49Å; Q191-R194 PolarHBondContact O-N 2.99Å; Q191-S195 PolarHBondContact O-N 2.77Å; Q191-S195 VanDerWaalsContact O-N 3.13Å; Q191-S195 PolarHBondContact O-OG 3.44Å
192	D	58.3	Low	57.2	Low	46 Å²	46	107.2 Å²	107.2	25%	0.246	55%	0.553	C	S	.	*	H	α-helix	trans	-66.1	-27.9	-175.4	-154.5	31.6	0	0	0	113.5	E188 S195 R196	E188-D192 PolarHBondContact O-N 3.22Å; D192-S195 WeakPolarHBondContact CA-OG 3.49Å; D192-S195 PolarHBondContact O-OG 3.39Å; D192-R196 WeakPolarHBondContact O-CB 3.24Å; D192-R196 VanDerWaalsContact O-CG 3.31Å; D192-R196 WeakPolarHBondContact O-CG 2.91Å; D192-R196 PolarHBondContact O-N 3.28Å; D192-R196 IonicContact OD1-CZ 2.77Å; D192-R196 IonicContact OD1-NH2 3.02Å; D192-R196 IonicContact OD2-CZ 3.96Å; D192-R196 IonicContact OD2-NH1 2.77Å; D192-R196 PolarHBondContact OD2-NH1 3.09Å; D192-R196 IonicContact OD2-NH2 3.73Å; D192-R196 PolarHBondContact OD2-NH2 3.13Å
193	H	69	Low	59.4	Low	123 Å²	123	98.2 Å²	98.2	57%	0.569	52%	0.516	S	S	*	.	H	α-helix	trans	-72.6	-31.9	170.1	-67.8	-57.2	0	0	0	113.3	F189 Q191 A197	F189-H193 PolarHBondContact O-CD2 3Å; Q191-H193 VanDerWaalsContact C-N 3.3Å; Q191-H193 PolarHBondContact O-N 3.34Å; H193-A197 VanDerWaalsContact O-CB 3.28Å; H193-A197 WeakPolarHBondContact O-CB 3.3Å; H193-A197 PolarHBondContact O-N 3.39Å
194	R	70.8	Confident	61.7	Low	200 Å²	200	98.8 Å²	98.8	76%	0.755	50%	0.503	S	S	*	.	H	α-helix	trans	-74.2	-42	179.8	-103.2	-179.8	161.9	-177.1	-5.5	111.9	Q191 A197 L198	Q191-R194 WeakPolarHBondContact O-CB 3.49Å; Q191-R194 PolarHBondContact O-N 2.99Å; R194-A197 PolarHBondContact O-N 2.95Å; R194-L198 WeakPolarHBondContact O-CG 3.5Å; R194-L198 PolarHBondContact O-N 3.36Å; R194-L198 VanDerWaalsContact O-N 3.12Å
195	S	69.9	Low	63.6	Low	21 Å²	21	98.7 Å²	98.7	15%	0.147	49%	0.494	C	S	.	.	H	α-helix	trans	-61.2	-51	173.7	49.8	0	0	0	0	111.2	Q191 D192 A197 L198 I199	Q191-S195 PolarHBondContact O-N 2.77Å; Q191-S195 VanDerWaalsContact O-N 3.13Å; Q191-S195 PolarHBondContact O-OG 3.44Å; D192-S195 WeakPolarHBondContact CA-OG 3.49Å; D192-S195 PolarHBondContact O-OG 3.39Å; S195-A197 VanDerWaalsContact C-N 3.34Å; S195-A197 PolarHBondContact O-N 3.28Å; S195-L198 PolarHBondContact O-N 3.08Å; S195-L198 VanDerWaalsContact O-N 3.13Å; S195-I199 WeakPolarHBondContact O-CG1 3.36Å; S195-I199 PolarHBondContact O-N 2.92Å
196	R	73.1	Confident	65.8	Low	82 Å²	82	94 Å²	94	31%	0.309	47%	0.471	S	S	.	.	H	α-helix	trans	-59.1	-40.4	176.7	-71.2	-176.9	-176.1	120.5	7	112.9	E139 D192 L198 I199 N200	E139-R196 PolarHBondContact O-NH2 3.3Å; D192-R196 WeakPolarHBondContact O-CB 3.24Å; D192-R196 VanDerWaalsContact O-CG 3.31Å; D192-R196 WeakPolarHBondContact O-CG 2.91Å; D192-R196 PolarHBondContact O-N 3.28Å; D192-R196 IonicContact OD1-CZ 2.77Å; D192-R196 IonicContact OD1-NH2 3.02Å; D192-R196 IonicContact OD2-CZ 3.96Å; D192-R196 IonicContact OD2-NH1 2.77Å; D192-R196 PolarHBondContact OD2-NH1 3.09Å; D192-R196 IonicContact OD2-NH2 3.73Å; D192-R196 PolarHBondContact OD2-NH2 3.13Å; R196-L198 VanDerWaalsContact C-N 3.35Å; R196-L198 PolarHBondContact O-N 3.06Å; R196-I199 PolarHBondContact O-N 2.84Å; R196-N200 WeakPolarHBondContact O-CB 3.32Å; R196-N200 PolarHBondContact O-N 3.07Å
197	A	74.6	Confident	67.9	Low	60 Å²	60	85.9 Å²	85.9	50%	0.496	45%	0.451	S	S	.	.	H	α-helix	trans	-62.3	-39.6	175.6	0	0	0	0	0	112.7	H193 R194 S195 A201	H193-A197 VanDerWaalsContact O-CB 3.28Å; H193-A197 WeakPolarHBondContact O-CB 3.3Å; H193-A197 PolarHBondContact O-N 3.39Å; R194-A197 PolarHBondContact O-N 2.95Å; S195-A197 VanDerWaalsContact C-N 3.34Å; S195-A197 PolarHBondContact O-N 3.28Å; A197-A201 WeakPolarHBondContact O-CB 3.35Å; A197-A201 PolarHBondContact O-N 2.81Å
198	L	77.7	Confident	69.5	Low	115 Å²	115	84.5 Å²	84.5	60%	0.602	44%	0.444	S	S	*	.	H	α-helix	trans	-67.7	-43.9	175.1	-72.9	169.3	0	0	0	112.2	R194 S195 R196 N200 A201 L202	R194-L198 WeakPolarHBondContact O-CG 3.5Å; R194-L198 PolarHBondContact O-N 3.36Å; R194-L198 VanDerWaalsContact O-N 3.12Å; S195-L198 PolarHBondContact O-N 3.08Å; S195-L198 VanDerWaalsContact O-N 3.13Å; R196-L198 VanDerWaalsContact C-N 3.35Å; R196-L198 PolarHBondContact O-N 3.06Å; L198-N200 VanDerWaalsContact C-N 3.31Å; L198-N200 PolarHBondContact O-N 2.76Å; L198-A201 PolarHBondContact O-N 2.96Å; L198-L202 WeakPolarHBondContact O-CB 3.26Å; L198-L202 VanDerWaalsContact O-CG 3.3Å; L198-L202 WeakPolarHBondContact O-CG 3.5Å; L198-L202 PolarHBondContact O-N 3.42Å
199	I	80	Confident	71.2	Confident	12 Å²	12	80.8 Å²	80.8	6%	0.062	43%	0.432	C	S	.	.	H	α-helix	trans	-62.8	-38.6	177.7	-66.8	165.9	0	0	0	111.4	L133 K134 F137 S195 R196 S203	L133-I199 HydrophobicContact CD2-CD1 3.9Å; L133-I199 HydrophobicContact CD2-CG1 3.76Å; K134-I199 HydrophobicContact CG-CG2 3.76Å; F137-I199 HydrophobicContact CB-CD1 4.21Å; F137-I199 HydrophobicContact CD2-CD1 3.6Å; F137-I199 HydrophobicContact CE2-CD1 4.23Å; F137-I199 HydrophobicContact CG-CD1 4.07Å; S195-I199 WeakPolarHBondContact O-CG1 3.36Å; S195-I199 PolarHBondContact O-N 2.92Å; R196-I199 PolarHBondContact O-N 2.84Å; I199-S203 WeakPolarHBondContact O-CB 3.37Å; I199-S203 PolarHBondContact O-N 3.04Å; I199-S203 PolarHBondContact O-OG 3.27Å
200	N	77.6	Confident	72.8	Confident	104 Å²	104	81.5 Å²	81.5	56%	0.556	44%	0.436	S	S	*	.	H	α-helix	trans	-68.1	-45.3	174.8	-74.2	-10.1	0	0	0	111.4	R196 L198 L202 S203 T204	R196-N200 WeakPolarHBondContact O-CB 3.32Å; R196-N200 PolarHBondContact O-N 3.07Å; L198-N200 VanDerWaalsContact C-N 3.31Å; L198-N200 PolarHBondContact O-N 2.76Å; N200-L202 PolarHBondContact O-N 3.01Å; N200-S203 PolarHBondContact O-N 3.36Å; N200-T204 WeakPolarHBondContact O-CG2 3.27Å; N200-T204 PolarHBondContact O-N 2.92Å; N200-T204 PolarHBondContact O-OG1 3.33Å
201	A	77.5	Confident	73.9	Confident	49 Å²	49	78.7 Å²	78.7	41%	0.405	43%	0.425	S	S	.	.	H	α-helix	trans	-57.5	-48.9	174.6	0	0	0	0	0	111.5	A197 L198 S203 T204 T205	A197-A201 WeakPolarHBondContact O-CB 3.35Å; A197-A201 PolarHBondContact O-N 2.81Å; L198-A201 PolarHBondContact O-N 2.96Å; A201-S203 PolarHBondContact O-N 2.93Å; A201-T204 PolarHBondContact O-N 3.42Å; A201-T204 VanDerWaalsContact O-N 3.16Å; A201-T204 PolarHBondContact O-OG1 3.3Å; A201-T205 PolarHBondContact O-N 3.12Å; A201-T205 PolarHBondContact O-OG1 3.44Å
202	L	80.2	Confident	74.4	Confident	85 Å²	85	77.8 Å²	77.8	45%	0.445	42%	0.423	S	S	.	.	H	α-helix	trans	-58.1	-46.8	175.6	-71	170.1	0	0	0	111.6	L130 L198 N200 T204 T205 V206	L130-L202 HydrophobicContact CD1-CB 3.89Å; L198-L202 WeakPolarHBondContact O-CB 3.26Å; L198-L202 VanDerWaalsContact O-CG 3.3Å; L198-L202 WeakPolarHBondContact O-CG 3.5Å; L198-L202 PolarHBondContact O-N 3.42Å; N200-L202 PolarHBondContact O-N 3.01Å; L202-T204 VanDerWaalsContact C-N 3.34Å; L202-T204 PolarHBondContact O-N 2.9Å; L202-T205 WeakPolarHBondContact CA-OG1 3.41Å; L202-T205 PolarHBondContact O-N 2.69Å; L202-T205 VanDerWaalsContact O-N 3.16Å; L202-T205 PolarHBondContact O-OG1 3.46Å; L202-V206 WeakPolarHBondContact O-CG2 3.29Å; L202-V206 PolarHBondContact O-N 2.93Å
203	S	82.5	Confident	74.4	Confident	18 Å²	18	80.4 Å²	80.4	13%	0.126	44%	0.437	C	S	.	.	H	α-helix	trans	-57.3	-43.8	174.6	-62.2	0	0	0	0	112.8	K134 I199 N200 A201 T205 V206 S207	K134-S203 WeakPolarHBondContact CE-OG 3.4Å; K134-S203 PolarHBondContact NZ-OG 2.95Å; I199-S203 WeakPolarHBondContact O-CB 3.37Å; I199-S203 PolarHBondContact O-N 3.04Å; I199-S203 PolarHBondContact O-OG 3.27Å; N200-S203 PolarHBondContact O-N 3.36Å; A201-S203 PolarHBondContact O-N 2.93Å; S203-T205 PolarHBondContact O-N 2.79Å; S203-V206 PolarHBondContact O-N 3.28Å; S203-S207 WeakPolarHBondContact O-CB 3.47Å; S203-S207 PolarHBondContact O-N 3.14Å; S203-S207 PolarHBondContact O-OG 2.8Å
204	T	78.3	Confident	73.7	Confident	93 Å²	93	77.1 Å²	77.1	57%	0.571	43%	0.427	S	S	*	.	H	α-helix	trans	-65	-38.5	177	60.7	0	0	0	0	112.3	N200 A201 L202 A208	N200-T204 WeakPolarHBondContact O-CG2 3.27Å; N200-T204 PolarHBondContact O-N 2.92Å; N200-T204 PolarHBondContact O-OG1 3.33Å; A201-T204 PolarHBondContact O-N 3.42Å; A201-T204 VanDerWaalsContact O-N 3.16Å; A201-T204 PolarHBondContact O-OG1 3.3Å; L202-T204 VanDerWaalsContact C-N 3.34Å; L202-T204 PolarHBondContact O-N 2.9Å; T204-A208 VanDerWaalsContact O-CB 3.28Å; T204-A208 WeakPolarHBondContact O-CB 3.37Å; T204-A208 PolarHBondContact O-N 3.4Å
205	T	77.9	Confident	72.6	Confident	82 Å²	82	75.6 Å²	75.6	50%	0.503	43%	0.426	S	S	.	.	H	α-helix	trans	-67.8	-40.5	176.8	52.9	0	0	0	0	113.2	A201 L202 S203 A208 A209	A201-T205 PolarHBondContact O-N 3.12Å; A201-T205 PolarHBondContact O-OG1 3.44Å; L202-T205 WeakPolarHBondContact CA-OG1 3.41Å; L202-T205 PolarHBondContact O-N 2.69Å; L202-T205 VanDerWaalsContact O-N 3.16Å; L202-T205 PolarHBondContact O-OG1 3.46Å; S203-T205 PolarHBondContact O-N 2.79Å; T205-A208 PolarHBondContact O-N 3.31Å; T205-A209 WeakPolarHBondContact O-CB 3.13Å; T205-A209 PolarHBondContact O-N 3.09Å
206	V	80.3	Confident	71.5	Confident	23 Å²	23	83.5 Å²	83.5	14%	0.139	46%	0.458	C	S	.	.	H	α-helix	trans	-67	-42.7	176.4	173.6	0	0	0	0	110.9	M123 V126 L130 L202 S203 A208 A209 K210	M123-V206 HydrophobicContact CE-CG1 4.26Å; V126-V206 HydrophobicContact CG1-CG2 3.96Å; L130-V206 HydrophobicContact CD2-CB 4.29Å; L130-V206 HydrophobicContact CD2-CG2 4.14Å; L202-V206 WeakPolarHBondContact O-CG2 3.29Å; L202-V206 PolarHBondContact O-N 2.93Å; S203-V206 PolarHBondContact O-N 3.28Å; V206-A208 PolarHBondContact O-N 2.97Å; V206-A209 PolarHBondContact O-N 3.19Å; V206-K210 WeakPolarHBondContact O-CB 3.24Å; V206-K210 PolarHBondContact O-N 2.96Å
207	S	78.3	Confident	70	Confident	67 Å²	67	86.6 Å²	86.6	47%	0.469	48%	0.48	S	S	.	.	H	α-helix	trans	-64	-38.5	174.1	-67.7	0	0	0	0	112.7	S203 K210 N211	S203-S207 WeakPolarHBondContact O-CB 3.47Å; S203-S207 PolarHBondContact O-N 3.14Å; S203-S207 PolarHBondContact O-OG 2.8Å; S207-K210 PolarHBondContact O-N 3.23Å; S207-N211 WeakPolarHBondContact O-CB 3.4Å; S207-N211 PolarHBondContact O-N 3.13Å
208	A	75.2	Confident	68.2	Low	50 Å²	50	88 Å²	88	41%	0.413	49%	0.486	S	S	.	.	H	α-helix	trans	-63.6	-46.9	174.5	0	0	0	0	0	111.5	T204 T205 V206 K210 N211 M212	T204-A208 VanDerWaalsContact O-CB 3.28Å; T204-A208 WeakPolarHBondContact O-CB 3.37Å; T204-A208 PolarHBondContact O-N 3.4Å; T205-A208 PolarHBondContact O-N 3.31Å; V206-A208 PolarHBondContact O-N 2.97Å; A208-K210 PolarHBondContact O-N 3.1Å; A208-N211 PolarHBondContact O-N 2.96Å; A208-M212 WeakPolarHBondContact O-CG 3.46Å; A208-M212 PolarHBondContact O-N 3.33Å
209	A	74.6	Confident	66.2	Low	36 Å²	36	92.1 Å²	92.1	30%	0.298	50%	0.499	S	S	.	.	H	α-helix	trans	-59.6	-43.5	175.5	0	0	0	0	0	112.1	M123 T205 V206 N211 M212 N213	M123-A209 HydrophobicContact CE-CB 3.86Å; T205-A209 WeakPolarHBondContact O-CB 3.13Å; T205-A209 PolarHBondContact O-N 3.09Å; V206-A209 PolarHBondContact O-N 3.19Å; A209-N211 VanDerWaalsContact C-N 3.33Å; A209-N211 PolarHBondContact O-N 3.14Å; A209-M212 PolarHBondContact O-N 3.49Å; A209-N213 PolarHBondContact O-N 3.23Å
210	K	73.9	Confident	63.9	Low	148 Å²	148	96.3 Å²	96.3	64%	0.643	53%	0.53	S	S	*	.	H	α-helix	trans	-60.2	-41	175	-168.1	172.9	-177.7	176.2	0	112.1	V206 S207 A208 N213 S214	V206-K210 WeakPolarHBondContact O-CB 3.24Å; V206-K210 PolarHBondContact O-N 2.96Å; S207-K210 PolarHBondContact O-N 3.23Å; A208-K210 PolarHBondContact O-N 3.1Å; K210-N213 PolarHBondContact O-N 2.64Å; K210-S214 PolarHBondContact O-N 3.23Å; K210-S214 PolarHBondContact O-OG 3.39Å
211	N	70.7	Confident	61.5	Low	95 Å²	95	95.1 Å²	95.1	51%	0.508	54%	0.542	S	S	.	.	H	α-helix	trans	-72.5	-27.3	177.9	-79.2	-19.1	0	0	0	114.4	S207 A208 A209 S214 K215	S207-N211 WeakPolarHBondContact O-CB 3.4Å; S207-N211 PolarHBondContact O-N 3.13Å; A208-N211 PolarHBondContact O-N 2.96Å; A209-N211 VanDerWaalsContact C-N 3.33Å; A209-N211 PolarHBondContact O-N 3.14Å; N211-S214 WeakPolarHBondContact CA-OG 3.27Å; N211-S214 PolarHBondContact O-OG 2.64Å; N211-K215 WeakPolarHBondContact O-CG 3.28Å; N211-K215 PolarHBondContact O-N 2.81Å
212	M	62.4	Low	59.4	Low	125 Å²	125	101 Å²	101	62%	0.616	56%	0.561	S	S	*	*	H	α-helix	trans	-70.8	-34.2	171.8	-68.2	-176.7	85.8	0	0	111.6	A208 A209	A208-M212 WeakPolarHBondContact O-CG 3.46Å; A208-M212 PolarHBondContact O-N 3.33Å; A209-M212 PolarHBondContact O-N 3.49Å
213	N	57.9	Low	57.1	Low	101 Å²	101	102 Å²	102	54%	0.54	57%	0.573	S	S	.	*	H	α-helix	trans	-75	-39.5	176.2	-69.7	-13.8	0	0	0	112.4	A209 K210 K216	A209-N213 PolarHBondContact O-N 3.23Å; K210-N213 PolarHBondContact O-N 2.64Å; N213-K216 PolarHBondContact O-N 3.13Å
214	S	55	Low	54.8	Low	53 Å²	53	106.2 Å²	106.2	37%	0.371	60%	0.599	S	S	.	*	H	α-helix	trans	-68.1	-39.6	178.5	62.9	0	0	0	0	113.2	K210 N211 K216 L217 S218	K210-S214 PolarHBondContact O-N 3.23Å; K210-S214 PolarHBondContact O-OG 3.39Å; N211-S214 WeakPolarHBondContact CA-OG 3.27Å; N211-S214 PolarHBondContact O-OG 2.64Å; S214-K216 PolarHBondContact O-N 3.03Å; S214-K216 VanDerWaalsContact O-N 3.14Å; S214-L217 PolarHBondContact O-N 3.19Å; S214-S218 PolarHBondContact O-N 3.15Å; S214-S218 PolarHBondContact O-OG 3.06Å
215	K	46.1	Very low	52.5	Low	169 Å²	169	108.2 Å²	108.2	74%	0.735	60%	0.602	S	S	*	*	H	α-helix	trans	-66.6	-11	177.8	-75.7	-175.9	176.7	-177.6	0	114.9	N211	N211-K215 WeakPolarHBondContact O-CG 3.28Å; N211-K215 PolarHBondContact O-N 2.81Å
216	K	46.9	Very low	50.6	Low	187 Å²	187	108.7 Å²	108.7	81%	0.813	61%	0.605	S	S	*	*	H	α-helix	trans	-92.4	-15	168.5	-85.5	-171.5	172.4	-174.9	0	114.1	N213 S214	N213-K216 PolarHBondContact O-N 3.13Å; S214-K216 PolarHBondContact O-N 3.03Å; S214-K216 VanDerWaalsContact O-N 3.14Å
217	L	42.8	Very low	48.5	Very low	146 Å²	146	115.9 Å²	115.9	76%	0.764	64%	0.637	S	S	*	*	H	α-helix	trans	-103.7	-27.2	179.3	-114.9	67.9	0	0	0	113	S214 K219	S214-L217 PolarHBondContact O-N 3.19Å; L217-K219 PolarHBondContact O-N 3.49Å
218	S	35.9	Very low	46.4	Very low	90 Å²	90	118.6 Å²	118.6	63%	0.629	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	51.7	-179.8	70.8	0	0	0	0	113.3	S214	S214-S218 PolarHBondContact O-N 3.15Å; S214-S218 PolarHBondContact O-OG 3.06Å
219	K	36.2	Very low	44.5	Very low	201 Å²	201	121.5 Å²	121.5	87%	0.874	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-152.6	30.3	169.5	-133.8	177.6	-175	-175.2	0	116.2	L217	L217-K219 PolarHBondContact O-N 3.49Å
220	S	31	Very low	42.6	Very low	101 Å²	101	126.3 Å²	126.3	71%	0.706	66%	0.664	S	S	*	*			trans	-157.9	101.9	161.9	54.7	0	0	0	0	109.6	H222	S220-H222 PolarHBondContact O-N 2.93Å; S220-H222 VanDerWaalsContact O-N 3.1Å
221	G	27.8	Very low	40.6	Very low	79 Å²	79	125.2 Å²	125.2	81%	0.814	67%	0.665	S	S	*	*			trans	-82.5	78	-179.9	0	0	0	0	0	112.4
222	H	33.5	Very low	39	Very low	172 Å²	172	126.2 Å²	126.2	80%	0.796	68%	0.675	S	S	*	*	S	Bend	trans	-165.8	134.5	155.1	-104.9	-74.5	0	0	0	109.3	S220	S220-H222 PolarHBondContact O-N 2.93Å; S220-H222 VanDerWaalsContact O-N 3.1Å
223	P	32.7	Very low	37.5	Very low	107 Å²	107	127.3 Å²	127.3	70%	0.695	68%	0.683	S	S	*	*			trans	-74.1	131.2	174.5	30.2	-32.7	0	0	0	110	Q225	P223-Q225 PolarHBondContact O-N 3.42Å; P223-Q225 VanDerWaalsContact O-N 3.13Å
224	P	33	Very low	36.2	Very low	106 Å²	106	127.4 Å²	127.4	69%	0.688	69%	0.691	S	S	*	*			trans	-74.1	107.1	176.8	28.9	-32.2	0	0	0	110.1	T226	P224-T226 PolarHBondContact O-N 3.02Å; P224-T226 PolarHBondContact O-OG1 3.22Å
225	Q	31.3	Very low	35	Very low	135 Å²	135	129.2 Å²	129.2	63%	0.631	70%	0.704	S	S	*	*			trans	-70.4	79	163	-77.9	177.2	-42.1	0	0	109.3	P223 Q227 Q228	P223-Q225 PolarHBondContact O-N 3.42Å; P223-Q225 VanDerWaalsContact O-N 3.13Å; Q225-Q227 PolarHBondContact O-N 3.31Å; Q225-Q228 PolarHBondContact O-N 3.11Å
226	T	37.5	Very low	34.3	Very low	92 Å²	92	130.1 Å²	130.1	56%	0.564	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.5	1.8	-173.2	-48.4	0	0	0	0	114.4	P224	P224-T226 PolarHBondContact O-N 3.02Å; P224-T226 PolarHBondContact O-OG1 3.22Å
227	Q	36.5	Very low	33.5	Very low	174 Å²	174	127 Å²	127	81%	0.813	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.1	-13.2	177.6	-74.6	-178.6	-35.8	0	0	115.2	Q225	Q225-Q227 PolarHBondContact O-N 3.31Å
228	Q	34.3	Very low	33.1	Very low	124 Å²	124	127.8 Å²	127.8	58%	0.579	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.5	-11.7	-177.1	-69.9	-173.7	-13.7	0	0	114.9	Q225 T232	Q225-Q228 PolarHBondContact O-N 3.11Å; Q228-T232 PolarHBondContact O-OG1 3.26Å
229	I	34.1	Very low	32.7	Very low	110 Å²	110	131.2 Å²	131.2	56%	0.564	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	-25.6	-175.9	-62.2	174.8	0	0	0	112.1
230	F	34.5	Very low	32.6	Very low	137 Å²	137	127.6 Å²	127.6	60%	0.601	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	-34.5	-179.9	-84.2	-85.8	0	0	0	113.8	T232 L233	F230-T232 VanDerWaalsContact C-N 3.29Å; F230-T232 PolarHBondContact O-N 3.47Å; F230-L233 PolarHBondContact O-N 3.4Å
231	D	33.4	Very low	32.6	Very low	125 Å²	125	127.2 Å²	127.2	67%	0.668	72%	0.719	S	S	*	*	G	3₁₀ helix	trans	-71.3	-25.2	-178	-63.6	-21.3	0	0	0	112.8	L233	D231-L233 VanDerWaalsContact C-N 3.33Å; D231-L233 PolarHBondContact O-N 3.03Å
232	T	35.5	Very low	33	Very low	116 Å²	116	131.3 Å²	131.3	71%	0.712	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-79.8	-14.7	-177.2	-47.4	0	0	0	0	112.9	Q228 F230	Q228-T232 PolarHBondContact O-OG1 3.26Å; F230-T232 VanDerWaalsContact C-N 3.29Å; F230-T232 PolarHBondContact O-N 3.47Å
233	L	31.8	Very low	32.9	Very low	149 Å²	149	126.6 Å²	126.6	78%	0.78	71%	0.707	S	S	*	*	G	3₁₀ helix	trans	-94.3	-0.6	179.2	-70.2	169.3	0	0	0	113.5	F230 D231	F230-L233 PolarHBondContact O-N 3.4Å; D231-L233 VanDerWaalsContact C-N 3.33Å; D231-L233 PolarHBondContact O-N 3.03Å
234	S	31.4	Very low	33.1	Very low	103 Å²	103	129.6 Å²	129.6	72%	0.72	72%	0.716	S	S	*	*	S	Bend	trans	-106.6	30.1	-174.6	-169.1	0	0	0	0	114.3
235	S	28.2	Very low	32.9	Very low	90 Å²	90	131.9 Å²	131.9	63%	0.629	72%	0.722	S	S	*	*	S	Bend	trans	-161.2	108.1	163.4	56.6	0	0	0	0	114.7
236	K	32.5	Very low	32.9	Very low	188 Å²	188	129.7 Å²	129.7	82%	0.817	73%	0.727	S	S	*	*			trans	152	123.6	137.1	-85	161.5	-176.9	176.2	0	111.7
237	P	29.2	Very low	32.6	Very low	123 Å²	123	131.1 Å²	131.1	80%	0.799	74%	0.741	S	S	*	*			trans	-83.4	134.8	165.6	33.8	-30.1	0	0	0	109.8
238	L	34.1	Very low	32.2	Very low	162 Å²	162	128.5 Å²	128.5	85%	0.848	74%	0.737	S	S	*	*			trans	-136.5	104.6	168.9	-89.2	169.1	0	0	0	110.1
239	N	27.7	Very low	32.2	Very low	162 Å²	162	130.1 Å²	130.1	87%	0.866	75%	0.749	S	S	*	*			trans	-63.6	134	166.8	-68	-28	0	0	0	109.9
240	S	34.6	Very low	32	Very low	124 Å²	124	132.4 Å²	132.4	87%	0.867	76%	0.758	S	S	*	*			trans	-158.2	134.1	141.1	35.6	0	0	0	0	109.8
241	S	30.4	Very low	31.8	Very low	93 Å²	93	133.5 Å²	133.5	65%	0.65	77%	0.769	S	S	*	*			trans	-94	140.4	-179.4	48.6	0	0	0	0	110.7
242	D	37	Very low	31.7	Very low	165 Å²	165	132.8 Å²	132.8	88%	0.882	77%	0.771	S	S	*	*			trans	-151.8	116	152.2	-96.3	-36.6	0	0	0	109.9
243	P	31.7	Very low	31.4	Very low	73 Å²	73	135.3 Å²	135.3	47%	0.474	78%	0.78	S	S	.	*			trans	-100.1	123.8	179.2	34.8	-30	0	0	0	111.9	E2	E2-P243 WeakPolarHBondContact OE2-CB 3.35Å
244	I	36.8	Very low	31.4	Very low	170 Å²	170	137.4 Å²	137.4	87%	0.872	78%	0.783	S	S	*	*			trans	-127.3	117.5	165.3	-62.1	-175.3	0	0	0	111.3
245	N	29	Very low	31.4	Very low	155 Å²	155	139.5 Å²	139.5	83%	0.829	79%	0.786	S	S	*	*			trans	-65.5	145.8	172.7	-69.1	-67.7	0	0	0	112.3
246	A	29.7	Very low	31.3	Very low	88 Å²	88	142.4 Å²	142.4	73%	0.727	79%	0.794	S	S	*	*				172.5	140.2	101.5	0	0	0	0	0	114.7
247	S	31.8	Very low	31.2	Very low	122 Å²	122	144.7 Å²	144.7	85%	0.853	80%	0.798	S	S	*	*			trans	69.7	57	147.4	-57.9	0	0	0	0	120
248	T	28.1	Very low	31.1	Very low	120 Å²	120	143.1 Å²	143.1	74%	0.736	78%	0.779	S	S	*	*			trans	-77	118	155.8	-60.7	0	0	0	0	111.2	Q250	T248-Q250 HydrophobicContact CG2-CG 4.34Å
249	N	34	Very low	30.9	Very low	157 Å²	157	140.7 Å²	140.7	84%	0.84	77%	0.771	S	S	*	*			trans	-128.2	71.4	160.7	-94.3	-30.8	0	0	0	111.5
250	Q	30.7	Very low	30.9	Very low	158 Å²	158	140.8 Å²	140.8	74%	0.738	77%	0.766	S	S	*	*				45.2	91	127.3	-57.1	-173.6	17.5	0	0	118.7	T248	T248-Q250 HydrophobicContact CG2-CG 4.34Å
251	L	30.7	Very low	30.9	Very low	160 Å²	160	139.2 Å²	139.2	84%	0.838	75%	0.751	S	S	*	*				-90	138.1	129.8	-106	80.2	0	0	0	108.4	N253	L251-N253 PolarHBondContact O-N 3.02Å
252	P	30.9	Very low	31.1	Very low	110 Å²	110	140.8 Å²	140.8	71%	0.714	76%	0.757	S	S	*	*			trans	-76.3	111.4	-178.3	29.2	-33	0	0	0	111.1	K254	P252-K254 PolarHBondContact O-N 3.08Å
253	N	29.6	Very low	31.9	Very low	169 Å²	169	137.1 Å²	137.1	90%	0.904	73%	0.733	S	S	*	*			trans	-63.3	78.9	169.2	-82.4	-19.6	0	0	0	111.2	L251 L255	L251-N253 PolarHBondContact O-N 3.02Å; N253-L255 PolarHBondContact O-N 3.07Å
254	K	30.7	Very low	33.4	Very low	193 Å²	193	137.3 Å²	137.3	84%	0.839	73%	0.73	S	S	*	*			trans	-101.2	41.6	-173.7	-145.7	173	-168.8	174.2	0	112.6	P252	P252-K254 PolarHBondContact O-N 3.08Å
255	L	31.4	Very low	35.1	Very low	148 Å²	148	133.3 Å²	133.3	78%	0.775	72%	0.715	S	S	*	*			trans	-139.7	30.3	-179.3	-108.7	168.7	0	0	0	114.3	N253	N253-L255 PolarHBondContact O-N 3.07Å
256	N	27.6	Very low	37.4	Very low	151 Å²	151	128.1 Å²	128.1	81%	0.807	69%	0.687	S	S	*	*			trans	-115.2	68.7	160	-102.4	-12.5	0	0	0	110.2	H258	N256-H258 VanDerWaalsContact C-N 3.32Å; N256-H258 PolarHBondContact O-N 2.84Å; N256-H258 VanDerWaalsContact O-N 3.1Å
257	R	28.9	Very low	39.7	Very low	236 Å²	236	124.9 Å²	124.9	89%	0.891	66%	0.661	S	S	*	*			trans	-73.5	97.4	157.3	-89.5	-173	172.5	173.2	-2.1	107.2	V259	R257-V259 PolarHBondContact O-N 2.87Å
258	H	26.8	Very low	41.7	Very low	90 Å²	90	121.4 Å²	121.4	42%	0.417	64%	0.636	S	S	.	*			trans	-65.7	76.3	171.1	-150	-107.8	0	0	0	109.2	L94 N256 Q260	L94-H258 VanDerWaalsContact CD2-CD2 3.49Å; L94-H258 WeakPolarHBondContact CD2-CD2 3.37Å; L94-H258 WeakPolarHBondContact CD2-NE2 3.37Å; N256-H258 VanDerWaalsContact C-N 3.32Å; N256-H258 PolarHBondContact O-N 2.84Å; N256-H258 VanDerWaalsContact O-N 3.1Å; H258-Q260 PolarHBondContact O-N 3.35Å
259	V	31	Very low	44.1	Very low	111 Å²	111	118.8 Å²	118.8	67%	0.673	62%	0.617	S	S	*	*			trans	-66.8	118.9	168.5	177.6	0	0	0	0	105.9	R257 V261	R257-V259 PolarHBondContact O-N 2.87Å; V259-V261 WeakPolarHBondContact O-CG2 3.19Å; V259-V261 PolarHBondContact O-N 3.25Å
260	Q	26.9	Very low	46.2	Very low	164 Å²	164	111.3 Å²	111.3	77%	0.766	58%	0.578	S	S	*	*			trans	-55.5	102.7	174	-69	169.6	-15.5	0	0	108.6	H258 T262	H258-Q260 PolarHBondContact O-N 3.35Å; Q260-T262 PolarHBondContact O-N 2.77Å
261	V	35.4	Very low	48.3	Very low	90 Å²	90	105.5 Å²	105.5	55%	0.545	55%	0.554	S	S	.	*			trans	-75.5	83.8	177	-175.8	0	0	0	0	107.8	V259 K263	V259-V261 WeakPolarHBondContact O-CG2 3.19Å; V259-V261 PolarHBondContact O-N 3.25Å; V261-K263 HydrophobicContact CG1-CG 3.94Å; V261-K263 PolarHBondContact O-N 3.43Å
262	T	34.8	Very low	50.5	Low	126 Å²	126	102.3 Å²	102.3	77%	0.773	54%	0.537	S	S	*	.			trans	-56.3	99.5	147.1	44.5	0	0	0	0	105.9	Q260 N264	Q260-T262 PolarHBondContact O-N 2.77Å; T262-N264 VanDerWaalsContact C-N 3.35Å; T262-N264 PolarHBondContact O-N 3.3Å
263	K	52.8	Low	52.9	Low	88 Å²	88	99.9 Å²	99.9	38%	0.383	52%	0.518	S	S	.	.			trans	-62.6	102.4	177.2	-81.3	-156.6	-169.4	160.9	0	107.6	E104 V261 P265	E104-K263 WeakPolarHBondContact OE1-CE 3.26Å; E104-K263 IonicContact OE1-NZ 3.4Å; E104-K263 PolarHBondContact OE1-NZ 3.12Å; E104-K263 WeakPolarHBondContact OE2-CD 3.41Å; E104-K263 WeakPolarHBondContact OE2-CE 3.49Å; E104-K263 IonicContact OE2-NZ 3.38Å; E104-K263 PolarHBondContact OE2-NZ 3.11Å; V261-K263 HydrophobicContact CG1-CG 3.94Å; V261-K263 PolarHBondContact O-N 3.43Å; K263-P265 WeakPolarHBondContact O-CD 3.39Å
264	N	63.3	Low	55.5	Low	78 Å²	78	95.5 Å²	95.5	42%	0.417	50%	0.499	S	S	.	.			trans	-63.8	116.9	173.3	-162.3	-4.4	0	0	0	106.5	T262 I266 A267	T262-N264 VanDerWaalsContact C-N 3.35Å; T262-N264 PolarHBondContact O-N 3.3Å; N264-I266 PolarHBondContact O-N 3.2Å; N264-I266 VanDerWaalsContact O-N 3.16Å; N264-A267 WeakPolarHBondContact O-CB 3.25Å; N264-A267 PolarHBondContact O-N 3.04Å
265	P	72.9	Confident	57.9	Low	86 Å²	86	87.3 Å²	87.3	56%	0.558	47%	0.465	S	S	*	.	H	α-helix	trans	-56.7	-38	-169.3	18.5	-31.5	0	0	0	112.2	K263 A267 S268 D269	K263-P265 WeakPolarHBondContact O-CD 3.39Å; P265-A267 PolarHBondContact O-N 2.86Å; P265-S268 WeakPolarHBondContact O-CB 3.17Å; P265-S268 PolarHBondContact O-N 3.42Å; P265-D269 PolarHBondContact O-N 3.17Å
266	I	78.6	Confident	60.4	Low	45 Å²	45	85.3 Å²	85.3	23%	0.231	45%	0.451	C	S	.	.	H	α-helix	trans	-51.6	-32.6	174.3	-55.8	165.3	0	0	0	112.4	N264 D269 V270 D281 Y285	N264-I266 PolarHBondContact O-N 3.2Å; N264-I266 VanDerWaalsContact O-N 3.16Å; I266-D269 PolarHBondContact O-N 2.96Å; I266-V270 HydrophobicContact CG2-CG2 4.19Å; I266-V270 WeakPolarHBondContact O-CB 3.29Å; I266-V270 VanDerWaalsContact O-CG2 3.32Å; I266-V270 WeakPolarHBondContact O-CG2 3.46Å; I266-V270 PolarHBondContact O-N 3.4Å; I266-D281 HydrophobicContact CD1-CB 4.13Å; I266-Y285 HydrophobicContact CG2-CD1 4.4Å; I266-Y285 HydrophobicContact CG2-CD2 4.5Å; I266-Y285 HydrophobicContact CG2-CG 3.95Å
267	A	76.9	Confident	63.3	Low	21 Å²	21	81.6 Å²	81.6	17%	0.174	44%	0.436	C	S	.	.	H	α-helix	trans	-66.3	-42.8	178.9	0	0	0	0	0	112.2	N264 P265 C271 Y285	N264-A267 WeakPolarHBondContact O-CB 3.25Å; N264-A267 PolarHBondContact O-N 3.04Å; P265-A267 PolarHBondContact O-N 2.86Å; A267-C271 PolarHBondContact O-N 3.21Å; A267-C271 PolarHBondContact O-SG 3.46Å; A267-Y285 HydrophobicContact CB-CE1 3.78Å; A267-Y285 HydrophobicContact CB-CE2 4.24Å; A267-Y285 VanDerWaalsContact CB-CZ 3.49Å; A267-Y285 VanDerWaalsContact CB-OH 3.24Å; A267-Y285 WeakPolarHBondContact CB-OH 3.4Å
268	S	74	Confident	66.2	Low	49 Å²	49	70.5 Å²	70.5	34%	0.343	39%	0.394	S	S	.	.	H	α-helix	trans	-64.7	-43.2	174.6	-57.3	0	0	0	0	110.6	P265 C271 I272	P265-S268 WeakPolarHBondContact O-CB 3.17Å; P265-S268 PolarHBondContact O-N 3.42Å; S268-C271 WeakPolarHBondContact O-CB 3.46Å; S268-C271 PolarHBondContact O-N 3.01Å; S268-I272 WeakPolarHBondContact O-CD1 3.41Å; S268-I272 WeakPolarHBondContact O-CG1 3.44Å; S268-I272 PolarHBondContact O-N 3.39Å
269	D	78.5	Confident	69.1	Low	64 Å²	64	69.7 Å²	69.7	34%	0.342	39%	0.393	S	S	.	.	H	α-helix	trans	-68.9	-39.6	-176.8	-62.3	-29.7	0	0	0	112.1	P265 I266 C271 I272 L273 H282	P265-D269 PolarHBondContact O-N 3.17Å; I266-D269 PolarHBondContact O-N 2.96Å; D269-C271 PolarHBondContact O-N 2.79Å; D269-I272 PolarHBondContact O-N 2.91Å; D269-I272 VanDerWaalsContact O-N 3.13Å; D269-L273 HydrophobicContact CB-CD1 4.1Å; D269-L273 VanDerWaalsContact O-CB 3.31Å; D269-L273 WeakPolarHBondContact O-CB 3.23Å; D269-L273 WeakPolarHBondContact O-CG 3.33Å; D269-L273 PolarHBondContact O-N 3.29Å; D269-H282 WeakPolarHBondContact CB-NE2 3.45Å; D269-H282 IonicContact OD2-NE2 2.79Å
270	V	78	Confident	71.9	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-60.4	-31	172	165.8	0	0	0	0	112.2	I266 W278 H282 Y285 Y290 P346 P347	I266-V270 HydrophobicContact CG2-CG2 4.19Å; I266-V270 WeakPolarHBondContact O-CB 3.29Å; I266-V270 VanDerWaalsContact O-CG2 3.32Å; I266-V270 WeakPolarHBondContact O-CG2 3.46Å; I266-V270 PolarHBondContact O-N 3.4Å; V270-W278 HydrophobicContact CG1-CH2 4.16Å; V270-W278 HydrophobicContact CG1-CZ2 3.77Å; V270-H282 HydrophobicContact CG2-CB 3.72Å; V270-Y285 HydrophobicContact CB-CD1 4.24Å; V270-Y285 HydrophobicContact CG1-CD1 4.41Å; V270-Y285 HydrophobicContact CG2-CD1 3.95Å; V270-Y290 HydrophobicContact CG1-CD2 4.45Å; V270-Y290 HydrophobicContact CG1-CE2 3.94Å; V270-P346 WeakPolarHBondContact O-CB 3.39Å; V270-P347 HydrophobicContact CG1-CG 3.97Å
271	C	75.8	Confident	74.9	Confident	37 Å²	37	62.6 Å²	62.6	25%	0.25	36%	0.357	C	S	.	.	H	α-helix	trans	-74.5	-27.6	176.6	-64.7	0	0	0	0	113.4	A267 S268 D269 P347	A267-C271 PolarHBondContact O-N 3.21Å; A267-C271 PolarHBondContact O-SG 3.46Å; S268-C271 WeakPolarHBondContact O-CB 3.46Å; S268-C271 PolarHBondContact O-N 3.01Å; D269-C271 PolarHBondContact O-N 2.79Å; C271-P347 WeakPolarHBondContact CA-O 3.43Å; C271-P347 PolarHBondContact SG-O 3.37Å
272	I	76.6	Confident	77.5	Confident	92 Å²	92	59 Å²	59	47%	0.472	34%	0.335	S	S	.	.	H	α-helix	trans	-104.2	-40.6	-168.8	-63.8	167.1	0	0	0	111.9	S268 D269	S268-I272 WeakPolarHBondContact O-CD1 3.41Å; S268-I272 WeakPolarHBondContact O-CG1 3.44Å; S268-I272 PolarHBondContact O-N 3.39Å; D269-I272 PolarHBondContact O-N 2.91Å; D269-I272 VanDerWaalsContact O-N 3.13Å
273	L	81.4	Confident	80.2	Confident	59 Å²	59	53.1 Å²	53.1	31%	0.309	30%	0.299	S	S	.	.	S	Bend	trans	-77.2	131.9	-176.2	-66.1	175.8	0	0	0	110.8	D269 W278 P346	D269-L273 HydrophobicContact CB-CD1 4.1Å; D269-L273 VanDerWaalsContact O-CB 3.31Å; D269-L273 WeakPolarHBondContact O-CB 3.23Å; D269-L273 WeakPolarHBondContact O-CG 3.33Å; D269-L273 PolarHBondContact O-N 3.29Å; L273-W278 PolarHBondContact O-NE1 3.03Å; L273-P346 WeakPolarHBondContact O-CG 3.47Å
274	P	82.9	Confident	82	Confident	78 Å²	78	50.4 Å²	50.4	51%	0.506	29%	0.288	S	S	.	.			trans	-53.2	143.5	167.2	-25	34.6	0	0	0	111.1	F276 C277	P274-F276 PolarHBondContact O-N 3.48Å; P274-F276 VanDerWaalsContact O-N 3.08Å; P274-C277 WeakPolarHBondContact O-CB 3.5Å; P274-C277 PolarHBondContact O-N 2.97Å
275	S	82	Confident	83.2	Confident	20 Å²	20	48.8 Å²	48.8	14%	0.14	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-60.1	-26.1	-172.1	49.8	0	0	0	0	114.7	C277 W278 G308 T312	S275-C277 VanDerWaalsContact C-N 3.25Å; S275-C277 PolarHBondContact O-N 3.39Å; S275-W278 PolarHBondContact O-N 2.89Å; S275-G308 CarbonylContact O-C 3.59Å; S275-G308 WeakPolarHBondContact O-CA 3.42Å; S275-T312 WeakPolarHBondContact OG-CG2 3.3Å
276	F	84.6	Confident	84.1	Confident	106 Å²	106	44.9 Å²	44.9	47%	0.465	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-65.7	-24	172.5	-179	-95.8	0	0	0	113.7	P274 K309	P274-F276 PolarHBondContact O-N 3.48Å; P274-F276 VanDerWaalsContact O-N 3.08Å; F276-K309 HydrophobicContact CD1-CG 4.3Å; F276-K309 HydrophobicContact CD2-CB 4.07Å; F276-K309 HydrophobicContact CD2-CG 3.81Å; F276-K309 HydrophobicContact CE1-CD 4.11Å; F276-K309 HydrophobicContact CE1-CG 4.07Å; F276-K309 HydrophobicContact CE2-CB 3.79Å; F276-K309 HydrophobicContact CE2-CD 3.98Å; F276-K309 HydrophobicContact CE2-CG 3.54Å; F276-K309 HydrophobicContact CG-CG 4.19Å; F276-K309 HydrophobicContact CZ-CB 4.36Å; F276-K309 HydrophobicContact CZ-CD 3.67Å; F276-K309 HydrophobicContact CZ-CG 3.69Å; F276-K309 WeakPolarHBondContact O-CG 3.49Å
277	C	87.1	Confident	84.6	Confident	73 Å²	73	42.8 Å²	42.8	49%	0.493	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-93	0.3	-178	-60	0	0	0	0	113.6	P274 S275	P274-C277 WeakPolarHBondContact O-CB 3.5Å; P274-C277 PolarHBondContact O-N 2.97Å; S275-C277 VanDerWaalsContact C-N 3.25Å; S275-C277 PolarHBondContact O-N 3.39Å
278	W	89.5	Confident	85.2	Confident	4 Å²	4	48.8 Å²	48.8	2%	0.015	26%	0.258	C	S	.	.			trans	-69.1	132.9	-179.9	-69.1	-4.7	0	0	0	111.8	V270 L273 S275 H282 V283 W286 G308 L311 L341 P346	V270-W278 HydrophobicContact CG1-CH2 4.16Å; V270-W278 HydrophobicContact CG1-CZ2 3.77Å; L273-W278 PolarHBondContact O-NE1 3.03Å; S275-W278 PolarHBondContact O-N 2.89Å; W278-H282 HydrophobicContact CB-CB 3.67Å; W278-H282 HydrophobicContact CD2-CB 4.48Å; W278-H282 HydrophobicContact CG-CB 3.88Å; W278-V283 HydrophobicContact CB-CG2 4.04Å; W278-V283 HydrophobicContact CE3-CG2 4.28Å; W278-W286 HydrophobicContact CE3-CB 4.44Å; W278-W286 HydrophobicContact CH2-CB 4.1Å; W278-W286 AromaticContact CH2-CD1 3.55Å; W278-W286 HydrophobicContact CH2-CD2 4.29Å; W278-W286 AromaticContact CH2-CG 3.72Å; W278-W286 HydrophobicContact CH2-CG 3.72Å; W278-W286 HydrophobicContact CZ3-CB 3.74Å; W278-W286 AromaticContact CZ3-CD1 3.82Å; W278-W286 AromaticContact CZ3-CD2 3.8Å; W278-W286 HydrophobicContact CZ3-CD2 3.8Å; W278-W286 HydrophobicContact CZ3-CE3 4.34Å; W278-W286 AromaticContact CZ3-CG 3.49Å; W278-W286 HydrophobicContact CZ3-CG 3.49Å; W278-W286 VanDerWaalsContact CZ3-CG 3.49Å; W278-G308 PolarHBondContact O-N 3.26Å; W278-L311 HydrophobicContact CE3-CD2 4.19Å; W278-L311 HydrophobicContact CZ3-CD2 4.16Å; W278-L341 HydrophobicContact CH2-CD1 3.35Å; W278-L341 HydrophobicContact CH2-CD2 4.18Å; W278-L341 HydrophobicContact CH2-CG 4.41Å; W278-L341 HydrophobicContact CZ2-CD1 4.1Å; W278-L341 HydrophobicContact CZ3-CD1 3.96Å; W278-L341 HydrophobicContact CZ3-CD2 3.92Å; W278-P346 HydrophobicContact CZ2-CB 4.11Å
279	N	88.2	Confident	85.8	Confident	73 Å²	73	51.2 Å²	51.2	39%	0.39	26%	0.264	S	S	.	.			trans	-79.5	178.1	166.7	81.7	9.8	0	0	0	110.6	D281 H282 V283	N279-D281 VanDerWaalsContact C-N 3.3Å; N279-D281 PolarHBondContact O-N 3.09Å; N279-D281 WeakPolarHBondContact OD1-CA 3.4Å; N279-D281 WeakPolarHBondContact OD1-CB 3.41Å; N279-D281 PolarHBondContact OD1-N 2.86Å; N279-H282 WeakPolarHBondContact O-CB 3.37Å; N279-H282 PolarHBondContact O-N 3.12Å; N279-H282 PolarHBondContact OD1-N 2.89Å; N279-H282 PolarHBondContact OD1-ND1 2.87Å; N279-V283 PolarHBondContact O-N 3.43Å
280	T	89.5	Confident	86.1	Confident	37 Å²	37	51.6 Å²	51.6	23%	0.227	26%	0.261	C	S	.	.	H	α-helix	trans	-54.4	-41	178.2	-53.2	0	0	0	0	113.9	V283 L284 R305 L306	T280-V283 PolarHBondContact O-N 2.79Å; T280-L284 HydrophobicContact CG2-CD1 4.02Å; T280-L284 HydrophobicContact CG2-CG 4.41Å; T280-L284 WeakPolarHBondContact O-CB 3.38Å; T280-L284 VanDerWaalsContact O-CG 3.28Å; T280-L284 WeakPolarHBondContact O-CG 3.32Å; T280-L284 PolarHBondContact O-N 3.28Å; T280-R305 HydrophobicContact CG2-CB 4.17Å; T280-R305 HydrophobicContact CG2-CG 4.49Å; T280-R305 PolarHBondContact OG1-O 2.73Å; T280-R305 VanDerWaalsContact OG1-O 3.09Å; T280-L306 WeakPolarHBondContact CA-O 3.28Å
281	D	90.5	Very high	86.6	Confident	88 Å²	88	51.6 Å²	51.6	47%	0.471	26%	0.261	S	S	.	.	H	α-helix	trans	-71.6	-35.4	-178.2	-55.3	-49.3	0	0	0	112.2	I266 N279 L284 Y285	I266-D281 HydrophobicContact CD1-CB 4.13Å; N279-D281 VanDerWaalsContact C-N 3.3Å; N279-D281 PolarHBondContact O-N 3.09Å; N279-D281 WeakPolarHBondContact OD1-CA 3.4Å; N279-D281 WeakPolarHBondContact OD1-CB 3.41Å; N279-D281 PolarHBondContact OD1-N 2.86Å; D281-L284 PolarHBondContact O-N 3.23Å; D281-Y285 VanDerWaalsContact O-CB 3.31Å; D281-Y285 WeakPolarHBondContact O-CB 3.47Å; D281-Y285 PolarHBondContact O-N 3.11Å
282	H	90.6	Very high	87.1	Confident	16 Å²	16	50.8 Å²	50.8	7%	0.074	26%	0.255	C	S	.	.	H	α-helix	trans	-63	-44.1	171.3	-67.1	83.1	0	0	0	111.1	D269 V270 W278 N279 Y285 W286	D269-H282 WeakPolarHBondContact CB-NE2 3.45Å; D269-H282 IonicContact OD2-NE2 2.79Å; V270-H282 HydrophobicContact CG2-CB 3.72Å; W278-H282 HydrophobicContact CB-CB 3.67Å; W278-H282 HydrophobicContact CD2-CB 4.48Å; W278-H282 HydrophobicContact CG-CB 3.88Å; N279-H282 WeakPolarHBondContact O-CB 3.37Å; N279-H282 PolarHBondContact O-N 3.12Å; N279-H282 PolarHBondContact OD1-N 2.89Å; N279-H282 PolarHBondContact OD1-ND1 2.87Å; H282-Y285 PolarHBondContact O-N 2.99Å; H282-W286 WeakPolarHBondContact O-CB 3.43Å; H282-W286 PolarHBondContact O-N 3.42Å
283	V	89.7	Confident	87.6	Confident	2 Å²	2	46.8 Å²	46.8	1%	0.012	24%	0.235	C	C	.	.	H	α-helix	trans	-63.6	-44.7	175.1	175	0	0	0	0	110.6	W278 N279 T280 Y285 W286 L287 L306 L311	W278-V283 HydrophobicContact CB-CG2 4.04Å; W278-V283 HydrophobicContact CE3-CG2 4.28Å; N279-V283 PolarHBondContact O-N 3.43Å; T280-V283 PolarHBondContact O-N 2.79Å; V283-Y285 PolarHBondContact O-N 3.22Å; V283-W286 PolarHBondContact O-N 2.92Å; V283-L287 HydrophobicContact CG1-CD1 4Å; V283-L287 HydrophobicContact CG1-CG 4.3Å; V283-L287 VanDerWaalsContact O-CG 3.25Å; V283-L287 WeakPolarHBondContact O-CG 3.44Å; V283-L287 PolarHBondContact O-N 3.09Å; V283-L306 HydrophobicContact CG1-CB 4.19Å; V283-L311 HydrophobicContact CG1-CD2 4.45Å; V283-L311 HydrophobicContact CG2-CD2 4.4Å
284	L	90.7	Very high	87.7	Confident	30 Å²	30	45.2 Å²	45.2	16%	0.157	23%	0.228	C	C	.	.	H	α-helix	trans	-63.2	-40.1	177	-73.7	172.3	0	0	0	112.9	T280 D281 L287 R288 A301	T280-L284 HydrophobicContact CG2-CD1 4.02Å; T280-L284 HydrophobicContact CG2-CG 4.41Å; T280-L284 WeakPolarHBondContact O-CB 3.38Å; T280-L284 VanDerWaalsContact O-CG 3.28Å; T280-L284 WeakPolarHBondContact O-CG 3.32Å; T280-L284 PolarHBondContact O-N 3.28Å; D281-L284 PolarHBondContact O-N 3.23Å; L284-L287 PolarHBondContact O-N 2.92Å; L284-R288 VanDerWaalsContact O-CB 3.29Å; L284-R288 WeakPolarHBondContact O-CB 3.34Å; L284-R288 PolarHBondContact O-N 2.85Å; L284-A301 HydrophobicContact CD2-CB 3.77Å
285	Y	90	Very high	87.7	Confident	45 Å²	45	43.6 Å²	43.6	18%	0.176	23%	0.226	C	C	.	.	H	α-helix	trans	-62	-45.2	172.9	-176.1	-97.2	0	0	0	110.8	I266 A267 V270 D281 H282 V283 L287 R288 E289 Y290	I266-Y285 HydrophobicContact CG2-CD1 4.4Å; I266-Y285 HydrophobicContact CG2-CD2 4.5Å; I266-Y285 HydrophobicContact CG2-CG 3.95Å; A267-Y285 HydrophobicContact CB-CE1 3.78Å; A267-Y285 HydrophobicContact CB-CE2 4.24Å; A267-Y285 VanDerWaalsContact CB-CZ 3.49Å; A267-Y285 VanDerWaalsContact CB-OH 3.24Å; A267-Y285 WeakPolarHBondContact CB-OH 3.4Å; V270-Y285 HydrophobicContact CB-CD1 4.24Å; V270-Y285 HydrophobicContact CG1-CD1 4.41Å; V270-Y285 HydrophobicContact CG2-CD1 3.95Å; D281-Y285 VanDerWaalsContact O-CB 3.31Å; D281-Y285 WeakPolarHBondContact O-CB 3.47Å; D281-Y285 PolarHBondContact O-N 3.11Å; H282-Y285 PolarHBondContact O-N 2.99Å; V283-Y285 PolarHBondContact O-N 3.22Å; Y285-L287 PolarHBondContact O-N 3.38Å; Y285-R288 PolarHBondContact O-N 3.39Å; Y285-E289 HydrophobicContact CD2-CG 3.94Å; Y285-E289 HydrophobicContact CE1-CB 4.36Å; Y285-E289 HydrophobicContact CE1-CG 4.28Å; Y285-E289 HydrophobicContact CE2-CB 4.41Å; Y285-E289 HydrophobicContact CE2-CG 3.49Å; Y285-E289 VanDerWaalsContact CE2-CG 3.49Å; Y285-E289 HydrophobicContact CG-CG 4.48Å; Y285-E289 PolarHBondContact O-N 3.18Å; Y285-Y290 HydrophobicContact CD1-CE2 4.31Å; Y285-Y290 HydrophobicContact CE1-CD2 4.5Å; Y285-Y290 AromaticContact CE1-CE2 3.82Å; Y285-Y290 HydrophobicContact CE1-CE2 3.82Å
286	W	90.7	Very high	87.7	Confident	4 Å²	4	44.7 Å²	44.7	2%	0.015	24%	0.24	C	C	.	.	I	π-helix	trans	-60.4	-46.5	176.4	178.2	75.3	0	0	0	113	W278 H282 V283 R288 Y290 V291 L311 F334 A337 L338 L341	W278-W286 HydrophobicContact CE3-CB 4.44Å; W278-W286 HydrophobicContact CH2-CB 4.1Å; W278-W286 AromaticContact CH2-CD1 3.55Å; W278-W286 HydrophobicContact CH2-CD2 4.29Å; W278-W286 AromaticContact CH2-CG 3.72Å; W278-W286 HydrophobicContact CH2-CG 3.72Å; W278-W286 HydrophobicContact CZ3-CB 3.74Å; W278-W286 AromaticContact CZ3-CD1 3.82Å; W278-W286 AromaticContact CZ3-CD2 3.8Å; W278-W286 HydrophobicContact CZ3-CD2 3.8Å; W278-W286 HydrophobicContact CZ3-CE3 4.34Å; W278-W286 AromaticContact CZ3-CG 3.49Å; W278-W286 HydrophobicContact CZ3-CG 3.49Å; W278-W286 VanDerWaalsContact CZ3-CG 3.49Å; H282-W286 WeakPolarHBondContact O-CB 3.43Å; H282-W286 PolarHBondContact O-N 3.42Å; V283-W286 PolarHBondContact O-N 2.92Å; W286-R288 VanDerWaalsContact C-N 3.29Å; W286-R288 PolarHBondContact O-N 2.86Å; W286-Y290 AromaticContact CD1-CD2 3.95Å; W286-Y290 WeakPolarHBondContact O-CB 3.31Å; W286-Y290 PolarHBondContact O-N 2.95Å; W286-V291 HydrophobicContact CD2-CG2 3.73Å; W286-V291 HydrophobicContact CE3-CG2 3.77Å; W286-V291 HydrophobicContact CH2-CG2 3.59Å; W286-V291 HydrophobicContact CZ2-CG2 3.53Å; W286-V291 HydrophobicContact CZ3-CG2 3.7Å; W286-V291 PolarHBondContact O-N 3.11Å; W286-L311 HydrophobicContact CE3-CD2 3.9Å; W286-L311 HydrophobicContact CH2-CD2 4.44Å; W286-L311 HydrophobicContact CZ3-CD1 3.97Å; W286-L311 HydrophobicContact CZ3-CD2 3.77Å; W286-L311 HydrophobicContact CZ3-CG 4.47Å; W286-F334 HydrophobicContact CZ3-CE2 4.16Å; W286-A337 HydrophobicContact CH2-CB 4.27Å; W286-A337 HydrophobicContact CZ2-CB 4.02Å; W286-L338 HydrophobicContact CH2-CB 4.46Å; W286-L341 HydrophobicContact CH2-CD2 4.28Å; W286-L341 HydrophobicContact CZ2-CB 4.08Å; W286-L341 HydrophobicContact CZ2-CD1 4.46Å; W286-L341 HydrophobicContact CZ2-CD2 3.97Å; W286-L341 HydrophobicContact CZ2-CG 4.42Å
287	L	89.9	Confident	87.7	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.005	22%	0.22	C	C	.	.	I	π-helix	trans	-63.3	-34.1	177.6	-65.9	172.9	0	0	0	112.9	V283 L284 Y285 V291 C292 L293 L298 A301 F334	V283-L287 HydrophobicContact CG1-CD1 4Å; V283-L287 HydrophobicContact CG1-CG 4.3Å; V283-L287 VanDerWaalsContact O-CG 3.25Å; V283-L287 WeakPolarHBondContact O-CG 3.44Å; V283-L287 PolarHBondContact O-N 3.09Å; L284-L287 PolarHBondContact O-N 2.92Å; Y285-L287 PolarHBondContact O-N 3.38Å; L287-V291 HydrophobicContact CD2-CG2 4.24Å; L287-C292 PolarHBondContact O-N 3.26Å; L287-C292 VanDerWaalsContact O-N 3.09Å; L287-L293 HydrophobicContact CB-CD1 4.45Å; L287-L293 HydrophobicContact CD2-CD1 3.89Å; L287-L293 PolarHBondContact O-N 3.49Å; L287-L298 HydrophobicContact CB-CD2 3.52Å; L287-A301 HydrophobicContact CD1-CB 3.51Å; L287-F334 HydrophobicContact CD2-CD2 4.03Å; L287-F334 HydrophobicContact CD2-CE2 3.71Å
288	R	89.5	Confident	87.6	Confident	146 Å²	146	37.2 Å²	37.2	55%	0.551	20%	0.2	S	C	*	.	I	π-helix	trans	-79.2	-55	-178.9	-175.2	-171.6	-68.9	-101.2	-3	112.4	L284 Y285 W286 C292 L298	L284-R288 VanDerWaalsContact O-CB 3.29Å; L284-R288 WeakPolarHBondContact O-CB 3.34Å; L284-R288 PolarHBondContact O-N 2.85Å; Y285-R288 PolarHBondContact O-N 3.39Å; W286-R288 VanDerWaalsContact C-N 3.29Å; W286-R288 PolarHBondContact O-N 2.86Å; R288-C292 VanDerWaalsContact O-CA 3.25Å; R288-C292 WeakPolarHBondContact O-CA 3.47Å; R288-C292 PolarHBondContact O-N 2.86Å; R288-L298 HydrophobicContact CB-CD1 3.94Å; R288-L298 HydrophobicContact CB-CD2 4.22Å; R288-L298 HydrophobicContact CG-CD1 3.92Å
289	E	85.9	Confident	87.4	Confident	100 Å²	100	42.3 Å²	42.3	47%	0.467	23%	0.225	S	C	.	.	I	π-helix	trans	-89.1	-39.5	-169.9	-59.5	-52.6	134.5	0	0	112.5	Y285 C292	Y285-E289 HydrophobicContact CD2-CG 3.94Å; Y285-E289 HydrophobicContact CE1-CB 4.36Å; Y285-E289 HydrophobicContact CE1-CG 4.28Å; Y285-E289 HydrophobicContact CE2-CB 4.41Å; Y285-E289 HydrophobicContact CE2-CG 3.49Å; Y285-E289 VanDerWaalsContact CE2-CG 3.49Å; Y285-E289 HydrophobicContact CG-CG 4.48Å; Y285-E289 PolarHBondContact O-N 3.18Å; E289-C292 PolarHBondContact O-SG 3.33Å
290	Y	85.6	Confident	87.3	Confident	73 Å²	73	39 Å²	39	29%	0.286	21%	0.208	S	C	.	.	I	π-helix	trans	-96.6	-39.8	-176.5	-65.4	-78.7	0	0	0	113.9	V270 Y285 W286 P347 R389	V270-Y290 HydrophobicContact CG1-CD2 4.45Å; V270-Y290 HydrophobicContact CG1-CE2 3.94Å; Y285-Y290 HydrophobicContact CD1-CE2 4.31Å; Y285-Y290 HydrophobicContact CE1-CD2 4.5Å; Y285-Y290 AromaticContact CE1-CE2 3.82Å; Y285-Y290 HydrophobicContact CE1-CE2 3.82Å; W286-Y290 AromaticContact CD1-CD2 3.95Å; W286-Y290 WeakPolarHBondContact O-CB 3.31Å; W286-Y290 PolarHBondContact O-N 2.95Å; Y290-P347 HydrophobicContact CD1-CB 3.61Å; Y290-P347 HydrophobicContact CD1-CG 3.84Å; Y290-P347 HydrophobicContact CD2-CB 4.38Å; Y290-P347 HydrophobicContact CD2-CG 3.67Å; Y290-P347 HydrophobicContact CE1-CB 3.46Å; Y290-P347 VanDerWaalsContact CE1-CB 3.46Å; Y290-P347 HydrophobicContact CE1-CG 3.75Å; Y290-P347 HydrophobicContact CE2-CB 4.23Å; Y290-P347 HydrophobicContact CE2-CG 3.55Å; Y290-P347 HydrophobicContact CG-CB 4.07Å; Y290-P347 HydrophobicContact CG-CG 3.79Å; Y290-R389 PolarHBondContact O-NH2 2.94Å
291	V	87.3	Confident	87.2	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.197	C	C	.	.	S	Bend	trans	-85.1	-23	174.7	-166	0	0	0	0	111.4	W286 L287 L293 K333 A337	W286-V291 HydrophobicContact CD2-CG2 3.73Å; W286-V291 HydrophobicContact CE3-CG2 3.77Å; W286-V291 HydrophobicContact CH2-CG2 3.59Å; W286-V291 HydrophobicContact CZ2-CG2 3.53Å; W286-V291 HydrophobicContact CZ3-CG2 3.7Å; W286-V291 PolarHBondContact O-N 3.11Å; L287-V291 HydrophobicContact CD2-CG2 4.24Å; V291-L293 VanDerWaalsContact C-N 3.31Å; V291-L293 HydrophobicContact CB-CG 4.29Å; V291-L293 HydrophobicContact CG1-CD2 3.89Å; V291-L293 HydrophobicContact CG1-CG 3.83Å; V291-L293 PolarHBondContact O-N 3.32Å; V291-K333 WeakPolarHBondContact O-CE 3.2Å; V291-K333 PolarHBondContact O-NZ 3.46Å; V291-A337 HydrophobicContact CB-CB 4.3Å; V291-A337 HydrophobicContact CG1-CB 3.83Å; V291-A337 HydrophobicContact CG2-CB 3.77Å
292	C	86.6	Confident	87.1	Confident	19 Å²	19	36 Å²	36	13%	0.128	20%	0.195	C	C	.	.			trans	50.2	47.8	-177.5	-41.9	0	0	0	0	112.6	L287 R288 E289 K333 Y360 R385	L287-C292 PolarHBondContact O-N 3.26Å; L287-C292 VanDerWaalsContact O-N 3.09Å; R288-C292 VanDerWaalsContact O-CA 3.25Å; R288-C292 WeakPolarHBondContact O-CA 3.47Å; R288-C292 PolarHBondContact O-N 2.86Å; E289-C292 PolarHBondContact O-SG 3.33Å; C292-K333 PolarHBondContact O-NZ 3.4Å; C292-Y360 HydrophobicContact CB-CD1 3.7Å; C292-Y360 HydrophobicContact CB-CE1 3.76Å; C292-R385 HydrophobicContact CB-CB 4.25Å; C292-R385 VanDerWaalsContact O-CB 3.28Å; C292-R385 WeakPolarHBondContact O-CB 3.39Å
293	L	86.6	Confident	86.9	Confident	8 Å²	8	43.9 Å²	43.9	4%	0.042	22%	0.224	C	C	.	.			trans	-68.5	148.9	174.8	-69.6	-176.5	0	0	0	111.3	L287 V291 C297 L298 K333 F334	L287-L293 HydrophobicContact CB-CD1 4.45Å; L287-L293 HydrophobicContact CD2-CD1 3.89Å; L287-L293 PolarHBondContact O-N 3.49Å; V291-L293 VanDerWaalsContact C-N 3.31Å; V291-L293 HydrophobicContact CB-CG 4.29Å; V291-L293 HydrophobicContact CG1-CD2 3.89Å; V291-L293 HydrophobicContact CG1-CG 3.83Å; V291-L293 PolarHBondContact O-N 3.32Å; L293-C297 HydrophobicContact CB-CB 4.11Å; L293-C297 HydrophobicContact CD1-CB 4.13Å; L293-L298 HydrophobicContact CB-CD2 4.15Å; L293-L298 HydrophobicContact CB-CG 4.47Å; L293-K333 HydrophobicContact CD2-CD 4.49Å; L293-F334 HydrophobicContact CD1-CD2 4.31Å
294	P	84.4	Confident	86.7	Confident	26 Å²	26	46.1 Å²	46.1	17%	0.169	24%	0.236	C	C	.	.			trans	-59.7	154.1	172.1	-22.9	34.4	0	0	0	112.8	G296 C297 L298 L330	P294-G296 VanDerWaalsContact C-N 3.32Å; P294-G296 PolarHBondContact O-N 2.86Å; P294-C297 WeakPolarHBondContact O-CB 3.41Å; P294-C297 PolarHBondContact O-N 3.43Å; P294-L298 PolarHBondContact O-N 2.84Å; P294-L330 HydrophobicContact CG-CD2 3.86Å
295	G	82.2	Confident	86.4	Confident	45 Å²	45	53.8 Å²	53.8	46%	0.464	26%	0.262	S	S	.	.	H	α-helix	trans	-52.6	-42.2	-173.5	0	0	0	0	0	114.7	C297 L298 E299	G295-C297 VanDerWaalsContact C-N 3.25Å; G295-C297 PolarHBondContact O-N 2.93Å; G295-L298 WeakPolarHBondContact O-CB 3.38Å; G295-L298 PolarHBondContact O-N 3.34Å; G295-E299 PolarHBondContact O-N 3.35Å
296	G	81.9	Confident	86.1	Confident	42 Å²	42	52.1 Å²	52.1	43%	0.433	26%	0.256	S	S	.	.	H	α-helix	trans	-60.9	-29.4	178.9	0	0	0	0	0	114.5	P294 A300	P294-G296 VanDerWaalsContact C-N 3.32Å; P294-G296 PolarHBondContact O-N 2.86Å; G296-A300 WeakPolarHBondContact O-CB 3.46Å; G296-A300 PolarHBondContact O-N 3Å
297	C	84.4	Confident	85.8	Confident	6 Å²	6	54 Å²	54	4%	0.041	27%	0.267	C	S	.	.	H	α-helix	trans	-78	-32.2	173.5	-65	0	0	0	0	112.1	L293 P294 G295 A300 A301 L323	L293-C297 HydrophobicContact CB-CB 4.11Å; L293-C297 HydrophobicContact CD1-CB 4.13Å; P294-C297 WeakPolarHBondContact O-CB 3.41Å; P294-C297 PolarHBondContact O-N 3.43Å; G295-C297 VanDerWaalsContact C-N 3.25Å; G295-C297 PolarHBondContact O-N 2.93Å; C297-A300 PolarHBondContact O-N 3.16Å; C297-A301 WeakPolarHBondContact O-CB 3.28Å; C297-A301 PolarHBondContact O-N 3.19Å; C297-L323 PolarHBondContact SG-O 2.68Å
298	L	86.1	Confident	85.6	Confident	16 Å²	16	54 Å²	54	8%	0.084	27%	0.267	C	S	.	.	H	α-helix	trans	-70.6	-38.7	175.9	-60.5	176.4	0	0	0	111.6	L287 R288 L293 P294 G295 A301 S302	L287-L298 HydrophobicContact CB-CD2 3.52Å; R288-L298 HydrophobicContact CB-CD1 3.94Å; R288-L298 HydrophobicContact CB-CD2 4.22Å; R288-L298 HydrophobicContact CG-CD1 3.92Å; L293-L298 HydrophobicContact CB-CD2 4.15Å; L293-L298 HydrophobicContact CB-CG 4.47Å; P294-L298 PolarHBondContact O-N 2.84Å; G295-L298 WeakPolarHBondContact O-CB 3.38Å; G295-L298 PolarHBondContact O-N 3.34Å; L298-A301 PolarHBondContact O-N 3.14Å; L298-S302 WeakPolarHBondContact O-CB 3.21Å; L298-S302 PolarHBondContact O-N 3.14Å
299	E	85.3	Confident	85.3	Confident	112 Å²	112	52 Å²	52	52%	0.523	26%	0.262	S	S	.	.	H	α-helix	trans	-62.4	-43.2	171.4	-72.7	-178.7	-146.6	0	0	111.8	G295 S302 R303	G295-E299 PolarHBondContact O-N 3.35Å; E299-S302 PolarHBondContact O-N 3.44Å; E299-R303 WeakPolarHBondContact O-CG 3.32Å; E299-R303 PolarHBondContact O-N 3.14Å; E299-R303 VanDerWaalsContact O-N 3.09Å; E299-R303 IonicContact OE2-NH2 2.78Å; E299-R303 PolarHBondContact OE2-NH2 3.08Å
300	A	86.2	Confident	85.1	Confident	4 Å²	4	51.5 Å²	51.5	3%	0.033	26%	0.26	C	S	.	.	H	α-helix	trans	-62.1	-45.4	175.5	0	0	0	0	0	111.7	G296 C297 S302 R303 L304 Q322	G296-A300 WeakPolarHBondContact O-CB 3.46Å; G296-A300 PolarHBondContact O-N 3Å; C297-A300 PolarHBondContact O-N 3.16Å; A300-S302 VanDerWaalsContact C-N 3.3Å; A300-S302 PolarHBondContact O-N 2.81Å; A300-R303 PolarHBondContact O-N 3.01Å; A300-L304 WeakPolarHBondContact O-CG 3.43Å; A300-L304 PolarHBondContact O-N 3.18Å; A300-L304 VanDerWaalsContact O-N 3.14Å; A300-Q322 WeakPolarHBondContact CB-O 3.35Å
301	A	86.9	Confident	84.9	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.008	25%	0.246	C	C	.	.	H	α-helix	trans	-59.2	-39.7	174.8	0	0	0	0	0	112.9	L284 L287 C297 L298 L304 R305 L323	L284-A301 HydrophobicContact CD2-CB 3.77Å; L287-A301 HydrophobicContact CD1-CB 3.51Å; C297-A301 WeakPolarHBondContact O-CB 3.28Å; C297-A301 PolarHBondContact O-N 3.19Å; L298-A301 PolarHBondContact O-N 3.14Å; A301-L304 PolarHBondContact O-N 3.42Å; A301-R305 PolarHBondContact O-N 3.02Å; A301-L323 HydrophobicContact CB-CD2 3.52Å
302	S	87.9	Confident	84.4	Confident	60 Å²	60	50.7 Å²	50.7	42%	0.42	26%	0.262	S	S	.	.	H	α-helix	trans	-65.7	-40.4	179.5	-179.7	0	0	0	0	111.6	L298 E299 A300 L304 R305	L298-S302 WeakPolarHBondContact O-CB 3.21Å; L298-S302 PolarHBondContact O-N 3.14Å; E299-S302 PolarHBondContact O-N 3.44Å; A300-S302 VanDerWaalsContact C-N 3.3Å; A300-S302 PolarHBondContact O-N 2.81Å; S302-L304 PolarHBondContact O-N 2.8Å; S302-R305 PolarHBondContact O-N 3.05Å
303	R	87.2	Confident	83.7	Confident	181 Å²	181	53.6 Å²	53.6	68%	0.683	28%	0.283	S	S	*	.	H	α-helix	trans	-65.6	-35.5	175.2	-66.4	171.5	-160.9	-167	7.9	112.9	E299 A300 R305	E299-R303 WeakPolarHBondContact O-CG 3.32Å; E299-R303 PolarHBondContact O-N 3.14Å; E299-R303 VanDerWaalsContact O-N 3.09Å; E299-R303 IonicContact OE2-NH2 2.78Å; E299-R303 PolarHBondContact OE2-NH2 3.08Å; A300-R303 PolarHBondContact O-N 3.01Å; R303-R305 VanDerWaalsContact C-N 3.3Å
304	L	84.8	Confident	82.3	Confident	50 Å²	50	59 Å²	59	26%	0.262	32%	0.316	S	S	.	.	H	α-helix	trans	-76.5	-15.8	178.1	-66.2	174.6	0	0	0	114	A300 A301 S302 L306 I319 Q322 L323	A300-L304 WeakPolarHBondContact O-CG 3.43Å; A300-L304 PolarHBondContact O-N 3.18Å; A300-L304 VanDerWaalsContact O-N 3.14Å; A301-L304 PolarHBondContact O-N 3.42Å; S302-L304 PolarHBondContact O-N 2.8Å; L304-L306 HydrophobicContact CB-CD2 4.1Å; L304-L306 HydrophobicContact CB-CG 3.95Å; L304-L306 PolarHBondContact O-N 2.7Å; L304-I319 HydrophobicContact CD1-CG2 4.27Å; L304-Q322 HydrophobicContact CD1-CB 3.58Å; L304-Q322 HydrophobicContact CD2-CB 3.87Å; L304-Q322 HydrophobicContact CD2-CG 4.3Å; L304-Q322 HydrophobicContact CG-CB 4.27Å; L304-L323 HydrophobicContact CD1-CD2 3.84Å; L304-L323 HydrophobicContact CD1-CG 4.04Å
305	R	84.4	Confident	81.4	Confident	191 Å²	191	59.4 Å²	59.4	72%	0.721	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.3	37.7	-177.5	-63.5	-175.8	169.9	-176.6	-3.8	114.3	T280 A301 S302 R303 D307	T280-R305 HydrophobicContact CG2-CB 4.17Å; T280-R305 HydrophobicContact CG2-CG 4.49Å; T280-R305 PolarHBondContact OG1-O 2.73Å; T280-R305 VanDerWaalsContact OG1-O 3.09Å; A301-R305 PolarHBondContact O-N 3.02Å; S302-R305 PolarHBondContact O-N 3.05Å; R303-R305 VanDerWaalsContact C-N 3.3Å; R305-D307 PolarHBondContact O-N 3.48Å
306	L	84.2	Confident	80.4	Confident	9 Å²	9	60.5 Å²	60.5	5%	0.047	31%	0.311	C	S	.	.			trans	-53.6	125.3	-176.6	-64.4	177.3	0	0	0	112	T280 V283 L304 I319 L323	T280-L306 WeakPolarHBondContact CA-O 3.28Å; V283-L306 HydrophobicContact CG1-CB 4.19Å; L304-L306 HydrophobicContact CB-CD2 4.1Å; L304-L306 HydrophobicContact CB-CG 3.95Å; L304-L306 PolarHBondContact O-N 2.7Å; L306-I319 HydrophobicContact CD1-CG2 4.23Å; L306-I319 HydrophobicContact CD2-CG2 4.07Å; L306-L323 HydrophobicContact CD1-CD1 4.12Å; L306-L323 HydrophobicContact CD1-CD2 3.95Å; L306-L323 HydrophobicContact CD1-CG 4.32Å
307	D	84.9	Confident	79.8	Confident	45 Å²	45	67.1 Å²	67.1	24%	0.241	32%	0.323	C	S	.	.			trans	-97.2	170.3	172.1	82.2	-14.8	0	0	0	112	R305 K309 Q310 L311	R305-D307 PolarHBondContact O-N 3.48Å; D307-K309 PolarHBondContact O-N 2.88Å; D307-K309 WeakPolarHBondContact OD1-CB 3.46Å; D307-K309 PolarHBondContact OD1-N 3.26Å; D307-Q310 PolarHBondContact O-N 3.46Å; D307-Q310 WeakPolarHBondContact OD1-CB 3.33Å; D307-Q310 WeakPolarHBondContact OD1-CG 3.26Å; D307-Q310 PolarHBondContact OD1-N 3.36Å; D307-L311 WeakPolarHBondContact O-CB 3.26Å; D307-L311 PolarHBondContact O-N 3.37Å
308	G	85	Confident	79	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-59.4	-29.1	177.7	0	0	0	0	0	113.8	S275 W278 T312	S275-G308 CarbonylContact O-C 3.59Å; S275-G308 WeakPolarHBondContact O-CA 3.42Å; W278-G308 PolarHBondContact O-N 3.26Å; G308-T312 WeakPolarHBondContact O-CB 3.11Å; G308-T312 WeakPolarHBondContact O-CG2 3.43Å; G308-T312 PolarHBondContact O-N 3.08Å; G308-T312 PolarHBondContact O-OG1 2.98Å
309	K	83.3	Confident	78.4	Confident	104 Å²	104	74 Å²	74	45%	0.452	35%	0.352	S	S	.	.	H	α-helix	trans	-72.2	-47.6	178.3	-51.6	-173.7	178.3	174.1	0	110.7	F276 D307 L311 T312 S313	F276-K309 HydrophobicContact CD1-CG 4.3Å; F276-K309 HydrophobicContact CD2-CB 4.07Å; F276-K309 HydrophobicContact CD2-CG 3.81Å; F276-K309 HydrophobicContact CE1-CD 4.11Å; F276-K309 HydrophobicContact CE1-CG 4.07Å; F276-K309 HydrophobicContact CE2-CB 3.79Å; F276-K309 HydrophobicContact CE2-CD 3.98Å; F276-K309 HydrophobicContact CE2-CG 3.54Å; F276-K309 HydrophobicContact CG-CG 4.19Å; F276-K309 HydrophobicContact CZ-CB 4.36Å; F276-K309 HydrophobicContact CZ-CD 3.67Å; F276-K309 HydrophobicContact CZ-CG 3.69Å; F276-K309 WeakPolarHBondContact O-CG 3.49Å; D307-K309 PolarHBondContact O-N 2.88Å; D307-K309 WeakPolarHBondContact OD1-CB 3.46Å; D307-K309 PolarHBondContact OD1-N 3.26Å; K309-L311 VanDerWaalsContact C-N 3.31Å; K309-L311 PolarHBondContact O-N 3.32Å; K309-T312 PolarHBondContact O-N 3.5Å; K309-T312 PolarHBondContact O-OG1 3.02Å; K309-S313 WeakPolarHBondContact O-CB 3.12Å; K309-S313 PolarHBondContact O-N 3.4Å; K309-S313 PolarHBondContact O-OG 2.91Å
310	Q	82.2	Confident	78	Confident	89 Å²	89	70 Å²	70	42%	0.416	33%	0.333	S	S	.	.	H	α-helix	trans	-62.9	-37.3	174.9	-71.6	170.6	-9	0	0	111.7	D307 T312	D307-Q310 PolarHBondContact O-N 3.46Å; D307-Q310 WeakPolarHBondContact OD1-CB 3.33Å; D307-Q310 WeakPolarHBondContact OD1-CG 3.26Å; D307-Q310 PolarHBondContact OD1-N 3.36Å; Q310-T312 VanDerWaalsContact C-N 3.33Å; Q310-T312 PolarHBondContact O-N 3.3Å
311	L	82	Confident	77.5	Confident	2 Å²	2	77.6 Å²	77.6	1%	0.01	37%	0.366	C	S	.	.	H	α-helix	trans	-64.9	-34.2	176.2	-174.4	63.9	0	0	0	113	W278 V283 W286 D307 K309 F315 F334 L338 L341	W278-L311 HydrophobicContact CE3-CD2 4.19Å; W278-L311 HydrophobicContact CZ3-CD2 4.16Å; V283-L311 HydrophobicContact CG1-CD2 4.45Å; V283-L311 HydrophobicContact CG2-CD2 4.4Å; W286-L311 HydrophobicContact CE3-CD2 3.9Å; W286-L311 HydrophobicContact CH2-CD2 4.44Å; W286-L311 HydrophobicContact CZ3-CD1 3.97Å; W286-L311 HydrophobicContact CZ3-CD2 3.77Å; W286-L311 HydrophobicContact CZ3-CG 4.47Å; D307-L311 WeakPolarHBondContact O-CB 3.26Å; D307-L311 PolarHBondContact O-N 3.37Å; K309-L311 VanDerWaalsContact C-N 3.31Å; K309-L311 PolarHBondContact O-N 3.32Å; L311-F315 HydrophobicContact CD1-CD2 4.48Å; L311-F315 HydrophobicContact CD1-CE2 4.11Å; L311-F334 HydrophobicContact CD1-CE2 4.26Å; L311-F334 HydrophobicContact CD1-CZ 3.89Å; L311-L338 HydrophobicContact CD1-CD1 3.91Å; L311-L338 HydrophobicContact CD1-CG 4.29Å; L311-L341 HydrophobicContact CD2-CD2 3.96Å
312	T	76.9	Confident	76.9	Confident	54 Å²	54	82.3 Å²	82.3	33%	0.331	39%	0.387	S	S	.	.	H	α-helix	trans	-103.1	-27.3	-172.1	53.7	0	0	0	0	115.4	S275 G308 K309 Q310	S275-T312 WeakPolarHBondContact OG-CG2 3.3Å; G308-T312 WeakPolarHBondContact O-CB 3.11Å; G308-T312 WeakPolarHBondContact O-CG2 3.43Å; G308-T312 PolarHBondContact O-N 3.08Å; G308-T312 PolarHBondContact O-OG1 2.98Å; K309-T312 PolarHBondContact O-N 3.5Å; K309-T312 PolarHBondContact O-OG1 3.02Å; Q310-T312 VanDerWaalsContact C-N 3.33Å; Q310-T312 PolarHBondContact O-N 3.3Å
313	S	70.3	Confident	76.6	Confident	81 Å²	81	79.5 Å²	79.5	57%	0.566	37%	0.368	S	S	*	.	H	α-helix	trans	-80.5	-28.2	-165.7	56.9	0	0	0	0	116	K309	K309-S313 WeakPolarHBondContact O-CB 3.12Å; K309-S313 PolarHBondContact O-N 3.4Å; K309-S313 PolarHBondContact O-OG 2.91Å
314	V	57.2	Low	76.2	Confident	121 Å²	121	75.4 Å²	75.4	73%	0.733	36%	0.356	S	S	*	.			trans	169.8	122.2	158.3	146	0	0	0	0	106.8	D316	V314-D316 PolarHBondContact O-N 3.31Å
315	F	65.3	Low	76.1	Confident	34 Å²	34	73.2 Å²	73.2	15%	0.149	35%	0.345	C	S	.	.			trans	-79.7	111.8	-179.5	-144.1	-96.2	0	0	0	110.7	L311 I319 E320 L323 F334 F335 L338	L311-F315 HydrophobicContact CD1-CD2 4.48Å; L311-F315 HydrophobicContact CD1-CE2 4.11Å; F315-I319 HydrophobicContact CD1-CB 4.21Å; F315-I319 HydrophobicContact CE1-CB 3.66Å; F315-I319 HydrophobicContact CE1-CG2 3.62Å; F315-I319 HydrophobicContact CE2-CG2 3.99Å; F315-I319 HydrophobicContact CZ-CB 3.84Å; F315-I319 HydrophobicContact CZ-CG2 3.29Å; F315-E320 HydrophobicContact CD1-CG 4.49Å; F315-E320 HydrophobicContact CE1-CG 4.49Å; F315-L323 HydrophobicContact CE1-CD1 4.28Å; F315-L323 HydrophobicContact CZ-CD1 3.69Å; F315-F334 AromaticContact CD1-CE1 3.87Å; F315-F334 HydrophobicContact CD1-CE1 3.87Å; F315-F334 HydrophobicContact CD2-CE1 4.13Å; F315-F334 HydrophobicContact CD2-CZ 4.12Å; F315-F334 HydrophobicContact CE1-CD1 4.41Å; F315-F334 AromaticContact CE1-CE1 3.47Å; F315-F334 HydrophobicContact CE1-CE1 3.47Å; F315-F334 VanDerWaalsContact CE1-CE1 3.47Å; F315-F334 AromaticContact CE1-CZ 3.94Å; F315-F334 HydrophobicContact CE1-CZ 3.94Å; F315-F334 AromaticContact CE2-CE1 3.77Å; F315-F334 HydrophobicContact CE2-CE1 3.77Å; F315-F334 AromaticContact CE2-CZ 3.47Å; F315-F334 HydrophobicContact CE2-CZ 3.47Å; F315-F334 VanDerWaalsContact CE2-CZ 3.47Å; F315-F334 HydrophobicContact CG-CE1 4.17Å; F315-F334 AromaticContact CZ-CE1 3.41Å; F315-F334 HydrophobicContact CZ-CE1 3.41Å; F315-F334 VanDerWaalsContact CZ-CE1 3.41Å; F315-F334 HydrophobicContact CZ-CE2 4.49Å; F315-F334 AromaticContact CZ-CZ 3.35Å; F315-F334 HydrophobicContact CZ-CZ 3.35Å; F315-F335 HydrophobicContact CB-CE1 4.43Å; F315-F335 HydrophobicContact CD1-CE1 4.26Å; F315-F335 HydrophobicContact CD1-CZ 4.34Å; F315-L338 HydrophobicContact CD2-CD1 4.07Å; F315-L338 HydrophobicContact CG-CD1 4.42Å
316	D	63.1	Low	75.6	Confident	69 Å²	69	68.6 Å²	68.6	37%	0.369	33%	0.334	S	S	.	.			trans	-75.6	142	176.7	-172	-13	0	0	0	110.5	V314 K318 I319 E320	V314-D316 PolarHBondContact O-N 3.31Å; D316-K318 HydrophobicContact CB-CB 4.41Å; D316-K318 PolarHBondContact O-N 3.11Å; D316-K318 PolarHBondContact OD1-N 3.09Å; D316-K318 VanDerWaalsContact OD2-CD 3.25Å; D316-K318 WeakPolarHBondContact OD2-CD 3.44Å; D316-K318 WeakPolarHBondContact OD2-CG 3.45Å; D316-K318 IonicContact OD2-NZ 2.72Å; D316-I319 HydrophobicContact CB-CG1 4.37Å; D316-I319 WeakPolarHBondContact O-CB 3.39Å; D316-I319 PolarHBondContact O-N 3.03Å; D316-E320 PolarHBondContact O-N 2.93Å
317	R	69.2	Low	75.2	Confident	181 Å²	181	69.3 Å²	69.3	68%	0.683	34%	0.338	S	S	*	.	H	α-helix	trans	-54.5	-22.1	169.1	-69.5	-177.5	176	-176.5	-0.2	112.8
318	K	67.1	Low	74.9	Confident	141 Å²	141	70 Å²	70	61%	0.613	34%	0.34	S	S	*	.	H	α-helix	trans	-62.2	-41	169.9	-65.3	179.4	-164.9	159.1	0	112.2	D316 K321 Q322	D316-K318 HydrophobicContact CB-CB 4.41Å; D316-K318 PolarHBondContact O-N 3.11Å; D316-K318 PolarHBondContact OD1-N 3.09Å; D316-K318 VanDerWaalsContact OD2-CD 3.25Å; D316-K318 WeakPolarHBondContact OD2-CD 3.44Å; D316-K318 WeakPolarHBondContact OD2-CG 3.45Å; D316-K318 IonicContact OD2-NZ 2.72Å; K318-K321 PolarHBondContact O-N 3.25Å; K318-Q322 WeakPolarHBondContact O-CG 3.5Å; K318-Q322 PolarHBondContact O-N 2.71Å; K318-Q322 VanDerWaalsContact O-N 3.1Å
319	I	72.5	Confident	74.7	Confident	26 Å²	26	70.1 Å²	70.1	13%	0.133	34%	0.341	C	S	.	.	H	α-helix	trans	-71	-35.5	-179.1	-51.2	175.5	0	0	0	110.5	L304 L306 F315 D316 K321 Q322 L323	L304-I319 HydrophobicContact CD1-CG2 4.27Å; L306-I319 HydrophobicContact CD1-CG2 4.23Å; L306-I319 HydrophobicContact CD2-CG2 4.07Å; F315-I319 HydrophobicContact CD1-CB 4.21Å; F315-I319 HydrophobicContact CE1-CB 3.66Å; F315-I319 HydrophobicContact CE1-CG2 3.62Å; F315-I319 HydrophobicContact CE2-CG2 3.99Å; F315-I319 HydrophobicContact CZ-CB 3.84Å; F315-I319 HydrophobicContact CZ-CG2 3.29Å; D316-I319 HydrophobicContact CB-CG1 4.37Å; D316-I319 WeakPolarHBondContact O-CB 3.39Å; D316-I319 PolarHBondContact O-N 3.03Å; I319-K321 VanDerWaalsContact C-N 3.28Å; I319-K321 PolarHBondContact O-N 3.08Å; I319-Q322 PolarHBondContact O-N 3.21Å; I319-Q322 VanDerWaalsContact O-N 3.17Å; I319-L323 HydrophobicContact CG2-CD1 4.2Å; I319-L323 HydrophobicContact CG2-CG 4.14Å; I319-L323 WeakPolarHBondContact O-CB 3.36Å; I319-L323 PolarHBondContact O-N 2.99Å
320	E	77.5	Confident	74.8	Confident	26 Å²	26	65.8 Å²	65.8	12%	0.121	32%	0.322	C	S	.	.	H	α-helix	trans	-52	-47.3	171.9	-68.2	176.3	-140.8	0	0	112	F315 D316 L325 R331 F335	F315-E320 HydrophobicContact CD1-CG 4.49Å; F315-E320 HydrophobicContact CE1-CG 4.49Å; D316-E320 PolarHBondContact O-N 2.93Å; E320-L325 WeakPolarHBondContact O-CB 3.49Å; E320-L325 PolarHBondContact O-N 2.99Å; E320-L325 VanDerWaalsContact O-N 3.09Å; E320-R331 WeakPolarHBondContact OE2-CD 3.45Å; E320-R331 IonicContact OE2-NH1 3.49Å; E320-R331 PolarHBondContact OE2-NH1 3.06Å; E320-F335 HydrophobicContact CG-CE2 4.12Å; E320-F335 HydrophobicContact CG-CZ 3.86Å; E320-F335 WeakPolarHBondContact OE1-CZ 3.3Å
321	K	76	Confident	75	Confident	165 Å²	165	65.2 Å²	65.2	72%	0.717	32%	0.317	S	S	*	.	H	α-helix	trans	-67.4	-43	178.5	-66.8	-175.6	177	-174	0	111.8	K318 I319 L323 H324	K318-K321 PolarHBondContact O-N 3.25Å; I319-K321 VanDerWaalsContact C-N 3.28Å; I319-K321 PolarHBondContact O-N 3.08Å; K321-L323 VanDerWaalsContact C-N 3.32Å; K321-L323 PolarHBondContact O-N 3.08Å; K321-H324 PolarHBondContact O-N 3.23Å; K321-H324 VanDerWaalsContact O-N 3.12Å
322	Q	74.6	Confident	75.1	Confident	100 Å²	100	67.5 Å²	67.5	47%	0.467	33%	0.326	S	S	.	.	H	α-helix	trans	-67.4	-30.9	-179.2	-70.7	172	-15.6	0	0	112.9	A300 L304 K318 I319 H324	A300-Q322 WeakPolarHBondContact CB-O 3.35Å; L304-Q322 HydrophobicContact CD1-CB 3.58Å; L304-Q322 HydrophobicContact CD2-CB 3.87Å; L304-Q322 HydrophobicContact CD2-CG 4.3Å; L304-Q322 HydrophobicContact CG-CB 4.27Å; K318-Q322 WeakPolarHBondContact O-CG 3.5Å; K318-Q322 PolarHBondContact O-N 2.71Å; K318-Q322 VanDerWaalsContact O-N 3.1Å; I319-Q322 PolarHBondContact O-N 3.21Å; I319-Q322 VanDerWaalsContact O-N 3.17Å; Q322-H324 PolarHBondContact O-N 2.72Å
323	L	80.2	Confident	75.6	Confident	1 Å²	1	64.9 Å²	64.9	1%	0.005	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	3.6	172.5	-77.4	-176.8	0	0	0	114.4	C297 A301 L304 L306 F315 I319 K321 L325 F334	C297-L323 PolarHBondContact SG-O 2.68Å; A301-L323 HydrophobicContact CB-CD2 3.52Å; L304-L323 HydrophobicContact CD1-CD2 3.84Å; L304-L323 HydrophobicContact CD1-CG 4.04Å; L306-L323 HydrophobicContact CD1-CD1 4.12Å; L306-L323 HydrophobicContact CD1-CD2 3.95Å; L306-L323 HydrophobicContact CD1-CG 4.32Å; F315-L323 HydrophobicContact CE1-CD1 4.28Å; F315-L323 HydrophobicContact CZ-CD1 3.69Å; I319-L323 HydrophobicContact CG2-CD1 4.2Å; I319-L323 HydrophobicContact CG2-CG 4.14Å; I319-L323 WeakPolarHBondContact O-CB 3.36Å; I319-L323 PolarHBondContact O-N 2.99Å; K321-L323 VanDerWaalsContact C-N 3.32Å; K321-L323 PolarHBondContact O-N 3.08Å; L323-L325 HydrophobicContact CB-CD1 4.19Å; L323-L325 HydrophobicContact CB-CD2 4.47Å; L323-L325 HydrophobicContact CB-CG 3.8Å; L323-L325 HydrophobicContact CD1-CD1 4.19Å; L323-L325 PolarHBondContact O-N 2.98Å; L323-F334 HydrophobicContact CD1-CZ 4.42Å
324	H	79.6	Confident	76.6	Confident	94 Å²	94	61 Å²	61	44%	0.435	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.6	32.7	-173.2	-53.4	161	0	0	0	113.1	K321 Q322 N326	K321-H324 PolarHBondContact O-N 3.23Å; K321-H324 VanDerWaalsContact O-N 3.12Å; Q322-H324 PolarHBondContact O-N 2.72Å; H324-N326 PolarHBondContact O-N 2.83Å
325	L	82.2	Confident	78	Confident	5 Å²	5	59 Å²	59	3%	0.026	27%	0.265	C	S	.	.			trans	-77.8	62.5	174.3	-55.6	177.6	0	0	0	110.2	E320 L323 D327 L330 R331 F334	E320-L325 WeakPolarHBondContact O-CB 3.49Å; E320-L325 PolarHBondContact O-N 2.99Å; E320-L325 VanDerWaalsContact O-N 3.09Å; L323-L325 HydrophobicContact CB-CD1 4.19Å; L323-L325 HydrophobicContact CB-CD2 4.47Å; L323-L325 HydrophobicContact CB-CG 3.8Å; L323-L325 HydrophobicContact CD1-CD1 4.19Å; L323-L325 PolarHBondContact O-N 2.98Å; L325-D327 VanDerWaalsContact C-N 3.28Å; L325-D327 PolarHBondContact O-N 3.2Å; L325-L330 HydrophobicContact CD2-CB 4.12Å; L325-R331 HydrophobicContact CB-CG 3.57Å; L325-R331 HydrophobicContact CD1-CG 4.46Å; L325-R331 WeakPolarHBondContact O-CD 3.48Å; L325-R331 VanDerWaalsContact O-CG 3.29Å; L325-R331 WeakPolarHBondContact O-CG 3.25Å; L325-F334 HydrophobicContact CD1-CB 4.13Å; L325-F334 HydrophobicContact CD1-CD1 3.93Å; L325-F334 HydrophobicContact CD1-CG 4.01Å
326	N	73.5	Confident	79.1	Confident	94 Å²	94	58.6 Å²	58.6	50%	0.503	27%	0.266	S	S	.	.			trans	-66.2	-30.7	-172.7	-61.3	-28.5	0	0	0	112.7	H324	H324-N326 PolarHBondContact O-N 2.83Å
327	D	76	Confident	80.3	Confident	23 Å²	23	55.3 Å²	55.3	12%	0.123	25%	0.248	C	C	.	.	S	Bend	trans	-103.5	146	-172.4	-59.7	-39.7	0	0	0	112.7	L325 G329 L330 R331 R384	L325-D327 VanDerWaalsContact C-N 3.28Å; L325-D327 PolarHBondContact O-N 3.2Å; D327-G329 PolarHBondContact O-N 3.33Å; D327-L330 HydrophobicContact CB-CG 4.5Å; D327-L330 PolarHBondContact O-N 3.28Å; D327-R331 WeakPolarHBondContact O-CG 3.27Å; D327-R331 PolarHBondContact O-N 2.83Å; D327-R331 VanDerWaalsContact O-N 3.08Å; D327-R384 IonicContact OD2-CZ 2.81Å; D327-R384 IonicContact OD2-NH1 2.68Å; D327-R384 PolarHBondContact OD2-NH1 3.15Å; D327-R384 IonicContact OD2-NH2 3.95Å; D327-R384 PolarHBondContact OD2-NH2 3.04Å
328	E	78.9	Confident	81.2	Confident	60 Å²	60	48 Å²	48	28%	0.28	22%	0.222	S	C	.	.	H	α-helix	trans	-53.8	-39.8	173.1	-172.1	65.2	-167.9	0	0	112.4	R331 K332	E328-R331 PolarHBondContact O-N 3.28Å; E328-R331 IonicContact OE2-CZ 3.04Å; E328-R331 IonicContact OE2-NE 3.38Å; E328-R331 IonicContact OE2-NH2 3.96Å; E328-R331 PolarHBondContact OE2-NH2 3.26Å; E328-K332 WeakPolarHBondContact O-CB 3.44Å; E328-K332 PolarHBondContact O-N 3.18Å
329	G	82	Confident	82	Confident	2 Å²	2	44.7 Å²	44.7	2%	0.021	21%	0.209	C	C	.	.	H	α-helix	trans	-64.9	-41.8	-179.8	0	0	0	0	0	114.1	D327 K332 K333 I523	D327-G329 PolarHBondContact O-N 3.33Å; G329-K332 PolarHBondContact O-N 3.06Å; G329-K333 WeakPolarHBondContact O-CB 3.31Å; G329-K333 PolarHBondContact O-N 3.3Å; G329-I523 WeakPolarHBondContact CA-O 3.48Å
330	L	85.1	Confident	82.6	Confident	13 Å²	13	44.4 Å²	44.4	7%	0.068	21%	0.208	C	C	.	.	H	α-helix	trans	-69.4	-42.1	177.4	-68.1	177.3	0	0	0	111.3	P294 L325 D327 K333 F334	P294-L330 HydrophobicContact CG-CD2 3.86Å; L325-L330 HydrophobicContact CD2-CB 4.12Å; D327-L330 HydrophobicContact CB-CG 4.5Å; D327-L330 PolarHBondContact O-N 3.28Å; L330-K333 PolarHBondContact O-N 2.97Å; L330-F334 WeakPolarHBondContact O-CB 3.35Å; L330-F334 PolarHBondContact O-N 3.38Å
331	R	85.3	Confident	83	Confident	77 Å²	77	43.4 Å²	43.4	29%	0.291	20%	0.203	S	C	.	.	H	α-helix	trans	-59.6	-49.4	172.5	-68.8	-171.9	-64.2	172.1	1.5	111.2	E320 L325 D327 E328 K333 F334 F335	E320-R331 WeakPolarHBondContact OE2-CD 3.45Å; E320-R331 IonicContact OE2-NH1 3.49Å; E320-R331 PolarHBondContact OE2-NH1 3.06Å; L325-R331 HydrophobicContact CB-CG 3.57Å; L325-R331 HydrophobicContact CD1-CG 4.46Å; L325-R331 WeakPolarHBondContact O-CD 3.48Å; L325-R331 VanDerWaalsContact O-CG 3.29Å; L325-R331 WeakPolarHBondContact O-CG 3.25Å; D327-R331 WeakPolarHBondContact O-CG 3.27Å; D327-R331 PolarHBondContact O-N 2.83Å; D327-R331 VanDerWaalsContact O-N 3.08Å; E328-R331 PolarHBondContact O-N 3.28Å; E328-R331 IonicContact OE2-CZ 3.04Å; E328-R331 IonicContact OE2-NE 3.38Å; E328-R331 IonicContact OE2-NH2 3.96Å; E328-R331 PolarHBondContact OE2-NH2 3.26Å; R331-K333 VanDerWaalsContact C-N 3.33Å; R331-K333 PolarHBondContact O-N 2.85Å; R331-F334 PolarHBondContact O-N 3.1Å; R331-F335 HydrophobicContact CB-CD2 4.28Å; R331-F335 HydrophobicContact CB-CE2 4.3Å; R331-F335 WeakPolarHBondContact O-CD2 3.42Å; R331-F335 PolarHBondContact O-N 3.43Å
332	K	84.5	Confident	83.3	Confident	50 Å²	50	44.2 Å²	44.2	22%	0.217	20%	0.202	C	C	.	.	H	α-helix	trans	-58.7	-46.1	179.8	-168.9	68.8	176.2	-173.8	0	111.1	E328 G329 F335 T336 I523	E328-K332 WeakPolarHBondContact O-CB 3.44Å; E328-K332 PolarHBondContact O-N 3.18Å; G329-K332 PolarHBondContact O-N 3.06Å; K332-F335 PolarHBondContact O-N 2.94Å; K332-T336 HydrophobicContact CD-CG2 4.49Å; K332-T336 HydrophobicContact CG-CG2 4.39Å; K332-T336 WeakPolarHBondContact O-CB 3.44Å; K332-T336 VanDerWaalsContact O-CG2 3.28Å; K332-T336 WeakPolarHBondContact O-CG2 3.4Å; K332-T336 PolarHBondContact O-N 2.84Å; K332-T336 PolarHBondContact O-OG1 3.49Å; K332-T336 VanDerWaalsContact O-OG1 3.05Å; K332-I523 HydrophobicContact CG-CG2 4.11Å
333	K	88.6	Confident	83.6	Confident	0 Å²	0	44 Å²	44	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-55.9	-54.8	175.7	-167.5	-176.3	-161.3	-160.7	0	111.8	V291 C292 L293 G329 L330 R331 F335 T336 A337 R385 M390	V291-K333 WeakPolarHBondContact O-CE 3.2Å; V291-K333 PolarHBondContact O-NZ 3.46Å; C292-K333 PolarHBondContact O-NZ 3.4Å; L293-K333 HydrophobicContact CD2-CD 4.49Å; G329-K333 WeakPolarHBondContact O-CB 3.31Å; G329-K333 PolarHBondContact O-N 3.3Å; L330-K333 PolarHBondContact O-N 2.97Å; R331-K333 VanDerWaalsContact C-N 3.33Å; R331-K333 PolarHBondContact O-N 2.85Å; K333-F335 PolarHBondContact O-N 3.17Å; K333-T336 PolarHBondContact O-N 3.15Å; K333-T336 PolarHBondContact O-OG1 3.07Å; K333-A337 PolarHBondContact O-N 3.4Å; K333-R385 WeakPolarHBondContact CE-O 3.38Å; K333-R385 VanDerWaalsContact NZ-CB 3.34Å; K333-R385 PolarHBondContact NZ-O 3.47Å; K333-M390 HydrophobicContact CB-CE 4.41Å; K333-M390 HydrophobicContact CB-CG 3.89Å; K333-M390 HydrophobicContact CB-SD 3.71Å; K333-M390 HydrophobicContact CD-SD 3.74Å; K333-M390 HydrophobicContact CG-CG 3.83Å; K333-M390 HydrophobicContact CG-SD 3.65Å
334	F	89.4	Confident	83.4	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-55.6	-50.8	178.8	177	-104.1	0	0	0	111.8	W286 L287 L293 L311 F315 L323 L325 L330 R331 T336 A337 L338	W286-F334 HydrophobicContact CZ3-CE2 4.16Å; L287-F334 HydrophobicContact CD2-CD2 4.03Å; L287-F334 HydrophobicContact CD2-CE2 3.71Å; L293-F334 HydrophobicContact CD1-CD2 4.31Å; L311-F334 HydrophobicContact CD1-CE2 4.26Å; L311-F334 HydrophobicContact CD1-CZ 3.89Å; F315-F334 AromaticContact CD1-CE1 3.87Å; F315-F334 HydrophobicContact CD1-CE1 3.87Å; F315-F334 HydrophobicContact CD2-CE1 4.13Å; F315-F334 HydrophobicContact CD2-CZ 4.12Å; F315-F334 HydrophobicContact CE1-CD1 4.41Å; F315-F334 AromaticContact CE1-CE1 3.47Å; F315-F334 HydrophobicContact CE1-CE1 3.47Å; F315-F334 VanDerWaalsContact CE1-CE1 3.47Å; F315-F334 AromaticContact CE1-CZ 3.94Å; F315-F334 HydrophobicContact CE1-CZ 3.94Å; F315-F334 AromaticContact CE2-CE1 3.77Å; F315-F334 HydrophobicContact CE2-CE1 3.77Å; F315-F334 AromaticContact CE2-CZ 3.47Å; F315-F334 HydrophobicContact CE2-CZ 3.47Å; F315-F334 VanDerWaalsContact CE2-CZ 3.47Å; F315-F334 HydrophobicContact CG-CE1 4.17Å; F315-F334 AromaticContact CZ-CE1 3.41Å; F315-F334 HydrophobicContact CZ-CE1 3.41Å; F315-F334 VanDerWaalsContact CZ-CE1 3.41Å; F315-F334 HydrophobicContact CZ-CE2 4.49Å; F315-F334 AromaticContact CZ-CZ 3.35Å; F315-F334 HydrophobicContact CZ-CZ 3.35Å; L323-F334 HydrophobicContact CD1-CZ 4.42Å; L325-F334 HydrophobicContact CD1-CB 4.13Å; L325-F334 HydrophobicContact CD1-CD1 3.93Å; L325-F334 HydrophobicContact CD1-CG 4.01Å; L330-F334 WeakPolarHBondContact O-CB 3.35Å; L330-F334 PolarHBondContact O-N 3.38Å; R331-F334 PolarHBondContact O-N 3.1Å; F334-T336 PolarHBondContact O-N 3.47Å; F334-A337 PolarHBondContact O-N 2.79Å; F334-L338 HydrophobicContact CE1-CD1 3.71Å; F334-L338 HydrophobicContact CZ-CD1 3.73Å; F334-L338 WeakPolarHBondContact O-CB 3.36Å; F334-L338 PolarHBondContact O-N 3.4Å
335	F	87.7	Confident	83.4	Confident	77 Å²	77	45.4 Å²	45.4	34%	0.338	22%	0.215	S	C	.	.	H	α-helix	trans	-66.2	-35	179.1	-74.1	-59.9	0	0	0	113.6	F315 E320 R331 K332 K333 A337 L338 E339	F315-F335 HydrophobicContact CB-CE1 4.43Å; F315-F335 HydrophobicContact CD1-CE1 4.26Å; F315-F335 HydrophobicContact CD1-CZ 4.34Å; E320-F335 HydrophobicContact CG-CE2 4.12Å; E320-F335 HydrophobicContact CG-CZ 3.86Å; E320-F335 WeakPolarHBondContact OE1-CZ 3.3Å; R331-F335 HydrophobicContact CB-CD2 4.28Å; R331-F335 HydrophobicContact CB-CE2 4.3Å; R331-F335 WeakPolarHBondContact O-CD2 3.42Å; R331-F335 PolarHBondContact O-N 3.43Å; K332-F335 PolarHBondContact O-N 2.94Å; K333-F335 PolarHBondContact O-N 3.17Å; F335-A337 VanDerWaalsContact C-N 3.32Å; F335-L338 PolarHBondContact O-N 2.96Å; F335-E339 WeakPolarHBondContact O-CB 3.31Å; F335-E339 PolarHBondContact O-N 2.99Å
336	T	87.6	Confident	83.3	Confident	27 Å²	27	45.7 Å²	45.7	17%	0.166	22%	0.218	C	C	.	.	H	α-helix	trans	-68.1	-32.3	174	55.4	0	0	0	0	112.6	K332 K333 F334 D340	K332-T336 HydrophobicContact CD-CG2 4.49Å; K332-T336 HydrophobicContact CG-CG2 4.39Å; K332-T336 WeakPolarHBondContact O-CB 3.44Å; K332-T336 VanDerWaalsContact O-CG2 3.28Å; K332-T336 WeakPolarHBondContact O-CG2 3.4Å; K332-T336 PolarHBondContact O-N 2.84Å; K332-T336 PolarHBondContact O-OG1 3.49Å; K332-T336 VanDerWaalsContact O-OG1 3.05Å; K333-T336 PolarHBondContact O-N 3.15Å; K333-T336 PolarHBondContact O-OG1 3.07Å; F334-T336 PolarHBondContact O-N 3.47Å; T336-D340 VanDerWaalsContact O-CB 3.25Å; T336-D340 WeakPolarHBondContact O-CB 3.44Å; T336-D340 PolarHBondContact O-N 2.81Å
337	A	88.9	Confident	83.2	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-73.9	-36.2	173.3	0	0	0	0	0	112.3	W286 V291 K333 F334 F335 D340 L341	W286-A337 HydrophobicContact CH2-CB 4.27Å; W286-A337 HydrophobicContact CZ2-CB 4.02Å; V291-A337 HydrophobicContact CB-CB 4.3Å; V291-A337 HydrophobicContact CG1-CB 3.83Å; V291-A337 HydrophobicContact CG2-CB 3.77Å; K333-A337 PolarHBondContact O-N 3.4Å; F334-A337 PolarHBondContact O-N 2.79Å; F335-A337 VanDerWaalsContact C-N 3.32Å; A337-D340 PolarHBondContact O-N 3.37Å; A337-L341 WeakPolarHBondContact O-CB 3.42Å; A337-L341 PolarHBondContact O-N 3.13Å
338	L	87.2	Confident	82.6	Confident	27 Å²	27	43.3 Å²	43.3	14%	0.141	22%	0.219	C	C	.	.	H	α-helix	trans	-68.9	-37.8	175.8	-149.8	167.9	0	0	0	111.1	W286 L311 F315 F334 F335 L341 R342	W286-L338 HydrophobicContact CH2-CB 4.46Å; L311-L338 HydrophobicContact CD1-CD1 3.91Å; L311-L338 HydrophobicContact CD1-CG 4.29Å; F315-L338 HydrophobicContact CD2-CD1 4.07Å; F315-L338 HydrophobicContact CG-CD1 4.42Å; F334-L338 HydrophobicContact CE1-CD1 3.71Å; F334-L338 HydrophobicContact CZ-CD1 3.73Å; F334-L338 WeakPolarHBondContact O-CB 3.36Å; F334-L338 PolarHBondContact O-N 3.4Å; F335-L338 PolarHBondContact O-N 2.96Å; L338-L341 WeakPolarHBondContact O-CB 3.47Å; L338-L341 PolarHBondContact O-N 3.25Å; L338-R342 WeakPolarHBondContact O-CB 3.37Å; L338-R342 PolarHBondContact O-N 3.12Å
339	E	84.5	Confident	81.6	Confident	72 Å²	72	45.2 Å²	45.2	34%	0.336	23%	0.23	S	C	.	.	H	α-helix	trans	-68	-41.1	172.5	-170.9	61.8	-159.9	0	0	112	F335 L341 R342 I343	F335-E339 WeakPolarHBondContact O-CB 3.31Å; F335-E339 PolarHBondContact O-N 2.99Å; E339-L341 VanDerWaalsContact C-N 3.29Å; E339-L341 PolarHBondContact O-N 3.36Å; E339-R342 PolarHBondContact O-N 3.06Å; E339-R342 VanDerWaalsContact O-N 3.1Å; E339-R342 IonicContact OE1-CZ 3.3Å; E339-R342 IonicContact OE1-NE 3.73Å; E339-R342 PolarHBondContact OE1-NE 3.47Å; E339-R342 IonicContact OE1-NH2 3.74Å; E339-R342 PolarHBondContact OE1-NH2 2.87Å; E339-R342 IonicContact OE2-CZ 3.98Å; E339-R342 IonicContact OE2-NE 2.73Å; E339-R342 PolarHBondContact OE2-NE 3.41Å; E339-R342 IonicContact OE2-NH2 3Å; E339-R342 PolarHBondContact OE2-NH2 3.17Å; E339-I343 HydrophobicContact CG-CD1 3.79Å; E339-I343 HydrophobicContact CG-CG1 4.31Å; E339-I343 WeakPolarHBondContact O-CG1 3.3Å; E339-I343 PolarHBondContact O-N 2.78Å; E339-I343 WeakPolarHBondContact OE1-CD1 3.44Å
340	D	85.7	Confident	80.3	Confident	20 Å²	20	51 Å²	51	11%	0.107	27%	0.27	C	S	.	.	H	α-helix	trans	-60.9	-35.8	171.5	170.4	52.7	0	0	0	112.1	T336 A337 H344 R351 S356 R389	T336-D340 VanDerWaalsContact O-CB 3.25Å; T336-D340 WeakPolarHBondContact O-CB 3.44Å; T336-D340 PolarHBondContact O-N 2.81Å; A337-D340 PolarHBondContact O-N 3.37Å; D340-H344 WeakPolarHBondContact O-CB 3.41Å; D340-H344 PolarHBondContact O-N 3Å; D340-H344 IonicContact OD1-CD2 3.97Å; D340-H344 PolarHBondContact OD1-CD2 3.31Å; D340-R351 PolarHBondContact O-NH1 3.38Å; D340-R351 IonicContact OD1-NH1 3.73Å; D340-R351 PolarHBondContact OD1-NH1 2.97Å; D340-R351 IonicContact OD2-NH1 3.92Å; D340-R351 PolarHBondContact OD2-NH1 3.32Å; D340-S356 VanDerWaalsContact OD1-CB 3.31Å; D340-S356 WeakPolarHBondContact OD1-CB 3.44Å; D340-S356 PolarHBondContact OD1-OG 3.44Å; D340-S356 VanDerWaalsContact OD2-CB 3.24Å; D340-S356 WeakPolarHBondContact OD2-CB 3.47Å; D340-R389 WeakPolarHBondContact OD2-CD 3.19Å; D340-R389 IonicContact OD2-CZ 2.7Å; D340-R389 IonicContact OD2-NH1 3.44Å; D340-R389 PolarHBondContact OD2-NH1 3.44Å
341	L	85.4	Confident	79.4	Confident	5 Å²	5	52 Å²	52	3%	0.026	27%	0.273	C	S	.	.	H	α-helix	trans	-68	-36.5	171.1	-171.1	75.6	0	0	0	112.3	W278 W286 L311 A337 L338 E339 G345	W278-L341 HydrophobicContact CH2-CD1 3.35Å; W278-L341 HydrophobicContact CH2-CD2 4.18Å; W278-L341 HydrophobicContact CH2-CG 4.41Å; W278-L341 HydrophobicContact CZ2-CD1 4.1Å; W278-L341 HydrophobicContact CZ3-CD1 3.96Å; W278-L341 HydrophobicContact CZ3-CD2 3.92Å; W286-L341 HydrophobicContact CH2-CD2 4.28Å; W286-L341 HydrophobicContact CZ2-CB 4.08Å; W286-L341 HydrophobicContact CZ2-CD1 4.46Å; W286-L341 HydrophobicContact CZ2-CD2 3.97Å; W286-L341 HydrophobicContact CZ2-CG 4.42Å; L311-L341 HydrophobicContact CD2-CD2 3.96Å; A337-L341 WeakPolarHBondContact O-CB 3.42Å; A337-L341 PolarHBondContact O-N 3.13Å; L338-L341 WeakPolarHBondContact O-CB 3.47Å; L338-L341 PolarHBondContact O-N 3.25Å; E339-L341 VanDerWaalsContact C-N 3.29Å; E339-L341 PolarHBondContact O-N 3.36Å; L341-G345 WeakPolarHBondContact CA-O 3.4Å; L341-G345 WeakPolarHBondContact CD1-O 3.37Å; L341-G345 CarbonylContact O-C 3.49Å; L341-G345 WeakPolarHBondContact O-CA 3.16Å; L341-G345 PolarHBondContact O-N 3.46Å; L341-G345 VanDerWaalsContact O-O 3.12Å
342	R	81.9	Confident	78.5	Confident	182 Å²	182	56.7 Å²	56.7	69%	0.687	30%	0.298	S	S	*	.	H	α-helix	trans	-74.9	-39.9	179.5	-171.8	175.2	70.2	148.3	-0.1	113	L338 E339	L338-R342 WeakPolarHBondContact O-CB 3.37Å; L338-R342 PolarHBondContact O-N 3.12Å; E339-R342 PolarHBondContact O-N 3.06Å; E339-R342 VanDerWaalsContact O-N 3.1Å; E339-R342 IonicContact OE1-CZ 3.3Å; E339-R342 IonicContact OE1-NE 3.73Å; E339-R342 PolarHBondContact OE1-NE 3.47Å; E339-R342 IonicContact OE1-NH2 3.74Å; E339-R342 PolarHBondContact OE1-NH2 2.87Å; E339-R342 IonicContact OE2-CZ 3.98Å; E339-R342 IonicContact OE2-NE 2.73Å; E339-R342 PolarHBondContact OE2-NE 3.41Å; E339-R342 IonicContact OE2-NH2 3Å; E339-R342 PolarHBondContact OE2-NH2 3.17Å
343	I	80.6	Confident	78.1	Confident	96 Å²	96	57 Å²	57	49%	0.492	31%	0.305	S	S	.	.	H	α-helix	trans	-78.3	-43.3	-178.5	-65.1	173.5	0	0	0	111.2	E339	E339-I343 HydrophobicContact CG-CD1 3.79Å; E339-I343 HydrophobicContact CG-CG1 4.31Å; E339-I343 WeakPolarHBondContact O-CG1 3.3Å; E339-I343 PolarHBondContact O-N 2.78Å; E339-I343 WeakPolarHBondContact OE1-CD1 3.44Å
344	H	76.2	Confident	77.8	Confident	100 Å²	100	57.3 Å²	57.3	46%	0.463	31%	0.308	S	S	.	.	H	α-helix	trans	-111.1	6.4	-170.5	-57.4	-71.7	0	0	0	114	D340 R351	D340-H344 WeakPolarHBondContact O-CB 3.41Å; D340-H344 PolarHBondContact O-N 3Å; D340-H344 IonicContact OD1-CD2 3.97Å; D340-H344 PolarHBondContact OD1-CD2 3.31Å; H344-R351 HydrophobicContact CB-CG 4.39Å; H344-R351 VanDerWaalsContact CB-CZ 3.47Å; H344-R351 PolarHBondContact O-NH2 2.96Å
345	G	79.9	Confident	77.7	Confident	23 Å²	23	59.1 Å²	59.1	24%	0.237	32%	0.32	C	S	.	.			trans	73.8	-154.9	179	0	0	0	0	0	113.7	L341 R351	L341-G345 WeakPolarHBondContact CA-O 3.4Å; L341-G345 WeakPolarHBondContact CD1-O 3.37Å; L341-G345 CarbonylContact O-C 3.49Å; L341-G345 WeakPolarHBondContact O-CA 3.16Å; L341-G345 PolarHBondContact O-N 3.46Å; L341-G345 VanDerWaalsContact O-O 3.12Å; G345-R351 PolarHBondContact O-NH2 2.86Å
346	P	79.7	Confident	77.7	Confident	11 Å²	11	57.1 Å²	57.1	7%	0.071	32%	0.315	C	S	.	.	S	Bend	trans	-62.6	150.3	172.1	-22.9	34.6	0	0	0	113.4	V270 L273 W278 G348 R351	V270-P346 WeakPolarHBondContact O-CB 3.39Å; L273-P346 WeakPolarHBondContact O-CG 3.47Å; W278-P346 HydrophobicContact CZ2-CB 4.11Å; P346-G348 PolarHBondContact O-N 3.13Å; P346-R351 PolarHBondContact O-NH2 3.46Å
347	P	71.8	Confident	77.6	Confident	12 Å²	12	60.2 Å²	60.2	8%	0.078	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	116.5	176.9	32	-32.5	0	0	0	110.1	V270 C271 Y290	V270-P347 HydrophobicContact CG1-CG 3.97Å; C271-P347 WeakPolarHBondContact CA-O 3.43Å; C271-P347 PolarHBondContact SG-O 3.37Å; Y290-P347 HydrophobicContact CD1-CB 3.61Å; Y290-P347 HydrophobicContact CD1-CG 3.84Å; Y290-P347 HydrophobicContact CD2-CB 4.38Å; Y290-P347 HydrophobicContact CD2-CG 3.67Å; Y290-P347 HydrophobicContact CE1-CB 3.46Å; Y290-P347 VanDerWaalsContact CE1-CB 3.46Å; Y290-P347 HydrophobicContact CE1-CG 3.75Å; Y290-P347 HydrophobicContact CE2-CB 4.23Å; Y290-P347 HydrophobicContact CE2-CG 3.55Å; Y290-P347 HydrophobicContact CG-CB 4.07Å; Y290-P347 HydrophobicContact CG-CG 3.79Å
348	G	62.9	Low	77.7	Confident	56 Å²	56	60.3 Å²	60.3	58%	0.577	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	141.4	-27.4	-178.3	0	0	0	0	0	113.6	P346	P346-G348 PolarHBondContact O-N 3.13Å
349	I	59.5	Low	77.9	Confident	99 Å²	99	61.7 Å²	61.7	51%	0.508	34%	0.34	S	S	.	.	S	Bend	trans	-63.8	137.5	164.2	-56.4	174.7	0	0	0	107.9	R351	I349-R351 WeakPolarHBondContact O-CG 3.47Å; I349-R351 PolarHBondContact O-N 2.96Å
350	S	54	Low	78.2	Confident	124 Å²	124	60.4 Å²	60.4	87%	0.867	33%	0.333	S	S	*	.			trans	-51.5	102.7	-179	-177.7	0	0	0	0	111.5
351	R	66.2	Low	78.6	Confident	35 Å²	35	63.2 Å²	63.2	13%	0.132	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-94.1	142.9	174	-62	-173.1	-172.3	-146.6	-10.1	108.3	D340 H344 G345 P346 I349 H357	D340-R351 PolarHBondContact O-NH1 3.38Å; D340-R351 IonicContact OD1-NH1 3.73Å; D340-R351 PolarHBondContact OD1-NH1 2.97Å; D340-R351 IonicContact OD2-NH1 3.92Å; D340-R351 PolarHBondContact OD2-NH1 3.32Å; H344-R351 HydrophobicContact CB-CG 4.39Å; H344-R351 VanDerWaalsContact CB-CZ 3.47Å; H344-R351 PolarHBondContact O-NH2 2.96Å; G345-R351 PolarHBondContact O-NH2 2.86Å; P346-R351 PolarHBondContact O-NH2 3.46Å; I349-R351 WeakPolarHBondContact O-CG 3.47Å; I349-R351 PolarHBondContact O-N 2.96Å; R351-H357 VanDerWaalsContact CB-CE1 3.47Å; R351-H357 WeakPolarHBondContact CB-CE1 3.43Å
352	H	65.6	Low	79	Confident	175 Å²	175	64.6 Å²	64.6	81%	0.81	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-62.5	142.9	164	-66.9	-65.6	0	0	0	109.6	G354 H357	H352-G354 PolarHBondContact O-N 3.27Å; H352-H357 PolarHBondContact O-CE1 3.16Å
353	P	76.9	Confident	79.7	Confident	56 Å²	56	56 Å²	56	36%	0.364	32%	0.317	S	S	.	.	S	Bend	trans	-49.4	138.3	173.8	-29.3	35.9	0	0	0	111.5	N570	P353-N570 HydrophobicContact CB-CB 3.96Å
354	G	82.4	Confident	80.4	Confident	7 Å²	7	51.5 Å²	51.5	7%	0.072	29%	0.294	C	S	.	.	S	Bend	trans	174.9	-176.1	-169.9	0	0	0	0	0	112.7	H352 S356 H357	H352-G354 PolarHBondContact O-N 3.27Å; G354-S356 PolarHBondContact O-N 3.35Å; G354-H357 PolarHBondContact N-ND1 2.96Å; G354-H357 PolarHBondContact O-N 2.75Å; G354-H357 PolarHBondContact O-ND1 3.42Å
355	P	88	Confident	81.2	Confident	37 Å²	37	50.3 Å²	50.3	24%	0.24	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-55.4	-26.8	-167.3	-27.4	34	0	0	0	115.8	G388 R389 F569	P355-G388 CarbonylContact O-C 3.57Å; P355-G388 VanDerWaalsContact O-C 3.31Å; P355-G388 VanDerWaalsContact O-CA 3.27Å; P355-G388 WeakPolarHBondContact O-CA 3.35Å; P355-R389 HydrophobicContact CB-CG 4.22Å; P355-R389 PolarHBondContact O-N 3.28Å; P355-F569 HydrophobicContact CB-CG 4.4Å; P355-F569 HydrophobicContact CG-CB 4.03Å; P355-F569 HydrophobicContact CG-CD2 3.73Å; P355-F569 HydrophobicContact CG-CE2 4.32Å; P355-F569 HydrophobicContact CG-CG 3.87Å
356	S	86.5	Confident	81.9	Confident	35 Å²	35	51.6 Å²	51.6	25%	0.245	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-74.4	-19.4	179.6	47.7	0	0	0	0	114.9	D340 G354	D340-S356 VanDerWaalsContact OD1-CB 3.31Å; D340-S356 WeakPolarHBondContact OD1-CB 3.44Å; D340-S356 PolarHBondContact OD1-OG 3.44Å; D340-S356 VanDerWaalsContact OD2-CB 3.24Å; D340-S356 WeakPolarHBondContact OD2-CB 3.47Å; G354-S356 PolarHBondContact O-N 3.35Å
357	H	85.7	Confident	82.7	Confident	93 Å²	93	51.4 Å²	51.4	43%	0.431	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-84.4	-16.7	179.3	-60.4	85.6	0	0	0	112.9	R351 H352 G354 S359	R351-H357 VanDerWaalsContact CB-CE1 3.47Å; R351-H357 WeakPolarHBondContact CB-CE1 3.43Å; H352-H357 PolarHBondContact O-CE1 3.16Å; G354-H357 PolarHBondContact N-ND1 2.96Å; G354-H357 PolarHBondContact O-N 2.75Å; G354-H357 PolarHBondContact O-ND1 3.42Å; H357-S359 PolarHBondContact O-N 2.98Å
358	I	91	Very high	83.9	Confident	2 Å²	2	50.9 Å²	50.9	1%	0.01	29%	0.287	C	S	.	.			trans	-85.1	102	-177.8	-55.8	179.4	0	0	0	109.3	W362 I363 G388 F569 I571	I358-W362 HydrophobicContact CG2-CD2 4.36Å; I358-W362 HydrophobicContact CG2-CE3 3.49Å; I358-W362 VanDerWaalsContact CG2-CE3 3.49Å; I358-W362 HydrophobicContact CG2-CZ3 3.86Å; I358-I363 HydrophobicContact CG2-CD1 3.78Å; I358-I363 HydrophobicContact CG2-CG1 3.75Å; I358-G388 PolarHBondContact O-N 2.88Å; I358-F569 HydrophobicContact CD1-CB 3.94Å; I358-F569 HydrophobicContact CD1-CD1 3.81Å; I358-F569 HydrophobicContact CD1-CG 4.39Å; I358-I571 HydrophobicContact CD1-CG2 3.59Å; I358-I571 HydrophobicContact CG1-CG2 3.73Å
359	S	91.4	Very high	85.4	Confident	55 Å²	55	52.5 Å²	52.5	39%	0.385	28%	0.278	S	S	.	.			trans	-69.4	153.7	175.4	74.3	0	0	0	0	112.1	H357 Q361 W362 I363	H357-S359 PolarHBondContact O-N 2.98Å; S359-Q361 PolarHBondContact O-N 3.22Å; S359-W362 PolarHBondContact O-N 3.44Å; S359-W362 PolarHBondContact OG-N 3.33Å; S359-W362 VanDerWaalsContact OG-N 3.15Å; S359-I363 PolarHBondContact O-N 2.85Å; S359-I363 VanDerWaalsContact O-N 3.17Å
360	Y	92	Very high	87	Confident	46 Å²	46	50.8 Å²	50.8	18%	0.18	27%	0.268	C	S	.	.	H	α-helix	trans	-62.6	-27	172.6	73.9	-89	0	0	0	112.4	C292 I363 C364 R385 V386	C292-Y360 HydrophobicContact CB-CD1 3.7Å; C292-Y360 HydrophobicContact CB-CE1 3.76Å; Y360-I363 PolarHBondContact O-N 2.92Å; Y360-C364 WeakPolarHBondContact O-CB 3.46Å; Y360-C364 PolarHBondContact O-N 3.25Å; Y360-C364 PolarHBondContact O-SG 2.95Å; Y360-R385 VanDerWaalsContact CB-C 3.4Å; Y360-R385 WeakPolarHBondContact CB-O 3.47Å; Y360-R385 HydrophobicContact CD1-CB 4.27Å; Y360-R385 HydrophobicContact CD2-CB 4.41Å; Y360-R385 HydrophobicContact CG-CB 4.06Å; Y360-R385 VanDerWaalsContact CZ-NH1 3.25Å; Y360-R385 PolarHBondContact OH-NH1 3.08Å; Y360-V386 WeakPolarHBondContact CA-O 3.36Å; Y360-V386 WeakPolarHBondContact CB-O 3.48Å
361	Q	93.2	Very high	88.9	Confident	78 Å²	78	45.6 Å²	45.6	36%	0.364	23%	0.23	S	C	.	.	H	α-helix	trans	-69.6	-42.9	178.3	-160.1	68.2	25.4	0	0	110.8	S359 I363 C364 D365	S359-Q361 PolarHBondContact O-N 3.22Å; Q361-I363 VanDerWaalsContact C-N 3.32Å; Q361-I363 PolarHBondContact O-N 2.89Å; Q361-C364 PolarHBondContact O-N 2.91Å; Q361-D365 VanDerWaalsContact NE2-CG 3.28Å; Q361-D365 PolarHBondContact NE2-OD1 3.38Å; Q361-D365 PolarHBondContact NE2-OD2 3.16Å; Q361-D365 WeakPolarHBondContact O-CB 3.41Å; Q361-D365 PolarHBondContact O-N 3.49Å
362	W	94.6	Very high	90.4	Very high	35 Å²	35	44.1 Å²	44.1	13%	0.133	22%	0.224	C	C	.	.	H	α-helix	trans	-62.2	-40	172.6	-177.5	94.9	0	0	0	111.6	I358 S359 C364 I366 W367 L564 I571	I358-W362 HydrophobicContact CG2-CD2 4.36Å; I358-W362 HydrophobicContact CG2-CE3 3.49Å; I358-W362 VanDerWaalsContact CG2-CE3 3.49Å; I358-W362 HydrophobicContact CG2-CZ3 3.86Å; S359-W362 PolarHBondContact O-N 3.44Å; S359-W362 PolarHBondContact OG-N 3.33Å; S359-W362 VanDerWaalsContact OG-N 3.15Å; W362-C364 PolarHBondContact O-N 3.46Å; W362-I366 HydrophobicContact CG-CD1 4.48Å; W362-I366 WeakPolarHBondContact O-CB 3.45Å; W362-I366 PolarHBondContact O-N 3.27Å; W362-I366 VanDerWaalsContact O-N 3.15Å; W362-W367 HydrophobicContact CE3-CB 3.83Å; W362-W367 HydrophobicContact CE3-CG 4.42Å; W362-W367 HydrophobicContact CH2-CB 3.93Å; W362-W367 AromaticContact CH2-CD1 3.7Å; W362-W367 AromaticContact CH2-CG 3.95Å; W362-W367 HydrophobicContact CH2-CG 3.95Å; W362-W367 HydrophobicContact CZ3-CB 3.54Å; W362-W367 AromaticContact CZ3-CD1 3.84Å; W362-W367 HydrophobicContact CZ3-CD2 4.35Å; W362-W367 AromaticContact CZ3-CG 3.66Å; W362-W367 HydrophobicContact CZ3-CG 3.66Å; W362-W367 PolarHBondContact O-N 2.98Å; W362-L564 HydrophobicContact CH2-CD2 4.43Å; W362-I571 HydrophobicContact CD2-CD1 4.37Å; W362-I571 HydrophobicContact CH2-CB 4.31Å; W362-I571 HydrophobicContact CH2-CG2 3.55Å; W362-I571 HydrophobicContact CZ2-CB 3.95Å; W362-I571 HydrophobicContact CZ2-CD1 4.43Å; W362-I571 HydrophobicContact CZ2-CG2 3.69Å; W362-I571 HydrophobicContact CZ3-CG2 4.05Å
363	I	95.6	Very high	91.7	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.186	C	C	.	.	I	π-helix	trans	-59.2	-46.6	175.2	-78.5	166.5	0	0	0	111.5	I358 S359 Y360 Q361 W367 L368 F381 V386 D387 L391	I358-I363 HydrophobicContact CG2-CD1 3.78Å; I358-I363 HydrophobicContact CG2-CG1 3.75Å; S359-I363 PolarHBondContact O-N 2.85Å; S359-I363 VanDerWaalsContact O-N 3.17Å; Y360-I363 PolarHBondContact O-N 2.92Å; Q361-I363 VanDerWaalsContact C-N 3.32Å; Q361-I363 PolarHBondContact O-N 2.89Å; I363-W367 HydrophobicContact CG1-CE3 4.28Å; I363-W367 HydrophobicContact CG2-CE3 4.12Å; I363-W367 HydrophobicContact CG2-CZ3 4.48Å; I363-L368 HydrophobicContact CG2-CD1 4.22Å; I363-L368 HydrophobicContact CG2-CG 4.37Å; I363-L368 WeakPolarHBondContact O-CB 3.29Å; I363-L368 VanDerWaalsContact O-CG 3.3Å; I363-L368 WeakPolarHBondContact O-CG 3.5Å; I363-L368 PolarHBondContact O-N 3.37Å; I363-F381 HydrophobicContact CG2-CD1 3.87Å; I363-V386 VanDerWaalsContact CD1-O 3.28Å; I363-V386 WeakPolarHBondContact CD1-O 3.49Å; I363-D387 VanDerWaalsContact CD1-C 3.4Å; I363-L391 HydrophobicContact CD1-CD1 3.64Å; I363-L391 HydrophobicContact CD1-CG 4.23Å; I363-L391 HydrophobicContact CG1-CD1 4.14Å
364	C	94.9	Very high	92.5	Very high	2 Å²	2	33.1 Å²	33.1	1%	0.014	17%	0.168	C	C	.	.	I	π-helix	trans	-75.3	-53.2	-178.3	-75	0	0	0	0	113.6	Y360 Q361 W362 I378	Y360-C364 WeakPolarHBondContact O-CB 3.46Å; Y360-C364 PolarHBondContact O-N 3.25Å; Y360-C364 PolarHBondContact O-SG 2.95Å; Q361-C364 PolarHBondContact O-N 2.91Å; W362-C364 PolarHBondContact O-N 3.46Å; C364-I378 HydrophobicContact CB-CG2 4.07Å; C364-I378 WeakPolarHBondContact O-CD1 3.5Å
365	D	94.1	Very high	93.1	Very high	75 Å²	75	35.2 Å²	35.2	40%	0.401	18%	0.18	S	C	.	.	I	π-helix	trans	-80.6	-27.9	-167.8	-69.1	-3.5	0	0	0	113	Q361 K369 H370	Q361-D365 VanDerWaalsContact NE2-CG 3.28Å; Q361-D365 PolarHBondContact NE2-OD1 3.38Å; Q361-D365 PolarHBondContact NE2-OD2 3.16Å; Q361-D365 WeakPolarHBondContact O-CB 3.41Å; Q361-D365 PolarHBondContact O-N 3.49Å; D365-K369 WeakPolarHBondContact O-CB 3.2Å; D365-K369 WeakPolarHBondContact O-CD 3.49Å; D365-H370 PolarHBondContact O-CD2 3.16Å
366	I	95	Very high	93.3	Very high	51 Å²	51	35.6 Å²	35.6	26%	0.262	18%	0.179	S	C	.	.	I	π-helix	trans	-117.3	-61	-172.2	-59.5	173.6	0	0	0	110.2	W362 H370 H371	W362-I366 HydrophobicContact CG-CD1 4.48Å; W362-I366 WeakPolarHBondContact O-CB 3.45Å; W362-I366 PolarHBondContact O-N 3.27Å; W362-I366 VanDerWaalsContact O-N 3.15Å; I366-H370 WeakPolarHBondContact O-CA 3.04Å; I366-H370 WeakPolarHBondContact O-CB 3.16Å; I366-H370 PolarHBondContact O-N 2.93Å; I366-H371 WeakPolarHBondContact CG2-CE1 3.46Å; I366-H371 PolarHBondContact O-N 2.97Å
367	W	96.2	Very high	93.5	Very high	7 Å²	7	34 Å²	34	3%	0.027	17%	0.167	C	C	.	.	I	π-helix	trans	-68.1	-55.7	-170.5	-173.9	68.5	0	0	0	113.4	W362 I363 K369 H371 L372 L391 L557 A560 I561 L564	W362-W367 HydrophobicContact CE3-CB 3.83Å; W362-W367 HydrophobicContact CE3-CG 4.42Å; W362-W367 HydrophobicContact CH2-CB 3.93Å; W362-W367 AromaticContact CH2-CD1 3.7Å; W362-W367 AromaticContact CH2-CG 3.95Å; W362-W367 HydrophobicContact CH2-CG 3.95Å; W362-W367 HydrophobicContact CZ3-CB 3.54Å; W362-W367 AromaticContact CZ3-CD1 3.84Å; W362-W367 HydrophobicContact CZ3-CD2 4.35Å; W362-W367 AromaticContact CZ3-CG 3.66Å; W362-W367 HydrophobicContact CZ3-CG 3.66Å; W362-W367 PolarHBondContact O-N 2.98Å; I363-W367 HydrophobicContact CG1-CE3 4.28Å; I363-W367 HydrophobicContact CG2-CE3 4.12Å; I363-W367 HydrophobicContact CG2-CZ3 4.48Å; W367-K369 VanDerWaalsContact C-N 3.32Å; W367-K369 PolarHBondContact O-N 3.37Å; W367-H371 AromaticContact CD1-ND1 3.84Å; W367-H371 CarbonylContact O-C 3.24Å; W367-H371 WeakPolarHBondContact O-CA 3.39Å; W367-H371 VanDerWaalsContact O-CB 3.31Å; W367-H371 WeakPolarHBondContact O-CB 3.38Å; W367-H371 PolarHBondContact O-N 2.95Å; W367-H371 VanDerWaalsContact O-N 3.16Å; W367-L372 HydrophobicContact CD2-CD1 3.96Å; W367-L372 HydrophobicContact CD2-CG 4.33Å; W367-L372 HydrophobicContact CE3-CD1 4.16Å; W367-L372 HydrophobicContact CH2-CD1 4.06Å; W367-L372 HydrophobicContact CZ2-CD1 3.84Å; W367-L372 HydrophobicContact CZ3-CD1 4.21Å; W367-L372 WeakPolarHBondContact O-CG 3.42Å; W367-L372 PolarHBondContact O-N 3.5Å; W367-L391 HydrophobicContact CE3-CD1 4.32Å; W367-L391 HydrophobicContact CH2-CD1 3.65Å; W367-L391 HydrophobicContact CH2-CD2 4.13Å; W367-L391 HydrophobicContact CZ2-CD1 4.35Å; W367-L391 HydrophobicContact CZ3-CD1 3.64Å; W367-L391 HydrophobicContact CZ3-CD2 4.15Å; W367-L557 HydrophobicContact CH2-CD2 4.01Å; W367-L557 HydrophobicContact CZ3-CD2 4.06Å; W367-A560 HydrophobicContact CH2-CB 4.35Å; W367-A560 HydrophobicContact CZ2-CB 3.62Å; W367-I561 HydrophobicContact CH2-CG1 4.07Å; W367-I561 HydrophobicContact CZ2-CG1 4.48Å; W367-L564 HydrophobicContact CH2-CD1 4.26Å; W367-L564 HydrophobicContact CZ2-CD1 3.54Å; W367-L564 HydrophobicContact CZ2-CG 4.34Å
368	L	96.2	Very high	93.9	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.155	C	C	.	.	I	π-helix	trans	-63.5	-38.9	177.4	-73.5	175.4	0	0	0	112.2	I363 L372 G373 L374 L377 I378 F381 L557	I363-L368 HydrophobicContact CG2-CD1 4.22Å; I363-L368 HydrophobicContact CG2-CG 4.37Å; I363-L368 WeakPolarHBondContact O-CB 3.29Å; I363-L368 VanDerWaalsContact O-CG 3.3Å; I363-L368 WeakPolarHBondContact O-CG 3.5Å; I363-L368 PolarHBondContact O-N 3.37Å; L368-L372 HydrophobicContact CD2-CD1 4.42Å; L368-G373 PolarHBondContact O-N 3.18Å; L368-L374 HydrophobicContact CD2-CB 4.14Å; L368-L374 HydrophobicContact CD2-CD1 4.48Å; L368-L374 PolarHBondContact O-N 3.44Å; L368-L377 HydrophobicContact CD1-CB 4.4Å; L368-L377 HydrophobicContact CD2-CB 4.49Å; L368-I378 HydrophobicContact CB-CG1 3.91Å; L368-I378 HydrophobicContact CD1-CG1 4.18Å; L368-F381 HydrophobicContact CD1-CB 3.81Å; L368-F381 HydrophobicContact CD1-CD1 3.74Å; L368-F381 HydrophobicContact CD1-CD2 4.21Å; L368-F381 HydrophobicContact CD1-CE1 4.31Å; L368-F381 HydrophobicContact CD1-CG 3.67Å; L368-F381 HydrophobicContact CD2-CE1 4.45Å; L368-L557 HydrophobicContact CD2-CD2 3.99Å
369	K	94.1	Very high	93.9	Very high	91 Å²	91	35 Å²	35	40%	0.396	18%	0.179	S	C	.	.	I	π-helix	trans	-76.5	-59	-173.7	-172.8	-179.7	170.6	-137.2	0	113.1	D365 W367 V375 I378	D365-K369 WeakPolarHBondContact O-CB 3.2Å; D365-K369 WeakPolarHBondContact O-CD 3.49Å; W367-K369 VanDerWaalsContact C-N 3.32Å; W367-K369 PolarHBondContact O-N 3.37Å; K369-V375 HydrophobicContact CB-CG1 4.48Å; K369-V375 HydrophobicContact CG-CG1 4.06Å; K369-I378 HydrophobicContact CB-CD1 3.87Å; K369-I378 HydrophobicContact CG-CD1 4.34Å
370	H	93.2	Very high	93.7	Very high	63 Å²	63	32.6 Å²	32.6	29%	0.292	16%	0.162	S	C	.	.	I	π-helix	trans	-97.6	-37.1	-170.9	-71.3	-79.1	0	0	0	112.6	D365 I366 N593 D594	D365-H370 PolarHBondContact O-CD2 3.16Å; I366-H370 WeakPolarHBondContact O-CA 3.04Å; I366-H370 WeakPolarHBondContact O-CB 3.16Å; I366-H370 PolarHBondContact O-N 2.93Å; H370-N593 WeakPolarHBondContact O-CB 3.48Å; H370-N593 PolarHBondContact O-N 2.94Å; H370-D594 WeakPolarHBondContact CB-OD2 3.11Å; H370-D594 IonicContact CE1-OD2 2.95Å; H370-D594 IonicContact CG-OD2 3.96Å; H370-D594 IonicContact ND1-OD1 3.16Å; H370-D594 IonicContact ND1-OD2 2.73Å; H370-D594 PolarHBondContact ND1-OD2 3.28Å
371	H	94.8	Very high	93.7	Very high	14 Å²	14	30.4 Å²	30.4	7%	0.065	15%	0.154	C	C	.	.	I	π-helix	trans	-80.7	-41.1	-176.8	-56.2	165.7	0	0	0	112.8	I366 W367 E575 R578 T592 N593 H618	I366-H371 WeakPolarHBondContact CG2-CE1 3.46Å; I366-H371 PolarHBondContact O-N 2.97Å; W367-H371 AromaticContact CD1-ND1 3.84Å; W367-H371 CarbonylContact O-C 3.24Å; W367-H371 WeakPolarHBondContact O-CA 3.39Å; W367-H371 VanDerWaalsContact O-CB 3.31Å; W367-H371 WeakPolarHBondContact O-CB 3.38Å; W367-H371 PolarHBondContact O-N 2.95Å; W367-H371 VanDerWaalsContact O-N 3.16Å; H371-E575 IonicContact CE1-OE1 3.92Å; H371-E575 PolarHBondContact CE1-OE1 3Å; H371-E575 IonicContact CE1-OE2 3.6Å; H371-E575 IonicContact ND1-OE1 3.34Å; H371-E575 IonicContact NE2-OE1 2.69Å; H371-E575 IonicContact NE2-OE2 3.59Å; H371-R578 PolarHBondContact CE1-NH1 3.32Å; H371-R578 PolarHBondContact ND1-NH1 2.75Å; H371-R578 VanDerWaalsContact ND1-NH1 3.11Å; H371-R578 PolarHBondContact NE2-NH1 3.4Å; H371-T592 HydrophobicContact CB-CG2 4.31Å; H371-T592 CarbonylContact O-C 3.26Å; H371-T592 WeakPolarHBondContact O-CA 3.28Å; H371-N593 PolarHBondContact O-N 2.83Å; H371-H618 VanDerWaalsContact O-CB 3.28Å; H371-H618 WeakPolarHBondContact O-CB 3.46Å
372	L	96.4	Very high	93.5	Very high	4 Å²	4	28.5 Å²	28.5	2%	0.021	15%	0.149	C	C	.	.	S	Bend	trans	-106.2	-23.4	-172.4	-54.4	-168.5	0	0	0	115.6	W367 L368 L374 L557 A560 G616 L617 H618	W367-L372 HydrophobicContact CD2-CD1 3.96Å; W367-L372 HydrophobicContact CD2-CG 4.33Å; W367-L372 HydrophobicContact CE3-CD1 4.16Å; W367-L372 HydrophobicContact CH2-CD1 4.06Å; W367-L372 HydrophobicContact CZ2-CD1 3.84Å; W367-L372 HydrophobicContact CZ3-CD1 4.21Å; W367-L372 WeakPolarHBondContact O-CG 3.42Å; W367-L372 PolarHBondContact O-N 3.5Å; L368-L372 HydrophobicContact CD2-CD1 4.42Å; L372-L374 HydrophobicContact CB-CB 4.5Å; L372-L374 HydrophobicContact CB-CD1 4.11Å; L372-L374 HydrophobicContact CB-CG 4.17Å; L372-L374 HydrophobicContact CD1-CD1 4.14Å; L372-L557 HydrophobicContact CD1-CD2 3.84Å; L372-A560 HydrophobicContact CD1-CB 3.53Å; L372-A560 HydrophobicContact CD2-CB 3.48Å; L372-A560 VanDerWaalsContact CD2-CB 3.48Å; L372-A560 HydrophobicContact CG-CB 4.16Å; L372-G616 CarbonylContact O-C 3.51Å; L372-G616 VanDerWaalsContact O-CA 3.24Å; L372-G616 WeakPolarHBondContact O-CA 3.43Å; L372-L617 PolarHBondContact O-N 3Å; L372-H618 HydrophobicContact CD2-CB 4.41Å
373	G	93.7	Very high	93.1	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.16	C	C	.	.			trans	66	47.9	-172	0	0	0	0	0	112.6	L368 N593 N613 A614 S615 G616	L368-G373 PolarHBondContact O-N 3.18Å; G373-N593 VanDerWaalsContact CA-CG 3.5Å; G373-N613 VanDerWaalsContact C-C 3.49Å; G373-N613 CarbonylContact C-O 3.31Å; G373-N613 WeakPolarHBondContact CA-O 3.41Å; G373-N613 CarbonylContact O-C 3.45Å; G373-N613 VanDerWaalsContact O-C 3.24Å; G373-A614 CarbonylContact O-C 3.46Å; G373-A614 VanDerWaalsContact O-C 3.26Å; G373-A614 WeakPolarHBondContact O-CA 3.49Å; G373-A614 PolarHBondContact O-N 3.45Å; G373-S615 PolarHBondContact O-N 2.93Å; G373-G616 WeakPolarHBondContact O-CA 3.41Å; G373-G616 PolarHBondContact O-N 3.29Å
374	L	94.2	Very high	92.5	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.162	C	C	.	.			trans	-122.7	45.9	178.9	-69.4	175.8	0	0	0	111.7	L368 L372 Q376 L377 E553 L557 N613	L368-L374 HydrophobicContact CD2-CB 4.14Å; L368-L374 HydrophobicContact CD2-CD1 4.48Å; L368-L374 PolarHBondContact O-N 3.44Å; L372-L374 HydrophobicContact CB-CB 4.5Å; L372-L374 HydrophobicContact CB-CD1 4.11Å; L372-L374 HydrophobicContact CB-CG 4.17Å; L372-L374 HydrophobicContact CD1-CD1 4.14Å; L374-Q376 PolarHBondContact O-N 3.35Å; L374-Q376 VanDerWaalsContact O-N 3.08Å; L374-L377 HydrophobicContact CB-CD1 4.13Å; L374-L377 HydrophobicContact CB-CG 4.34Å; L374-L377 HydrophobicContact CD1-CD1 4.03Å; L374-L377 HydrophobicContact CG-CD1 4.47Å; L374-L377 PolarHBondContact O-N 3.27Å; L374-E553 HydrophobicContact CD2-CB 4.2Å; L374-E553 HydrophobicContact CD2-CG 4.12Å; L374-L557 HydrophobicContact CD1-CD1 4.47Å; L374-L557 HydrophobicContact CD1-CD2 3.87Å; L374-L557 HydrophobicContact CD1-CG 3.69Å; L374-N613 PolarHBondContact N-O 2.98Å
375	V	93.9	Very high	92.2	Very high	52 Å²	52	35 Å²	35	32%	0.315	18%	0.178	S	C	.	.	G	3₁₀ helix	trans	-57.1	-28	-175.7	-62	0	0	0	0	114	K369 L377 I378 N613 A614	K369-V375 HydrophobicContact CB-CG1 4.48Å; K369-V375 HydrophobicContact CG-CG1 4.06Å; V375-L377 PolarHBondContact O-N 3.42Å; V375-I378 HydrophobicContact CB-CD1 4.09Å; V375-I378 HydrophobicContact CG1-CD1 4.17Å; V375-I378 WeakPolarHBondContact O-CB 3.22Å; V375-I378 WeakPolarHBondContact O-CG1 3.48Å; V375-I378 PolarHBondContact O-N 3.14Å; V375-N613 HydrophobicContact CG1-CB 4.18Å; V375-N613 WeakPolarHBondContact CG1-O 3.5Å; V375-N613 WeakPolarHBondContact CG2-O 3.08Å; V375-N613 PolarHBondContact N-O 3.03Å; V375-N613 VanDerWaalsContact N-O 3.11Å; V375-A614 HydrophobicContact CG2-CB 4.29Å
376	Q	91.9	Very high	92.1	Very high	45 Å²	45	31.5 Å²	31.5	21%	0.21	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-64.9	-17.3	177.1	71.3	-85.8	32.6	0	0	114.2	L374 A614	L374-Q376 PolarHBondContact O-N 3.35Å; L374-Q376 VanDerWaalsContact O-N 3.08Å; Q376-A614 PolarHBondContact NE2-O 3.2Å; Q376-A614 VanDerWaalsContact OE1-CA 3.31Å
377	L	92.5	Very high	91.9	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-91.5	-18.3	178.5	-59.1	-174.1	0	0	0	113.1	L368 L374 V375 I380 F381 L548 L549 L557	L368-L377 HydrophobicContact CD1-CB 4.4Å; L368-L377 HydrophobicContact CD2-CB 4.49Å; L374-L377 HydrophobicContact CB-CD1 4.13Å; L374-L377 HydrophobicContact CB-CG 4.34Å; L374-L377 HydrophobicContact CD1-CD1 4.03Å; L374-L377 HydrophobicContact CG-CD1 4.47Å; L374-L377 PolarHBondContact O-N 3.27Å; V375-L377 PolarHBondContact O-N 3.42Å; L377-I380 HydrophobicContact CD2-CD1 4.09Å; L377-I380 PolarHBondContact O-N 3.46Å; L377-I380 VanDerWaalsContact O-N 3.08Å; L377-F381 HydrophobicContact CB-CD2 3.95Å; L377-F381 HydrophobicContact CB-CE2 3.96Å; L377-F381 HydrophobicContact CD1-CE2 4.13Å; L377-F381 WeakPolarHBondContact O-CD2 3.06Å; L377-F381 PolarHBondContact O-N 3.4Å; L377-L548 HydrophobicContact CD2-CB 4.15Å; L377-L548 WeakPolarHBondContact CD2-O 3.49Å; L377-L549 HydrophobicContact CD1-CD1 4.22Å; L377-L549 HydrophobicContact CD2-CB 4.22Å; L377-L557 HydrophobicContact CD1-CD1 3.61Å; L377-L557 HydrophobicContact CD1-CG 4.35Å
378	I	92.8	Very high	91.7	Very high	37 Å²	37	29 Å²	29	19%	0.19	15%	0.147	C	C	.	.	H	α-helix	trans	-53.1	-46.6	-175.9	-64	171.5	0	0	0	112.6	C364 L368 K369 V375 I380 F381 S382	C364-I378 HydrophobicContact CB-CG2 4.07Å; C364-I378 WeakPolarHBondContact O-CD1 3.5Å; L368-I378 HydrophobicContact CB-CG1 3.91Å; L368-I378 HydrophobicContact CD1-CG1 4.18Å; K369-I378 HydrophobicContact CB-CD1 3.87Å; K369-I378 HydrophobicContact CG-CD1 4.34Å; V375-I378 HydrophobicContact CB-CD1 4.09Å; V375-I378 HydrophobicContact CG1-CD1 4.17Å; V375-I378 WeakPolarHBondContact O-CB 3.22Å; V375-I378 WeakPolarHBondContact O-CG1 3.48Å; V375-I378 PolarHBondContact O-N 3.14Å; I378-I380 VanDerWaalsContact C-N 3.29Å; I378-I380 PolarHBondContact O-N 3.1Å; I378-F381 PolarHBondContact O-N 3.1Å; I378-S382 WeakPolarHBondContact O-CB 3.15Å; I378-S382 PolarHBondContact O-N 2.94Å
379	P	90.6	Very high	91.5	Very high	79 Å²	79	30 Å²	30	51%	0.513	15%	0.15	S	C	.	.	H	α-helix	trans	-60	-40.5	179.9	-23.7	34.9	0	0	0	112.4	I383	P379-I383 WeakPolarHBondContact O-CB 3.13Å; P379-I383 WeakPolarHBondContact O-CD1 3.11Å; P379-I383 WeakPolarHBondContact O-CG1 3.33Å; P379-I383 PolarHBondContact O-N 2.94Å
380	I	88	Confident	91.3	Very high	5 Å²	5	25.7 Å²	25.7	3%	0.026	13%	0.132	C	C	.	.	H	α-helix	trans	-71.4	-45	-176.9	-32.8	174.4	0	0	0	110.9	L377 I378 S382 R384 L525 L541 L548	L377-I380 HydrophobicContact CD2-CD1 4.09Å; L377-I380 PolarHBondContact O-N 3.46Å; L377-I380 VanDerWaalsContact O-N 3.08Å; I378-I380 VanDerWaalsContact C-N 3.29Å; I378-I380 PolarHBondContact O-N 3.1Å; I380-S382 VanDerWaalsContact C-N 3.32Å; I380-R384 WeakPolarHBondContact O-CG 3.17Å; I380-R384 PolarHBondContact O-N 2.87Å; I380-R384 VanDerWaalsContact O-N 3.16Å; I380-L525 HydrophobicContact CB-CD2 4.3Å; I380-L525 HydrophobicContact CG2-CD1 4.06Å; I380-L525 HydrophobicContact CG2-CD2 3.5Å; I380-L525 HydrophobicContact CG2-CG 4.29Å; I380-L541 HydrophobicContact CG2-CD1 3.53Å; I380-L541 HydrophobicContact CG2-CD2 3.7Å; I380-L541 HydrophobicContact CG2-CG 4.26Å; I380-L548 HydrophobicContact CD1-CB 3.63Å; I380-L548 HydrophobicContact CD1-CD1 3.57Å; I380-L548 HydrophobicContact CD1-CG 4.22Å; I380-L548 HydrophobicContact CG1-CD1 4.04Å
381	F	91.7	Very high	91.4	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-67.6	-34.8	178.3	-84	-122.5	0	0	0	111.5	I363 L368 L377 I378 R384 R385 V386 L524 L525 L557	I363-F381 HydrophobicContact CG2-CD1 3.87Å; L368-F381 HydrophobicContact CD1-CB 3.81Å; L368-F381 HydrophobicContact CD1-CD1 3.74Å; L368-F381 HydrophobicContact CD1-CD2 4.21Å; L368-F381 HydrophobicContact CD1-CE1 4.31Å; L368-F381 HydrophobicContact CD1-CG 3.67Å; L368-F381 HydrophobicContact CD2-CE1 4.45Å; L377-F381 HydrophobicContact CB-CD2 3.95Å; L377-F381 HydrophobicContact CB-CE2 3.96Å; L377-F381 HydrophobicContact CD1-CE2 4.13Å; L377-F381 WeakPolarHBondContact O-CD2 3.06Å; L377-F381 PolarHBondContact O-N 3.4Å; I378-F381 PolarHBondContact O-N 3.1Å; F381-R384 CarbonylContact O-C 3.42Å; F381-R385 WeakPolarHBondContact O-CA 3.28Å; F381-R385 PolarHBondContact O-N 3.23Å; F381-V386 HydrophobicContact CB-CB 4.41Å; F381-V386 HydrophobicContact CB-CG2 4.3Å; F381-V386 HydrophobicContact CD1-CB 3.72Å; F381-V386 HydrophobicContact CD1-CG1 3.83Å; F381-V386 HydrophobicContact CD1-CG2 3.91Å; F381-V386 HydrophobicContact CE1-CB 4.4Å; F381-V386 HydrophobicContact CE1-CG1 4.04Å; F381-V386 HydrophobicContact CG-CB 4.29Å; F381-V386 HydrophobicContact CG-CG2 4.1Å; F381-V386 PolarHBondContact O-N 3.22Å; F381-L524 HydrophobicContact CE1-CD1 4.06Å; F381-L524 HydrophobicContact CE2-CD1 4.48Å; F381-L524 HydrophobicContact CZ-CD1 3.65Å; F381-L525 HydrophobicContact CE2-CD2 4.47Å; F381-L557 HydrophobicContact CZ-CD1 3.93Å; F381-L557 HydrophobicContact CZ-CD2 4.45Å
382	S	90	Very high	91.2	Very high	39 Å²	39	24 Å²	24	27%	0.273	13%	0.129	S	C	.	.	H	α-helix	trans	-68.4	-47	176	-172.6	0	0	0	0	112.1	I378 I380 R384 R385	I378-S382 WeakPolarHBondContact O-CB 3.15Å; I378-S382 PolarHBondContact O-N 2.94Å; I380-S382 VanDerWaalsContact C-N 3.32Å; S382-R384 VanDerWaalsContact C-N 3.28Å; S382-R384 PolarHBondContact O-N 2.68Å; S382-R385 VanDerWaalsContact O-CD 3.28Å; S382-R385 WeakPolarHBondContact O-CD 3.42Å; S382-R385 WeakPolarHBondContact O-CG 3.46Å; S382-R385 PolarHBondContact O-N 2.79Å
383	I	85.8	Confident	90.8	Very high	70 Å²	70	24.9 Å²	24.9	36%	0.359	14%	0.135	S	C	.	.	H	α-helix	trans	-56.2	-43.9	174.7	-72.2	164.1	0	0	0	110.9	P379 R385 D540 L541	P379-I383 WeakPolarHBondContact O-CB 3.13Å; P379-I383 WeakPolarHBondContact O-CD1 3.11Å; P379-I383 WeakPolarHBondContact O-CG1 3.33Å; P379-I383 PolarHBondContact O-N 2.94Å; I383-R385 VanDerWaalsContact C-N 3.3Å; I383-R385 PolarHBondContact O-N 2.96Å; I383-D540 HydrophobicContact CG2-CB 3.84Å; I383-L541 HydrophobicContact CB-CD2 4.24Å; I383-L541 HydrophobicContact CD1-CD2 3.81Å; I383-L541 HydrophobicContact CG2-CD2 3.96Å; I383-L541 HydrophobicContact CG2-CG 4.3Å
384	R	83.5	Confident	90.6	Very high	12 Å²	12	25 Å²	25	5%	0.045	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-3.9	178.8	-56.1	-62.8	-101.2	177.7	-17.7	114.1	D327 I380 F381 S382 V386 L525 L541	D327-R384 IonicContact OD2-CZ 2.81Å; D327-R384 IonicContact OD2-NH1 2.68Å; D327-R384 PolarHBondContact OD2-NH1 3.15Å; D327-R384 IonicContact OD2-NH2 3.95Å; D327-R384 PolarHBondContact OD2-NH2 3.04Å; I380-R384 WeakPolarHBondContact O-CG 3.17Å; I380-R384 PolarHBondContact O-N 2.87Å; I380-R384 VanDerWaalsContact O-N 3.16Å; F381-R384 CarbonylContact O-C 3.42Å; S382-R384 VanDerWaalsContact C-N 3.28Å; S382-R384 PolarHBondContact O-N 2.68Å; R384-V386 HydrophobicContact CB-CG2 3.99Å; R384-V386 PolarHBondContact O-N 3.37Å; R384-L525 PolarHBondContact NE-O 2.85Å; R384-L525 PolarHBondContact NH2-O 3.2Å; R384-L541 HydrophobicContact CG-CD1 3.71Å
385	R	88.3	Confident	90.3	Very high	92 Å²	92	25.7 Å²	25.7	35%	0.347	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.5	41.9	-177.7	-56.7	-73.8	-178.3	172.3	0.2	112.2	C292 K333 Y360 F381 S382 I383 D387	C292-R385 HydrophobicContact CB-CB 4.25Å; C292-R385 VanDerWaalsContact O-CB 3.28Å; C292-R385 WeakPolarHBondContact O-CB 3.39Å; K333-R385 WeakPolarHBondContact CE-O 3.38Å; K333-R385 VanDerWaalsContact NZ-CB 3.34Å; K333-R385 PolarHBondContact NZ-O 3.47Å; Y360-R385 VanDerWaalsContact CB-C 3.4Å; Y360-R385 WeakPolarHBondContact CB-O 3.47Å; Y360-R385 HydrophobicContact CD1-CB 4.27Å; Y360-R385 HydrophobicContact CD2-CB 4.41Å; Y360-R385 HydrophobicContact CG-CB 4.06Å; Y360-R385 VanDerWaalsContact CZ-NH1 3.25Å; Y360-R385 PolarHBondContact OH-NH1 3.08Å; F381-R385 WeakPolarHBondContact O-CA 3.28Å; F381-R385 PolarHBondContact O-N 3.23Å; S382-R385 VanDerWaalsContact O-CD 3.28Å; S382-R385 WeakPolarHBondContact O-CD 3.42Å; S382-R385 WeakPolarHBondContact O-CG 3.46Å; S382-R385 PolarHBondContact O-N 2.79Å; I383-R385 VanDerWaalsContact C-N 3.3Å; I383-R385 PolarHBondContact O-N 2.96Å; R385-D387 PolarHBondContact O-N 2.69Å
386	V	91.3	Very high	89.7	Confident	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.148	C	C	.	.			trans	-57.3	123.6	-173	176.5	0	0	0	0	111.1	Y360 I363 F381 R384 M390 L391 L524	Y360-V386 WeakPolarHBondContact CA-O 3.36Å; Y360-V386 WeakPolarHBondContact CB-O 3.48Å; I363-V386 VanDerWaalsContact CD1-O 3.28Å; I363-V386 WeakPolarHBondContact CD1-O 3.49Å; F381-V386 HydrophobicContact CB-CB 4.41Å; F381-V386 HydrophobicContact CB-CG2 4.3Å; F381-V386 HydrophobicContact CD1-CB 3.72Å; F381-V386 HydrophobicContact CD1-CG1 3.83Å; F381-V386 HydrophobicContact CD1-CG2 3.91Å; F381-V386 HydrophobicContact CE1-CB 4.4Å; F381-V386 HydrophobicContact CE1-CG1 4.04Å; F381-V386 HydrophobicContact CG-CB 4.29Å; F381-V386 HydrophobicContact CG-CG2 4.1Å; F381-V386 PolarHBondContact O-N 3.22Å; R384-V386 HydrophobicContact CB-CG2 3.99Å; R384-V386 PolarHBondContact O-N 3.37Å; V386-M390 HydrophobicContact CB-SD 4.39Å; V386-M390 HydrophobicContact CG1-CB 4.14Å; V386-M390 HydrophobicContact CG1-SD 4.35Å; V386-M390 HydrophobicContact CG2-CE 4.42Å; V386-M390 HydrophobicContact CG2-SD 4.36Å; V386-L391 HydrophobicContact CG1-CD2 4.25Å; V386-L524 HydrophobicContact CG1-CD2 3.85Å
387	D	91.4	Very high	88.6	Confident	6 Å²	6	29.5 Å²	29.5	3%	0.032	16%	0.156	C	C	.	.			trans	-109.7	175.5	-178	70.8	5.9	0	0	0	112.7	I363 R385 R389 M390 L391	I363-D387 VanDerWaalsContact CD1-C 3.4Å; R385-D387 PolarHBondContact O-N 2.69Å; D387-R389 VanDerWaalsContact C-N 3.26Å; D387-R389 PolarHBondContact O-N 2.79Å; D387-R389 WeakPolarHBondContact OD1-CB 3.24Å; D387-R389 PolarHBondContact OD1-N 3.24Å; D387-R389 IonicContact OD2-CZ 3.44Å; D387-R389 IonicContact OD2-NE 3.15Å; D387-R389 PolarHBondContact OD2-NE 3.4Å; D387-R389 IonicContact OD2-NH2 3.69Å; D387-R389 PolarHBondContact OD2-NH2 3.05Å; D387-M390 PolarHBondContact O-N 2.85Å; D387-M390 WeakPolarHBondContact OD1-CG 3.37Å; D387-M390 PolarHBondContact OD1-N 3.43Å; D387-L391 PolarHBondContact O-N 3.47Å
388	G	92.2	Very high	87.1	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-63.3	-28	178	0	0	0	0	0	114.5	P355 I358 L391 S392	P355-G388 CarbonylContact O-C 3.57Å; P355-G388 VanDerWaalsContact O-C 3.31Å; P355-G388 VanDerWaalsContact O-CA 3.27Å; P355-G388 WeakPolarHBondContact O-CA 3.35Å; I358-G388 PolarHBondContact O-N 2.88Å; G388-L391 PolarHBondContact O-N 3Å; G388-S392 WeakPolarHBondContact O-CB 3.37Å; G388-S392 PolarHBondContact O-N 3.26Å
389	R	91	Very high	84.5	Confident	20 Å²	20	40.4 Å²	40.4	8%	0.075	20%	0.198	C	C	.	.	H	α-helix	trans	-67.5	-41	176.1	-65	176.5	-65.7	-140.7	-6.4	111.2	Y290 D340 P355 D387 S392 S393	Y290-R389 PolarHBondContact O-NH2 2.94Å; D340-R389 WeakPolarHBondContact OD2-CD 3.19Å; D340-R389 IonicContact OD2-CZ 2.7Å; D340-R389 IonicContact OD2-NH1 3.44Å; D340-R389 PolarHBondContact OD2-NH1 3.44Å; P355-R389 HydrophobicContact CB-CG 4.22Å; P355-R389 PolarHBondContact O-N 3.28Å; D387-R389 VanDerWaalsContact C-N 3.26Å; D387-R389 PolarHBondContact O-N 2.79Å; D387-R389 WeakPolarHBondContact OD1-CB 3.24Å; D387-R389 PolarHBondContact OD1-N 3.24Å; D387-R389 IonicContact OD2-CZ 3.44Å; D387-R389 IonicContact OD2-NE 3.15Å; D387-R389 PolarHBondContact OD2-NE 3.4Å; D387-R389 IonicContact OD2-NH2 3.69Å; D387-R389 PolarHBondContact OD2-NH2 3.05Å; R389-S392 PolarHBondContact O-N 3.33Å; R389-S393 WeakPolarHBondContact O-CB 3.38Å; R389-S393 PolarHBondContact O-N 3.16Å
390	M	91.2	Very high	81.8	Confident	2 Å²	2	39.4 Å²	39.4	1%	0.01	19%	0.193	C	C	.	.	H	α-helix	trans	-60.8	-42.8	170.7	-70.2	-177.3	77.9	0	0	111.7	K333 V386 D387 S393 I523 L524	K333-M390 HydrophobicContact CB-CE 4.41Å; K333-M390 HydrophobicContact CB-CG 3.89Å; K333-M390 HydrophobicContact CB-SD 3.71Å; K333-M390 HydrophobicContact CD-SD 3.74Å; K333-M390 HydrophobicContact CG-CG 3.83Å; K333-M390 HydrophobicContact CG-SD 3.65Å; V386-M390 HydrophobicContact CB-SD 4.39Å; V386-M390 HydrophobicContact CG1-CB 4.14Å; V386-M390 HydrophobicContact CG1-SD 4.35Å; V386-M390 HydrophobicContact CG2-CE 4.42Å; V386-M390 HydrophobicContact CG2-SD 4.36Å; D387-M390 PolarHBondContact O-N 2.85Å; D387-M390 WeakPolarHBondContact OD1-CG 3.37Å; D387-M390 PolarHBondContact OD1-N 3.43Å; M390-S393 WeakPolarHBondContact O-CB 3.36Å; M390-S393 PolarHBondContact O-N 3.41Å; M390-S393 PolarHBondContact O-OG 3Å; M390-I523 WeakPolarHBondContact CE-O 3.4Å; M390-L524 HydrophobicContact CB-CD2 4.29Å; M390-L524 HydrophobicContact CE-CD2 4.47Å
391	L	93.4	Very high	79.6	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-63.4	-44.9	176	-63.1	-179.3	0	0	0	112.3	I363 W367 V386 D387 G388 S393 L394 L524 I561 L564 F569	I363-L391 HydrophobicContact CD1-CD1 3.64Å; I363-L391 HydrophobicContact CD1-CG 4.23Å; I363-L391 HydrophobicContact CG1-CD1 4.14Å; W367-L391 HydrophobicContact CE3-CD1 4.32Å; W367-L391 HydrophobicContact CH2-CD1 3.65Å; W367-L391 HydrophobicContact CH2-CD2 4.13Å; W367-L391 HydrophobicContact CZ2-CD1 4.35Å; W367-L391 HydrophobicContact CZ3-CD1 3.64Å; W367-L391 HydrophobicContact CZ3-CD2 4.15Å; V386-L391 HydrophobicContact CG1-CD2 4.25Å; D387-L391 PolarHBondContact O-N 3.47Å; G388-L391 PolarHBondContact O-N 3Å; L391-S393 VanDerWaalsContact C-N 3.26Å; L391-S393 PolarHBondContact O-N 3.31Å; L391-L394 WeakPolarHBondContact O-CB 3.3Å; L391-L394 PolarHBondContact O-N 2.87Å; L391-L524 HydrophobicContact CD2-CD2 4.37Å; L391-I561 HydrophobicContact CD2-CD1 4.15Å; L391-I561 HydrophobicContact CD2-CG1 4.23Å; L391-L564 HydrophobicContact CD1-CD1 4.09Å; L391-F569 HydrophobicContact CB-CE1 4.11Å
392	S	90.9	Very high	77.1	Confident	41 Å²	41	54.9 Å²	54.9	29%	0.287	26%	0.262	S	S	.	.	H	α-helix	trans	-59.9	-36.5	174.1	-178.8	0	0	0	0	112	G388 R389 L394 I395	G388-S392 WeakPolarHBondContact O-CB 3.37Å; G388-S392 PolarHBondContact O-N 3.26Å; R389-S392 PolarHBondContact O-N 3.33Å; S392-L394 PolarHBondContact O-N 2.91Å; S392-L394 VanDerWaalsContact O-N 3.11Å; S392-I395 WeakPolarHBondContact O-CB 3.48Å; S392-I395 WeakPolarHBondContact O-CG1 3.34Å; S392-I395 PolarHBondContact O-N 2.9Å
393	S	88	Confident	74.6	Confident	23 Å²	23	60.3 Å²	60.3	16%	0.161	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-13	178.2	88.4	0	0	0	0	115.2	R389 M390 L391 I395	R389-S393 WeakPolarHBondContact O-CB 3.38Å; R389-S393 PolarHBondContact O-N 3.16Å; M390-S393 WeakPolarHBondContact O-CB 3.36Å; M390-S393 PolarHBondContact O-N 3.41Å; M390-S393 PolarHBondContact O-OG 3Å; L391-S393 VanDerWaalsContact C-N 3.26Å; L391-S393 PolarHBondContact O-N 3.31Å; S393-I395 VanDerWaalsContact C-N 3.26Å
394	L	90.1	Very high	72.5	Confident	1 Å²	1	61.1 Å²	61.1	1%	0.005	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-3.9	171.8	-63.7	174	0	0	0	112.9	L391 S392 V514 A515 M520 I523 L524 I561	L391-L394 WeakPolarHBondContact O-CB 3.3Å; L391-L394 PolarHBondContact O-N 2.87Å; S392-L394 PolarHBondContact O-N 2.91Å; S392-L394 VanDerWaalsContact O-N 3.11Å; L394-V514 WeakPolarHBondContact O-CA 3.38Å; L394-A515 HydrophobicContact CB-CB 3.91Å; L394-A515 HydrophobicContact CD2-CB 3.86Å; L394-A515 HydrophobicContact CG-CB 4.46Å; L394-A515 VanDerWaalsContact O-CB 3.26Å; L394-A515 WeakPolarHBondContact O-CB 3.39Å; L394-A515 PolarHBondContact O-N 3.38Å; L394-M520 HydrophobicContact CD1-CG 4.18Å; L394-M520 HydrophobicContact CD2-CG 4.37Å; L394-I523 HydrophobicContact CD2-CB 3.85Å; L394-I523 HydrophobicContact CD2-CD1 3.79Å; L394-I523 HydrophobicContact CD2-CG1 4.41Å; L394-I523 HydrophobicContact CD2-CG2 3.85Å; L394-L524 HydrophobicContact CD1-CD1 3.92Å; L394-L524 HydrophobicContact CD1-CD2 3.87Å; L394-L524 HydrophobicContact CD1-CG 3.97Å; L394-L524 HydrophobicContact CG-CD2 4.46Å; L394-I561 HydrophobicContact CD1-CD1 3.6Å
395	I	87.4	Confident	70.3	Confident	15 Å²	15	67.9 Å²	67.9	8%	0.077	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	119.4	-176.9	-49.5	-172.3	0	0	0	109	S392 S393 W512 V514 I561 H565 F569	S392-I395 WeakPolarHBondContact O-CB 3.48Å; S392-I395 WeakPolarHBondContact O-CG1 3.34Å; S392-I395 PolarHBondContact O-N 2.9Å; S393-I395 VanDerWaalsContact C-N 3.26Å; I395-W512 HydrophobicContact CG2-CB 4.15Å; I395-W512 HydrophobicContact CG2-CE3 4.46Å; I395-V514 HydrophobicContact CG1-CG2 4.31Å; I395-I561 HydrophobicContact CD1-CG2 3.77Å; I395-I561 HydrophobicContact CG1-CG2 3.84Å; I395-H565 HydrophobicContact CD1-CB 3.49Å; I395-H565 VanDerWaalsContact CD1-CB 3.49Å; I395-H565 WeakPolarHBondContact CD1-CD2 3.41Å; I395-F569 HydrophobicContact CD1-CE2 3.91Å; I395-F569 HydrophobicContact CD1-CZ 3.73Å
396	T	81.5	Confident	68	Low	82 Å²	82	71 Å²	71	50%	0.503	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	130.6	-179.6	-59.9	0	0	0	0	110.6	K398 W512 Q513	T396-K398 PolarHBondContact O-N 2.99Å; T396-W512 CarbonylContact O-C 3.58Å; T396-W512 WeakPolarHBondContact O-CA 3.44Å; T396-Q513 PolarHBondContact N-O 3.03Å; T396-Q513 PolarHBondContact O-N 3.2Å
397	Y	69.2	Low	65.8	Low	95 Å²	95	78 Å²	78	37%	0.373	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	125.7	172.4	-172.9	-88	0	0	0	110.8	R399 N511	Y397-R399 HydrophobicContact CE1-CB 4.42Å; Y397-N511 CarbonylContact C-O 3.59Å; Y397-N511 HydrophobicContact CD2-CB 4.38Å; Y397-N511 VanDerWaalsContact CD2-O 3.29Å; Y397-N511 WeakPolarHBondContact CD2-O 3.48Å; Y397-N511 HydrophobicContact CE2-CB 3.62Å
398	K	60.3	Low	63.3	Low	111 Å²	111	83.3 Å²	83.3	48%	0.483	39%	0.391	S	S	.	.			trans	-100.4	87.9	-175.7	-173	-180	-172.3	166.2	0	110.2	T396 S400 N511 Q513	T396-K398 PolarHBondContact O-N 2.99Å; K398-S400 PolarHBondContact O-N 3.25Å; K398-N511 PolarHBondContact N-O 3.45Å; K398-Q513 HydrophobicContact CD-CB 4.46Å
399	R	39.4	Very low	60.7	Low	155 Å²	155	94.2 Å²	94.2	59%	0.585	43%	0.432	S	S	*	.			trans	-58.1	123.2	174	-150.3	171.6	-162.8	126.4	10.1	110.1	Y397 K401	Y397-R399 HydrophobicContact CE1-CB 4.42Å; R399-K401 PolarHBondContact O-N 3.45Å
400	S	33.6	Very low	58.4	Low	58 Å²	58	103.8 Å²	103.8	41%	0.406	47%	0.468	S	S	.	.			trans	-56	132.8	-176.6	-177.7	0	0	0	0	111.9	K398 H402 Y403	K398-S400 PolarHBondContact O-N 3.25Å; S400-H402 PolarHBondContact O-N 2.83Å; S400-Y403 PolarHBondContact O-N 2.77Å
401	K	40.7	Very low	56.1	Low	173 Å²	173	112.7 Å²	112.7	75%	0.752	51%	0.507	S	S	*	.	G	3₁₀ helix	trans	-60.9	-17.5	-170.4	-76.6	-174.2	174.2	-177.6	0	114.1	R399 Y403 I404	R399-K401 PolarHBondContact O-N 3.45Å; K401-Y403 PolarHBondContact O-N 3.28Å; K401-I404 PolarHBondContact O-N 2.68Å
402	H	39.5	Very low	53.4	Low	158 Å²	158	117.7 Å²	117.7	73%	0.731	54%	0.542	S	S	*	.	G	3₁₀ helix	trans	-66.5	-16.9	-179.3	-80.5	-77	0	0	0	114.9	S400	S400-H402 PolarHBondContact O-N 2.83Å
403	Y	37.4	Very low	50.9	Low	153 Å²	153	125.1 Å²	125.1	60%	0.6	57%	0.569	S	S	*	*	G	3₁₀ helix	trans	-81.1	-19.3	175.5	-161.2	-116.3	0	0	0	114.1	S400 K401	S400-Y403 PolarHBondContact O-N 2.77Å; K401-Y403 PolarHBondContact O-N 3.28Å
404	I	41.5	Very low	48.6	Very low	87 Å²	87	130.7 Å²	130.7	45%	0.446	60%	0.597	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88.6	-26.5	-168.4	-63.8	176.4	0	0	0	112.9	K401 H406 K407 N408	K401-I404 PolarHBondContact O-N 2.68Å; I404-H406 VanDerWaalsContact C-N 3.26Å; I404-H406 PolarHBondContact O-N 3.01Å; I404-K407 PolarHBondContact O-N 2.88Å; I404-N408 PolarHBondContact O-N 3.01Å
405	Q	38.1	Very low	46.1	Very low	153 Å²	153	138.4 Å²	138.4	72%	0.715	64%	0.637	S	S	*	*	H	α-helix	trans	-67.1	-22.2	179.8	-75	-169.1	-15.5	0	0	114.1
406	H	40.7	Very low	43.5	Very low	158 Å²	158	146.4 Å²	146.4	73%	0.731	67%	0.673	S	S	*	*	H	α-helix	trans	-83.5	-19.9	178	-79	-77.5	0	0	0	114.9	I404	I404-H406 VanDerWaalsContact C-N 3.26Å; I404-H406 PolarHBondContact O-N 3.01Å
407	K	43.9	Very low	41.4	Very low	147 Å²	147	150.6 Å²	150.6	64%	0.639	69%	0.687	S	S	*	*	H	α-helix	trans	-88.2	-37.2	174	-80.6	-168.2	173.4	-173.5	0	113.1	I404 R409 R410	I404-K407 PolarHBondContact O-N 2.88Å; K407-R409 VanDerWaalsContact C-N 3.31Å; K407-R409 PolarHBondContact O-N 2.91Å; K407-R410 PolarHBondContact O-N 3.34Å
408	N	39.5	Very low	39.5	Very low	118 Å²	118	152.4 Å²	152.4	63%	0.631	70%	0.703	S	S	*	*	H	α-helix	trans	-73.5	-20.1	-176.5	-71.6	-0.1	0	0	0	114	I404 R410	I404-N408 PolarHBondContact O-N 3.01Å; N408-R410 VanDerWaalsContact C-N 3.33Å; N408-R410 PolarHBondContact O-N 3.46Å
409	R	38.5	Very low	38.1	Very low	229 Å²	229	152.9 Å²	152.9	86%	0.864	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.8	-4	177.1	-138.3	172.5	-176.2	166.5	-0.2	114.6	K407	K407-R409 VanDerWaalsContact C-N 3.31Å; K407-R409 PolarHBondContact O-N 2.91Å
410	R	41.8	Very low	37.7	Very low	221 Å²	221	152.4 Å²	152.4	83%	0.834	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.5	0.2	178.1	-73.5	-173.2	175.2	176.7	-0.9	114.7	K407 N408	K407-R410 PolarHBondContact O-N 3.34Å; N408-R410 VanDerWaalsContact C-N 3.33Å; N408-R410 PolarHBondContact O-N 3.46Å
411	K	42.5	Very low	37.6	Very low	188 Å²	188	156.4 Å²	156.4	82%	0.817	75%	0.745	S	S	*	*	S	Bend	trans	-105.3	17.8	178.4	-75.9	-164.4	169.6	-165.7	0	114.5
412	S	37	Very low	37.2	Very low	106 Å²	106	154.7 Å²	154.7	74%	0.741	74%	0.744	S	S	*	*	S	Bend	trans	-112.9	24.7	-171.2	-170.2	0	0	0	0	113.9
413	K	38.5	Very low	36.8	Very low	197 Å²	197	154.3 Å²	154.3	86%	0.857	75%	0.747	S	S	*	*	S	Bend	trans	-135.3	-9.4	-176.3	-101.9	-170.5	173.1	-170.3	0	117.3
414	D	38.6	Very low	36.4	Very low	140 Å²	140	154.6 Å²	154.6	75%	0.749	76%	0.759	S	S	*	*	S	Bend	trans	-129.7	150.3	-179.3	-55.9	-66.6	0	0	0	109.7
415	I	38.2	Very low	35.8	Very low	163 Å²	163	154.7 Å²	154.7	84%	0.836	77%	0.768	S	S	*	*			trans	76	65	-174.7	-41	172.8	0	0	0	113.9
416	H	33.3	Very low	35.4	Very low	183 Å²	183	156.3 Å²	156.3	85%	0.847	78%	0.775	S	S	*	*			trans	-68.1	115.6	131.6	-93.5	-107.5	0	0	0	107.6
417	H	36.7	Very low	34.8	Very low	170 Å²	170	154.6 Å²	154.6	79%	0.787	77%	0.771	S	S	*	*			trans	171.2	110.3	131.8	-95.6	-68.8	0	0	0	111.2
418	N	29	Very low	34.2	Very low	133 Å²	133	154.1 Å²	154.1	71%	0.711	77%	0.774	S	S	*	*			trans	37.4	103.1	132.4	-161.5	32.9	0	0	0	119.3
419	C	31.5	Very low	33.7	Very low	121 Å²	121	155.6 Å²	155.6	82%	0.818	78%	0.78	S	S	*	*				-165.9	136.8	123.1	-100.9	0	0	0	0	109.9
420	N	30.3	Very low	33.3	Very low	144 Å²	144	150.9 Å²	150.9	77%	0.77	77%	0.771	S	S	*	*			trans	-92.9	176.3	-176.1	-72.8	-36.2	0	0	0	112.8
421	N	33.1	Very low	32.6	Very low	142 Å²	142	144.5 Å²	144.5	76%	0.759	76%	0.76	S	S	*	*			trans	88.9	93.1	163.7	-57.4	-3.2	0	0	0	117.3
422	D	30.9	Very low	32.2	Very low	137 Å²	137	140.8 Å²	140.8	73%	0.733	75%	0.749	S	S	*	*				40.9	110.9	120.3	-54	-19.3	0	0	0	119
423	N	32.3	Very low	32.2	Very low	150 Å²	150	138.4 Å²	138.4	80%	0.802	73%	0.731	S	S	*	*				-173.9	153.3	107.8	-98.7	-61.2	0	0	0	113.8	S425	N423-S425 PolarHBondContact O-N 2.86Å
424	N	28	Very low	32	Very low	160 Å²	160	134.5 Å²	134.5	86%	0.856	72%	0.72	S	S	*	*			trans	-38.1	120.9	-177.5	-72.2	-55.3	0	0	0	117.6
425	S	29.8	Very low	31.8	Very low	89 Å²	89	130.5 Å²	130.5	62%	0.622	71%	0.711	S	S	*	*			trans	-144.5	99.7	152.4	66.6	0	0	0	0	112.6	N423 N427	N423-S425 PolarHBondContact O-N 2.86Å; S425-N427 PolarHBondContact O-N 3.44Å
426	H	28.2	Very low	31.6	Very low	187 Å²	187	128.1 Å²	128.1	87%	0.866	70%	0.7	S	S	*	*			trans	-74.9	74	163.8	-90.9	1.3	0	0	0	110.3	I428	H426-I428 VanDerWaalsContact C-N 3.32Å; H426-I428 PolarHBondContact O-N 2.73Å
427	N	29.3	Very low	31.6	Very low	122 Å²	122	125.7 Å²	125.7	65%	0.652	69%	0.693	S	S	*	*			trans	-75.2	87.7	165.1	-79.3	-21.9	0	0	0	109	S425 I429	S425-N427 PolarHBondContact O-N 3.44Å; N427-I429 PolarHBondContact O-N 2.72Å; N427-I429 VanDerWaalsContact O-N 3.12Å
428	I	32.1	Very low	31.1	Very low	136 Å²	136	123.3 Å²	123.3	70%	0.697	69%	0.692	S	S	*	*			trans	-67.6	107	165.3	-62.1	177	0	0	0	106.9	H426 I430	H426-I428 VanDerWaalsContact C-N 3.32Å; H426-I428 PolarHBondContact O-N 2.73Å; I428-I430 PolarHBondContact O-N 3.04Å
429	I	28.5	Very low	31.1	Very low	150 Å²	150	123.2 Å²	123.2	77%	0.769	70%	0.696	S	S	*	*			trans	-67.3	102.6	173	-61.3	173.9	0	0	0	107.3	N427 S431	N427-I429 PolarHBondContact O-N 2.72Å; N427-I429 VanDerWaalsContact O-N 3.12Å; I429-S431 PolarHBondContact O-N 2.95Å
430	I	29.7	Very low	30.8	Very low	130 Å²	130	122.7 Å²	122.7	67%	0.667	69%	0.693	S	S	*	*			trans	-72.8	85.3	170.7	-56	177.3	0	0	0	107.3	I428 N432	I428-I430 PolarHBondContact O-N 3.04Å; I430-N432 PolarHBondContact O-N 3.38Å
431	S	27.7	Very low	30.7	Very low	86 Å²	86	122 Å²	122	60%	0.601	69%	0.69	S	S	*	*			trans	-67.7	113.3	165.9	48.4	0	0	0	0	108.8	I429 P433	I429-S431 PolarHBondContact O-N 2.95Å; S431-P433 VanDerWaalsContact O-CD 3.3Å; S431-P433 WeakPolarHBondContact O-CD 3.37Å
432	N	33.5	Very low	30.3	Very low	110 Å²	110	121.6 Å²	121.6	59%	0.588	70%	0.695	S	S	*	*			trans	-48.9	115.8	175.3	-179.8	7.7	0	0	0	110.9	I430 N434	I430-N432 PolarHBondContact O-N 3.38Å; N432-N434 PolarHBondContact O-N 3.27Å; N432-N434 WeakPolarHBondContact OD1-CB 3.21Å; N432-N434 PolarHBondContact OD1-N 3.29Å
433	P	35.9	Very low	30.4	Very low	57 Å²	57	119.1 Å²	119.1	37%	0.37	69%	0.688	S	S	.	*	G	3₁₀ helix	trans	-68.7	-16.4	177.5	-19.4	33.5	0	0	0	113.7	S431 G435	S431-P433 VanDerWaalsContact O-CD 3.3Å; S431-P433 WeakPolarHBondContact O-CD 3.37Å; P433-G435 PolarHBondContact O-N 3.15Å
434	N	35.2	Very low	30.4	Very low	114 Å²	114	120.5 Å²	120.5	61%	0.61	69%	0.69	S	S	*	*	G	3₁₀ helix	trans	-95.1	15.3	-170.7	-57.8	-10.8	0	0	0	113.2	N432	N432-N434 PolarHBondContact O-N 3.27Å; N432-N434 WeakPolarHBondContact OD1-CB 3.21Å; N432-N434 PolarHBondContact OD1-N 3.29Å
435	G	34.3	Very low	30.5	Very low	56 Å²	56	122 Å²	122	58%	0.577	69%	0.692	S	S	*	*	G	3₁₀ helix	trans	-78.3	-16.7	-178.6	0	0	0	0	0	115.6	P433	P433-G435 PolarHBondContact O-N 3.15Å
436	D	33.9	Very low	30.6	Very low	113 Å²	113	125.6 Å²	125.6	60%	0.604	70%	0.704	S	S	*	*	S	Bend	trans	-122.5	23.1	-167.5	-70.6	-42.3	0	0	0	113.7
437	I	32.6	Very low	30.6	Very low	133 Å²	133	124.2 Å²	124.2	68%	0.682	70%	0.702	S	S	*	*	S	Bend	trans	-115.7	121.9	167.8	-58.7	178.4	0	0	0	108.7	V439	I437-V439 PolarHBondContact O-N 2.73Å
438	P	27.1	Very low	30.8	Very low	120 Å²	120	126 Å²	126	78%	0.779	71%	0.71	S	S	*	*			trans	-74.1	100.3	-179.3	29.9	-33.3	0	0	0	110.3	S440	P438-S440 PolarHBondContact O-N 3.26Å; P438-S440 VanDerWaalsContact O-N 3.09Å
439	V	28.3	Very low	30.7	Very low	130 Å²	130	127.3 Å²	127.3	79%	0.788	72%	0.718	S	S	*	*			trans	-67.2	106.7	160.8	178.4	0	0	0	0	107.3	I437 N441	I437-V439 PolarHBondContact O-N 2.73Å; V439-N441 VanDerWaalsContact C-N 3.26Å; V439-N441 PolarHBondContact O-N 3.05Å
440	S	26.7	Very low	30.8	Very low	110 Å²	110	128.3 Å²	128.3	77%	0.769	72%	0.724	S	S	*	*	S	Bend	trans	-69.2	80.7	173.8	51.9	0	0	0	0	110.9	P438	P438-S440 PolarHBondContact O-N 3.26Å; P438-S440 VanDerWaalsContact O-N 3.09Å
441	N	27.8	Very low	31	Very low	130 Å²	130	131.5 Å²	131.5	70%	0.695	73%	0.734	S	S	*	*			trans	-159.7	98.4	158	-109.6	-18.5	0	0	0	110.6	V439 S443	V439-N441 VanDerWaalsContact C-N 3.26Å; V439-N441 PolarHBondContact O-N 3.05Å; N441-S443 PolarHBondContact O-N 2.65Å; N441-S443 VanDerWaalsContact O-N 3.14Å
442	P	24.9	Very low	31.1	Very low	134 Å²	134	134.8 Å²	134.8	87%	0.87	74%	0.744	S	S	*	*			trans	-85.5	83.7	-175.9	33.7	-33.7	0	0	0	111.7
443	S	32.1	Very low	30.9	Very low	84 Å²	84	136.5 Å²	136.5	59%	0.587	75%	0.753	S	S	*	*	S	Bend	trans	-153.3	3.2	175	56.2	0	0	0	0	117.8	N441	N441-S443 PolarHBondContact O-N 2.65Å; N441-S443 VanDerWaalsContact O-N 3.14Å
444	Q	33.8	Very low	30.6	Very low	179 Å²	179	142 Å²	142	84%	0.836	78%	0.775	S	S	*	*	S	Bend	trans	-127.4	6.8	-177.7	-74	-169.9	-38.6	0	0	116.7
445	Q	30.1	Very low	30.3	Very low	193 Å²	193	144 Å²	144	90%	0.902	78%	0.783	S	S	*	*	S	Bend	trans	-95.2	2.4	-176.5	-85.8	-175.7	-16.5	0	0	116.7
446	N	30.4	Very low	30	Very low	164 Å²	164	149.3 Å²	149.3	88%	0.877	80%	0.799	S	S	*	*	S	Bend	trans	-110.3	47.7	179.4	-77.8	-15.4	0	0	0	113.5
447	L	29.7	Very low	29.8	Very low	158 Å²	158	146.7 Å²	146.7	83%	0.827	80%	0.798	S	S	*	*	S	Bend	trans	-154.6	18.6	173	-114.6	154	0	0	0	117.6
448	I	33	Very low	29.7	Very low	158 Å²	158	146.1 Å²	146.1	81%	0.81	81%	0.806	S	S	*	*	S	Bend	trans	-131.9	82.6	157.5	-59.7	88.9	0	0	0	108.9
449	N	29.2	Very low	29.8	Very low	164 Å²	164	145.6 Å²	145.6	88%	0.877	81%	0.805	S	S	*	*	S	Bend	trans	-165.4	52.8	162.2	-111.2	-8.4	0	0	0	111.2
450	L	31	Very low	29.9	Very low	171 Å²	171	144.4 Å²	144.4	90%	0.895	80%	0.802	S	S	*	*			trans	-162	54.8	176.3	-110.4	156.5	0	0	0	112.1
451	K	33.1	Very low	30.1	Very low	198 Å²	198	144 Å²	144	86%	0.861	80%	0.799	S	S	*	*			trans	-163.9	84.6	162.4	-113.9	168.4	-173.5	179	0	111.2
452	N	30.8	Very low	30.3	Very low	154 Å²	154	144.4 Å²	144.4	82%	0.824	80%	0.802	S	S	*	*	S	Bend	trans	164.5	82.1	143.8	-84.6	-7.3	0	0	0	109.8
453	N	28.8	Very low	30.6	Very low	146 Å²	146	144.7 Å²	144.7	78%	0.781	80%	0.796	S	S	*	*				-177.3	120.3	128.1	-91.9	-22.7	0	0	0	111.9
454	Q	29.9	Very low	30.6	Very low	174 Å²	174	147.1 Å²	147.1	81%	0.813	80%	0.803	S	S	*	*			trans	42.8	105.1	140.7	-58.4	178.2	-2.5	0	0	119
455	I	29.5	Very low	30.4	Very low	154 Å²	154	145 Å²	145	79%	0.79	80%	0.797	S	S	*	*				-129.2	96.7	128.5	-59.2	-177.4	0	0	0	107.5
456	N	27.8	Very low	30.6	Very low	169 Å²	169	142.6 Å²	142.6	90%	0.904	79%	0.789	S	S	*	*			trans	-74.2	137.1	138.4	-83.8	-5.9	0	0	0	107
457	G	29.8	Very low	30.6	Very low	58 Å²	58	139 Å²	139	60%	0.598	78%	0.776	S	S	*	*			trans	129.7	138.3	177.6	0	0	0	0	0	111.7
458	S	30.1	Very low	30.7	Very low	120 Å²	120	137.5 Å²	137.5	84%	0.839	77%	0.769	S	S	*	*			cis	-172.5	133.6	-4.2	43.8	0	0	0	0	109.5
459	S	29.4	Very low	30.6	Very low	110 Å²	110	137.4 Å²	137.4	77%	0.769	77%	0.765	S	S	*	*			trans	-112.2	108.5	154.9	40.1	0	0	0	0	106.8
460	S	29.2	Very low	30.7	Very low	104 Å²	104	135 Å²	135	73%	0.727	76%	0.761	S	S	*	*				56.6	101.3	76.8	76	0	0	0	0	111.2
461	S	32.7	Very low	30.8	Very low	101 Å²	101	131.5 Å²	131.5	71%	0.706	75%	0.751	S	S	*	*				-176.9	152.4	75.7	41.1	0	0	0	0	112.7
462	N	31.8	Very low	30.6	Very low	139 Å²	139	128.6 Å²	128.6	74%	0.743	74%	0.743	S	S	*	*			trans	48.8	109.7	144.8	-52.4	-7.1	0	0	0	119.7
463	N	30.3	Very low	30.6	Very low	140 Å²	140	130 Å²	130	75%	0.749	74%	0.742	S	S	*	*				-167.2	163.7	87.3	-97.9	-18.9	0	0	0	112.4
464	D	32.6	Very low	30.4	Very low	136 Å²	136	128 Å²	128	73%	0.727	74%	0.74	S	S	*	*			trans	66.5	140.4	163.6	-58.7	-40.7	0	0	0	119.4
465	N	29.6	Very low	30.4	Very low	134 Å²	134	127.1 Å²	127.1	72%	0.717	74%	0.739	S	S	*	*			cis	-167.4	-175.1	-32.4	-129.1	-50.4	0	0	0	106.3
466	I	33	Very low	30.4	Very low	143 Å²	143	123.5 Å²	123.5	73%	0.733	73%	0.727	S	S	*	*			trans	70.1	88.8	169.2	-45.3	-176.9	0	0	0	112.7
467	S	30.7	Very low	30.4	Very low	88 Å²	88	121.5 Å²	121.5	62%	0.615	73%	0.726	S	S	*	*				62.6	134.1	82	98.8	0	0	0	0	112.9
468	N	31.7	Very low	30.2	Very low	126 Å²	126	124.1 Å²	124.1	67%	0.674	73%	0.73	S	S	*	*			cis	-161.4	153.1	31.3	-108.9	-30.5	0	0	0	113.7
469	H	31	Very low	30.1	Very low	157 Å²	157	123.8 Å²	123.8	73%	0.727	73%	0.728	S	S	*	*			trans	44	136.7	146.1	-67.1	-64.4	0	0	0	124.2
470	S	32	Very low	30	Very low	113 Å²	113	123.2 Å²	123.2	79%	0.79	72%	0.724	S	S	*	*			trans	70.9	142.3	142.7	72.4	0	0	0	0	117.7
471	S	33.8	Very low	30	Very low	97 Å²	97	124 Å²	124	68%	0.678	73%	0.725	S	S	*	*			cis	-150.8	128.2	-7.3	-100.8	0	0	0	0	106.8
472	I	27.5	Very low	29.7	Very low	138 Å²	138	123.6 Å²	123.6	71%	0.708	72%	0.722	S	S	*	*				65.9	125.9	91.9	-66.4	174.8	0	0	0	113.9
473	K	30.9	Very low	29.4	Very low	183 Å²	183	121.8 Å²	121.8	80%	0.796	72%	0.72	S	S	*	*			trans	74.7	110.7	173.1	-66.5	155.2	-170.6	179.1	0	115.5
474	S	26	Very low	29.3	Very low	104 Å²	104	122.9 Å²	122.9	73%	0.727	73%	0.725	S	S	*	*			cis	68.4	103.5	42.5	88.9	0	0	0	0	114.5
475	I	29.8	Very low	28.9	Very low	155 Å²	155	121 Å²	121	80%	0.795	72%	0.719	S	S	*	*			trans	-164.3	97.7	152.1	-90.1	137.5	0	0	0	103.3
476	S	29.5	Very low	28.8	Very low	78 Å²	78	121.6 Å²	121.6	55%	0.545	72%	0.722	S	S	.	*				46	97.1	93.5	66.1	0	0	0	0	112.6
477	S	27.3	Very low	28.4	Very low	127 Å²	127	119 Å²	119	89%	0.888	72%	0.722	S	S	*	*				55.8	48.2	66.7	87.1	0	0	0	0	114.2
478	V	24.8	Very low	28.5	Very low	113 Å²	113	121.2 Å²	121.2	69%	0.685	73%	0.732	S	S	*	*			trans	-142	126.4	164.2	-149.5	0	0	0	0	109.5
479	S	29.1	Very low	28.2	Very low	114 Å²	114	123.2 Å²	123.2	80%	0.797	74%	0.737	S	S	*	*			trans	-175.7	104.8	155.6	-84.8	0	0	0	0	104.3
480	S	27	Very low	28	Very low	97 Å²	97	122.4 Å²	122.4	68%	0.678	74%	0.738	S	S	*	*				55.9	122.4	58.2	-41.4	0	0	0	0	109.1
481	T	29.3	Very low	27.9	Very low	120 Å²	120	121.8 Å²	121.8	74%	0.736	73%	0.733	S	S	*	*			cis	-148.2	135.8	33.3	46.8	0	0	0	0	108.5
482	S	26.6	Very low	27.3	Very low	93 Å²	93	122.1 Å²	122.1	65%	0.65	74%	0.736	S	S	*	*				44	121.4	80.8	72.2	0	0	0	0	114.7
483	S	25	Very low	27.3	Very low	102 Å²	102	120.2 Å²	120.2	71%	0.713	74%	0.735	S	S	*	*			trans	37.7	126.4	145.7	42.5	0	0	0	0	121
484	L	28.6	Very low	27.1	Very low	162 Å²	162	119.8 Å²	119.8	85%	0.848	74%	0.735	S	S	*	*			trans	177.1	87.7	141.2	-91.6	155.6	0	0	0	106.1
485	T	25.1	Very low	27.3	Very low	98 Å²	98	122.4 Å²	122.4	60%	0.601	74%	0.739	S	S	*	*				72.8	134.7	84.7	62	0	0	0	0	115.3
486	N	27.2	Very low	27.1	Very low	145 Å²	145	122.7 Å²	122.7	78%	0.775	74%	0.743	S	S	*	*			trans	69.7	112.6	151.8	-55.2	-8.4	0	0	0	116.3
487	A	24.6	Very low	27.1	Very low	88 Å²	88	123.8 Å²	123.8	73%	0.727	75%	0.75	S	S	*	*				76.9	90.7	65.8	0	0	0	0	0	113.1
488	V	31.3	Very low	27.2	Very low	136 Å²	136	122.5 Å²	122.5	82%	0.824	74%	0.741	S	S	*	*			trans	-156.3	100.9	158.9	-179.2	0	0	0	0	102.1
489	Q	25.8	Very low	27.3	Very low	168 Å²	168	124.2 Å²	124.2	79%	0.785	75%	0.747	S	S	*	*			cis	47.3	81.7	41.4	-150.6	177.1	16.2	0	0	111.3
490	D	26.6	Very low	27.3	Very low	140 Å²	140	127.6 Å²	127.6	75%	0.749	75%	0.747	S	S	*	*				176.5	155.4	126.1	-90.7	-16.2	0	0	0	114.3
491	S	29.7	Very low	27.4	Very low	99 Å²	99	134 Å²	134	69%	0.692	76%	0.758	S	S	*	*			trans	53.2	108.5	156.9	-56.9	0	0	0	0	118.3
492	S	22.6	Very low	27.6	Very low	105 Å²	105	134.3 Å²	134.3	73%	0.734	76%	0.755	S	S	*	*				64.8	148.3	58.9	96	0	0	0	0	114.7
493	S	26.8	Very low	27.8	Very low	98 Å²	98	136.8 Å²	136.8	69%	0.685	76%	0.761	S	S	*	*			trans	75.1	113.1	175	76.8	0	0	0	0	119
494	H	25.7	Very low	28.1	Very low	173 Å²	173	135.5 Å²	135.5	80%	0.801	75%	0.746	S	S	*	*			trans	34	127.3	135.6	-54.3	-68.8	0	0	0	121.2
495	I	31.7	Very low	28.3	Very low	159 Å²	159	133.8 Å²	133.8	82%	0.815	74%	0.738	S	S	*	*				-158.2	130.2	109	-95.3	145.3	0	0	0	109.7
496	N	23.9	Very low	28.5	Very low	162 Å²	162	137.9 Å²	137.9	87%	0.866	75%	0.75	S	S	*	*			trans	-75.9	132.3	173.5	-80.7	-41	0	0	0	111.1
497	S	31.1	Very low	29	Very low	100 Å²	100	139 Å²	139	70%	0.699	75%	0.745	S	S	*	*			trans	-157.5	80.7	156	49.4	0	0	0	0	114.4
498	S	27.8	Very low	29.9	Very low	101 Å²	101	142.3 Å²	142.3	71%	0.706	75%	0.749	S	S	*	*			trans	53.5	131.9	132.9	69.2	0	0	0	0	122.8
499	N	27	Very low	30.6	Very low	148 Å²	148	142.3 Å²	142.3	79%	0.791	74%	0.74	S	S	*	*			trans	78.4	86.8	142.3	-58.2	-23.2	0	0	0	120.6
500	K	30.5	Very low	32.3	Very low	185 Å²	185	138.8 Å²	138.8	80%	0.804	72%	0.719	S	S	*	*				165	125.4	104.3	-93.9	-176.3	172.8	-172.9	0	111.6
501	Y	28.7	Very low	34.4	Very low	233 Å²	233	134.3 Å²	134.3	91%	0.914	70%	0.695	S	S	*	*			trans	-95.2	111	163	-73.1	-88.3	0	0	0	109.2
502	D	33.3	Very low	36.6	Very low	125 Å²	125	131.9 Å²	131.9	67%	0.668	67%	0.671	S	S	*	*			trans	-101.1	121.9	163.6	-87.4	-47.7	0	0	0	108.8	D504	D502-D504 PolarHBondContact O-N 2.81Å; D502-D504 VanDerWaalsContact O-N 3.1Å
503	N	30.5	Very low	39.5	Very low	146 Å²	146	130.6 Å²	130.6	78%	0.781	65%	0.653	S	S	*	*			trans	-78.5	90.3	177.5	-93.7	-25	0	0	0	110.3	N505	N503-N505 PolarHBondContact O-N 3.39Å
504	D	31.6	Very low	42.3	Very low	75 Å²	75	125.9 Å²	125.9	40%	0.401	62%	0.62	S	S	.	*			trans	-69.1	76.9	169.2	-65.3	-47.8	0	0	0	111.1	D502 E506 R778 R779	D502-D504 PolarHBondContact O-N 2.81Å; D502-D504 VanDerWaalsContact O-N 3.1Å; D504-E506 PolarHBondContact O-N 3.32Å; D504-R778 PolarHBondContact O-NH2 3.29Å; D504-R779 IonicContact OD2-CZ 3.2Å; D504-R779 IonicContact OD2-NH1 2.85Å; D504-R779 PolarHBondContact OD2-NH1 2.98Å; D504-R779 IonicContact OD2-NH2 2.67Å; D504-R779 PolarHBondContact OD2-NH2 2.9Å
505	N	32.4	Very low	45.2	Very low	125 Å²	125	118 Å²	118	67%	0.668	59%	0.585	S	S	*	*			trans	-69.3	108.6	153.4	-84.5	-9.7	0	0	0	106.7	N503 Y507	N503-N505 PolarHBondContact O-N 3.39Å; N505-Y507 HydrophobicContact CB-CE2 4.45Å; N505-Y507 PolarHBondContact O-N 3.44Å
506	E	29.3	Very low	47.9	Very low	184 Å²	184	111.9 Å²	111.9	86%	0.86	56%	0.561	S	S	*	*			trans	-74.4	76.2	-174.7	-166.4	159.3	-151.3	0	0	110.3	D504 I508	D504-E506 PolarHBondContact O-N 3.32Å; E506-I508 PolarHBondContact O-N 2.76Å
507	Y	38.3	Very low	51	Low	169 Å²	169	108.7 Å²	108.7	66%	0.663	54%	0.537	S	S	*	.			trans	-57.7	110	169.6	-82.8	-76.2	0	0	0	109	N505 E509	N505-Y507 HydrophobicContact CB-CE2 4.45Å; N505-Y507 PolarHBondContact O-N 3.44Å; Y507-E509 PolarHBondContact O-N 3.27Å
508	I	42.9	Very low	53.6	Low	158 Å²	158	112.7 Å²	112.7	81%	0.81	54%	0.537	S	S	*	.			trans	-60.6	105.6	174	-60	175.7	0	0	0	107.7	E506 R510	E506-I508 PolarHBondContact O-N 2.76Å; I508-R510 PolarHBondContact O-N 3.46Å
509	E	46.5	Very low	56.4	Low	136 Å²	136	112.8 Å²	112.8	64%	0.636	53%	0.526	S	S	*	.			trans	-58.2	125.8	178.3	-166.4	173.9	-161.1	0	0	108.5	Y507 N511	Y507-E509 PolarHBondContact O-N 3.27Å; E509-N511 VanDerWaalsContact O-CG 3.31Å; E509-N511 PolarHBondContact O-N 3.27Å; E509-N511 PolarHBondContact O-ND2 3.27Å
510	R	61.3	Low	59.4	Low	93 Å²	93	105.7 Å²	105.7	35%	0.351	49%	0.488	S	S	.	.			trans	-67.6	81.4	-177.7	-65.6	-169.9	-167.8	179.5	6.2	110	I508 W512 E562 E664	I508-R510 PolarHBondContact O-N 3.46Å; R510-W512 PolarHBondContact O-N 3.28Å; R510-E562 IonicContact CZ-OE1 3.75Å; R510-E562 IonicContact NH1-OE1 3.85Å; R510-E562 PolarHBondContact NH1-OE1 3.27Å; R510-E664 PolarHBondContact NH2-O 2.94Å
511	N	70.4	Confident	62.1	Low	46 Å²	46	97 Å²	97	25%	0.246	45%	0.45	C	S	.	.			trans	-81.7	9.9	-173.5	-76.1	-42.3	0	0	0	113.6	Y397 K398 E509	Y397-N511 CarbonylContact C-O 3.59Å; Y397-N511 HydrophobicContact CD2-CB 4.38Å; Y397-N511 VanDerWaalsContact CD2-O 3.29Å; Y397-N511 WeakPolarHBondContact CD2-O 3.48Å; Y397-N511 HydrophobicContact CE2-CB 3.62Å; K398-N511 PolarHBondContact N-O 3.45Å; E509-N511 VanDerWaalsContact O-CG 3.31Å; E509-N511 PolarHBondContact O-N 3.27Å; E509-N511 PolarHBondContact O-ND2 3.27Å
512	W	76.3	Confident	64.6	Low	49 Å²	49	89.3 Å²	89.3	19%	0.186	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	158.7	172.5	49.8	-97.3	0	0	0	109.9	I395 T396 R510 V514 E562 H565 H566	I395-W512 HydrophobicContact CG2-CB 4.15Å; I395-W512 HydrophobicContact CG2-CE3 4.46Å; T396-W512 CarbonylContact O-C 3.58Å; T396-W512 WeakPolarHBondContact O-CA 3.44Å; R510-W512 PolarHBondContact O-N 3.28Å; W512-V514 HydrophobicContact CE3-CG2 4.39Å; W512-V514 HydrophobicContact CZ3-CG2 4.13Å; W512-E562 HydrophobicContact CH2-CB 3.88Å; W512-E562 HydrophobicContact CH2-CG 3.58Å; W512-E562 WeakPolarHBondContact CH2-OE1 3.47Å; W512-E562 HydrophobicContact CZ3-CB 3.79Å; W512-E562 HydrophobicContact CZ3-CG 3.92Å; W512-H565 AromaticContact CD1-CE1 3.49Å; W512-H565 VanDerWaalsContact CD1-CE1 3.49Å; W512-H565 AromaticContact CD2-CE1 3.74Å; W512-H565 AromaticContact CD2-ND1 3.61Å; W512-H565 AromaticContact CE2-CE1 3.7Å; W512-H565 AromaticContact CE2-ND1 3.4Å; W512-H565 AromaticContact CG-CE1 3.64Å; W512-H565 AromaticContact CZ2-ND1 3.76Å; W512-H565 AromaticContact NE1-CE1 3.5Å; W512-H565 AromaticContact NE1-ND1 3.63Å; W512-H566 AromaticContact CH2-CE1 3.95Å; W512-H566 AromaticContact CH2-NE2 3.89Å; W512-H566 AromaticContact CZ2-CD2 3.95Å; W512-H566 AromaticContact CZ2-CE1 3.98Å; W512-H566 AromaticContact CZ2-NE2 3.45Å; W512-H566 WeakPolarHBondContact CZ2-NE2 3.34Å
513	Q	83.8	Confident	67	Low	77 Å²	77	84.5 Å²	84.5	36%	0.36	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	122.3	178.2	-176.7	175.4	-37.3	0	0	109	T396 K398	T396-Q513 PolarHBondContact N-O 3.03Å; T396-Q513 PolarHBondContact O-N 3.2Å; K398-Q513 HydrophobicContact CD-CB 4.46Å
514	V	85.8	Confident	69.7	Low	0 Å²	0	77.6 Å²	77.6	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	135.8	167.3	-175.7	0	0	0	0	109.3	L394 I395 W512 M520 R558 I561 E562	L394-V514 WeakPolarHBondContact O-CA 3.38Å; I395-V514 HydrophobicContact CG1-CG2 4.31Å; W512-V514 HydrophobicContact CE3-CG2 4.39Å; W512-V514 HydrophobicContact CZ3-CG2 4.13Å; V514-M520 HydrophobicContact CG1-CE 4.12Å; V514-R558 HydrophobicContact CB-CG 3.71Å; V514-R558 HydrophobicContact CG1-CB 4.46Å; V514-R558 HydrophobicContact CG1-CG 3.79Å; V514-R558 PolarHBondContact O-NE 3.36Å; V514-I561 HydrophobicContact CG1-CB 4.03Å; V514-I561 HydrophobicContact CG1-CD1 4.21Å; V514-I561 HydrophobicContact CG1-CG2 3.87Å; V514-I561 HydrophobicContact CG2-CB 4.44Å; V514-I561 HydrophobicContact CG2-CG2 4.04Å; V514-E562 HydrophobicContact CG2-CB 3.89Å
515	A	87.1	Confident	72.1	Confident	6 Å²	6	74.1 Å²	74.1	5%	0.05	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-46.8	152.9	-177.1	0	0	0	0	0	114.8	L394 E519	L394-A515 HydrophobicContact CB-CB 3.91Å; L394-A515 HydrophobicContact CD2-CB 3.86Å; L394-A515 HydrophobicContact CG-CB 4.46Å; L394-A515 VanDerWaalsContact O-CB 3.26Å; L394-A515 WeakPolarHBondContact O-CB 3.39Å; L394-A515 PolarHBondContact O-N 3.38Å; A515-E519 WeakPolarHBondContact CA-OE2 3.28Å; A515-E519 HydrophobicContact CB-CB 3.8Å; A515-E519 WeakPolarHBondContact CB-OE2 3.49Å
516	G	88.1	Confident	74.1	Confident	31 Å²	31	68.7 Å²	68.7	32%	0.32	32%	0.315	S	S	.	.	P	Polyproline II helix	trans	-79.4	164.6	174.4	0	0	0	0	0	113	R518 E519 M520	G516-R518 PolarHBondContact O-N 2.7Å; G516-E519 PolarHBondContact N-OE2 3.1Å; G516-E519 WeakPolarHBondContact O-CB 3.42Å; G516-E519 PolarHBondContact O-N 3.25Å; G516-M520 PolarHBondContact O-N 2.95Å
517	R	89.3	Confident	76.2	Confident	95 Å²	95	60.6 Å²	60.6	36%	0.358	28%	0.277	S	S	.	.	H	α-helix	trans	-47.2	-39.8	177.7	-179.9	178.2	178.8	-148.7	-4.6	113.9	M520 L521 R546 L549 G550 A554	R517-M520 PolarHBondContact O-N 3.27Å; R517-L521 HydrophobicContact CG-CD1 4.05Å; R517-L521 HydrophobicContact CG-CG 4.38Å; R517-L521 WeakPolarHBondContact O-CB 3.36Å; R517-L521 VanDerWaalsContact O-CG 3.29Å; R517-L521 WeakPolarHBondContact O-CG 3.19Å; R517-L521 PolarHBondContact O-N 3Å; R517-R546 PolarHBondContact NH2-O 3.21Å; R517-L549 PolarHBondContact NE-O 3.01Å; R517-L549 PolarHBondContact NH2-O 2.9Å; R517-G550 WeakPolarHBondContact CD-O 3.4Å; R517-G550 VanDerWaalsContact NE-C 3.33Å; R517-G550 PolarHBondContact NE-O 3.14Å; R517-A554 HydrophobicContact CB-CB 3.67Å; R517-A554 HydrophobicContact CG-CB 3.78Å
518	R	85.6	Confident	77.3	Confident	185 Å²	185	55.3 Å²	55.3	70%	0.698	27%	0.265	S	S	*	.	H	α-helix	trans	-61.1	-44.8	178.8	-176.6	-174.2	-67.8	177.2	-1.2	111.9	G516 H522	G516-R518 PolarHBondContact O-N 2.7Å; R518-H522 WeakPolarHBondContact O-CB 3.28Å; R518-H522 PolarHBondContact O-N 3.13Å; R518-H522 VanDerWaalsContact O-N 3.09Å
519	E	85.8	Confident	77.7	Confident	102 Å²	102	52.4 Å²	52.4	48%	0.477	25%	0.248	S	C	.	.	H	α-helix	trans	-73	-38.3	179.9	-69.6	157.2	163.6	0	0	110.5	A515 G516 H522 I523	A515-E519 WeakPolarHBondContact CA-OE2 3.28Å; A515-E519 HydrophobicContact CB-CB 3.8Å; A515-E519 WeakPolarHBondContact CB-OE2 3.49Å; G516-E519 PolarHBondContact N-OE2 3.1Å; G516-E519 WeakPolarHBondContact O-CB 3.42Å; G516-E519 PolarHBondContact O-N 3.25Å; E519-H522 PolarHBondContact O-N 3.45Å; E519-I523 WeakPolarHBondContact O-CB 3.25Å; E519-I523 WeakPolarHBondContact O-CG1 3.39Å; E519-I523 PolarHBondContact O-N 3.45Å
520	M	90	Very high	77.6	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-59.7	-45.9	171.3	-65.9	178.7	169.9	0	0	112.3	L394 V514 G516 R517 H522 L524 L549 A554 L557 R558 I561	L394-M520 HydrophobicContact CD1-CG 4.18Å; L394-M520 HydrophobicContact CD2-CG 4.37Å; V514-M520 HydrophobicContact CG1-CE 4.12Å; G516-M520 PolarHBondContact O-N 2.95Å; R517-M520 PolarHBondContact O-N 3.27Å; M520-H522 VanDerWaalsContact C-N 3.29Å; M520-H522 PolarHBondContact O-N 2.87Å; M520-L524 HydrophobicContact CB-CD1 4.45Å; M520-L524 VanDerWaalsContact O-CB 3.23Å; M520-L524 WeakPolarHBondContact O-CB 3.45Å; M520-L524 PolarHBondContact O-N 2.96Å; M520-L549 HydrophobicContact CB-CD2 4.04Å; M520-A554 HydrophobicContact SD-CB 3.95Å; M520-L557 HydrophobicContact CE-CB 4.33Å; M520-L557 HydrophobicContact SD-CB 4.46Å; M520-R558 HydrophobicContact CE-CB 3.81Å; M520-R558 HydrophobicContact CE-CG 4.33Å; M520-I561 HydrophobicContact CE-CD1 4.19Å
521	L	86.2	Confident	76.6	Confident	1 Å²	1	52 Å²	52	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-60	-39.8	174.8	-74.1	169.3	0	0	0	111.7	R517 L525 G526 L527 H529 R546 L549	R517-L521 HydrophobicContact CG-CD1 4.05Å; R517-L521 HydrophobicContact CG-CG 4.38Å; R517-L521 WeakPolarHBondContact O-CB 3.36Å; R517-L521 VanDerWaalsContact O-CG 3.29Å; R517-L521 WeakPolarHBondContact O-CG 3.19Å; R517-L521 PolarHBondContact O-N 3Å; L521-L525 HydrophobicContact CD2-CD1 3.81Å; L521-L525 CarbonylContact O-C 3.56Å; L521-L525 WeakPolarHBondContact O-CA 3.5Å; L521-L525 VanDerWaalsContact O-CB 3.3Å; L521-L525 WeakPolarHBondContact O-CB 3.49Å; L521-L525 PolarHBondContact O-N 3.06Å; L521-G526 PolarHBondContact O-N 3.48Å; L521-G526 VanDerWaalsContact O-N 3.11Å; L521-L527 PolarHBondContact O-N 3.37Å; L521-H529 WeakPolarHBondContact CD1-NE2 3.41Å; L521-R546 HydrophobicContact CD2-CB 4.32Å; L521-R546 HydrophobicContact CD2-CG 4.34Å; L521-L549 HydrophobicContact CD2-CB 3.97Å; L521-L549 HydrophobicContact CD2-CD2 4Å; L521-L549 HydrophobicContact CD2-CG 4.2Å; L521-L549 HydrophobicContact CG-CD2 4.31Å
522	H	82.9	Confident	75.3	Confident	73 Å²	73	55.8 Å²	55.8	34%	0.338	30%	0.299	S	S	.	.	H	α-helix	trans	-75.3	-41.8	-178.7	-165.3	-140.5	0	0	0	113.2	R518 E519 M520 G526	R518-H522 WeakPolarHBondContact O-CB 3.28Å; R518-H522 PolarHBondContact O-N 3.13Å; R518-H522 VanDerWaalsContact O-N 3.09Å; E519-H522 PolarHBondContact O-N 3.45Å; M520-H522 VanDerWaalsContact C-N 3.29Å; M520-H522 PolarHBondContact O-N 2.87Å; H522-G526 WeakPolarHBondContact O-CA 3.35Å; H522-G526 PolarHBondContact O-N 3.09Å; H522-G526 VanDerWaalsContact O-N 3.09Å
523	I	83.3	Confident	73.6	Confident	24 Å²	24	57.6 Å²	57.6	12%	0.123	32%	0.32	C	S	.	.	H	α-helix	trans	-85.8	-44.9	-175.4	-68.8	165.5	0	0	0	111.8	G329 K332 M390 L394 E519	G329-I523 WeakPolarHBondContact CA-O 3.48Å; K332-I523 HydrophobicContact CG-CG2 4.11Å; M390-I523 WeakPolarHBondContact CE-O 3.4Å; L394-I523 HydrophobicContact CD2-CB 3.85Å; L394-I523 HydrophobicContact CD2-CD1 3.79Å; L394-I523 HydrophobicContact CD2-CG1 4.41Å; L394-I523 HydrophobicContact CD2-CG2 3.85Å; E519-I523 WeakPolarHBondContact O-CB 3.25Å; E519-I523 WeakPolarHBondContact O-CG1 3.39Å; E519-I523 PolarHBondContact O-N 3.45Å
524	L	86.1	Confident	71.4	Confident	1 Å²	1	60.1 Å²	60.1	1%	0.005	35%	0.346	C	S	.	.	H	α-helix	trans	-80.2	-38.4	-178.9	-56	-177.1	0	0	0	111.8	F381 V386 M390 L391 L394 M520	F381-L524 HydrophobicContact CE1-CD1 4.06Å; F381-L524 HydrophobicContact CE2-CD1 4.48Å; F381-L524 HydrophobicContact CZ-CD1 3.65Å; V386-L524 HydrophobicContact CG1-CD2 3.85Å; M390-L524 HydrophobicContact CB-CD2 4.29Å; M390-L524 HydrophobicContact CE-CD2 4.47Å; L391-L524 HydrophobicContact CD2-CD2 4.37Å; L394-L524 HydrophobicContact CD1-CD1 3.92Å; L394-L524 HydrophobicContact CD1-CD2 3.87Å; L394-L524 HydrophobicContact CD1-CG 3.97Å; L394-L524 HydrophobicContact CG-CD2 4.46Å; M520-L524 HydrophobicContact CB-CD1 4.45Å; M520-L524 VanDerWaalsContact O-CB 3.23Å; M520-L524 WeakPolarHBondContact O-CB 3.45Å; M520-L524 PolarHBondContact O-N 2.96Å
525	L	81.9	Confident	69.2	Low	1 Å²	1	63.7 Å²	63.7	1%	0.005	37%	0.371	C	S	.	.	S	Bend	trans	-108.8	-14.2	-173	-43.5	-170.3	0	0	0	113.6	I380 F381 R384 L521 L527 L541 L549	I380-L525 HydrophobicContact CB-CD2 4.3Å; I380-L525 HydrophobicContact CG2-CD1 4.06Å; I380-L525 HydrophobicContact CG2-CD2 3.5Å; I380-L525 HydrophobicContact CG2-CG 4.29Å; F381-L525 HydrophobicContact CE2-CD2 4.47Å; R384-L525 PolarHBondContact NE-O 2.85Å; R384-L525 PolarHBondContact NH2-O 3.2Å; L521-L525 HydrophobicContact CD2-CD1 3.81Å; L521-L525 CarbonylContact O-C 3.56Å; L521-L525 WeakPolarHBondContact O-CA 3.5Å; L521-L525 VanDerWaalsContact O-CB 3.3Å; L521-L525 WeakPolarHBondContact O-CB 3.49Å; L521-L525 PolarHBondContact O-N 3.06Å; L525-L527 HydrophobicContact CB-CB 4.43Å; L525-L527 HydrophobicContact CB-CD1 3.76Å; L525-L527 HydrophobicContact CB-CG 3.8Å; L525-L527 HydrophobicContact CD1-CD1 3.91Å; L525-L527 PolarHBondContact O-N 2.84Å; L525-L541 HydrophobicContact CB-CD1 4.29Å; L525-L549 HydrophobicContact CD1-CB 4.34Å; L525-L549 HydrophobicContact CD1-CD2 4.38Å
526	G	74.7	Confident	66.8	Low	12 Å²	12	69.5 Å²	69.5	12%	0.124	41%	0.411	C	S	.	.			trans	71.6	9.4	-173.2	0	0	0	0	0	114.6	L521 H522 S528	L521-G526 PolarHBondContact O-N 3.48Å; L521-G526 VanDerWaalsContact O-N 3.11Å; H522-G526 WeakPolarHBondContact O-CA 3.35Å; H522-G526 PolarHBondContact O-N 3.09Å; H522-G526 VanDerWaalsContact O-N 3.09Å; G526-S528 PolarHBondContact O-N 3.27Å
527	L	73	Confident	64.3	Low	14 Å²	14	72.4 Å²	72.4	7%	0.073	43%	0.426	C	S	.	.			trans	-87.8	103.2	-171.4	-60.9	174.5	0	0	0	110	L521 L525 R546	L521-L527 PolarHBondContact O-N 3.37Å; L525-L527 HydrophobicContact CB-CB 4.43Å; L525-L527 HydrophobicContact CB-CD1 3.76Å; L525-L527 HydrophobicContact CB-CG 3.8Å; L525-L527 HydrophobicContact CD1-CD1 3.91Å; L525-L527 PolarHBondContact O-N 2.84Å; L527-R546 HydrophobicContact CB-CG 4.01Å; L527-R546 HydrophobicContact CD1-CG 3.53Å; L527-R546 HydrophobicContact CG-CG 4.32Å
528	S	62.2	Low	61.9	Low	57 Å²	57	70.3 Å²	70.3	40%	0.399	43%	0.434	S	S	.	.			trans	-73.6	162.8	173.9	72.2	0	0	0	0	111.8	G526 T530	G526-S528 PolarHBondContact O-N 3.27Å; S528-T530 PolarHBondContact OG-OG1 2.73Å
529	H	51.7	Low	60.2	Low	97 Å²	97	64 Å²	64	45%	0.449	42%	0.422	S	S	.	.			trans	-105.2	12.3	-178.1	-81.9	-82.7	0	0	0	113.8	L521	L521-H529 WeakPolarHBondContact CD1-NE2 3.41Å
530	T	44.7	Very low	58.8	Low	119 Å²	119	65.3 Å²	65.3	73%	0.73	43%	0.432	S	S	*	.			trans	-78.4	129.8	176.6	44.5	0	0	0	0	111	S528	S528-T530 PolarHBondContact OG-OG1 2.73Å
531	S	40.8	Very low	57.7	Low	101 Å²	101	66 Å²	66	71%	0.706	44%	0.436	S	S	*	.			trans	-70.1	155	-172.6	-47.6	0	0	0	0	114	S533	S531-S533 PolarHBondContact O-N 3.34Å
532	S	42.9	Very low	56.9	Low	126 Å²	126	69 Å²	69	88%	0.881	46%	0.457	S	S	*	.			trans	59.2	41.6	145.9	61.2	0	0	0	0	119.3
533	S	38.9	Very low	56.2	Low	88 Å²	88	69.6 Å²	69.6	62%	0.615	46%	0.462	S	S	*	.			trans	-121.7	118	156.3	64.5	0	0	0	0	111.2	S531 S535	S531-S533 PolarHBondContact O-N 3.34Å; S533-S535 PolarHBondContact O-N 3.49Å; S533-S535 PolarHBondContact OG-OG 2.84Å; S533-S535 VanDerWaalsContact OG-OG 3.1Å
534	S	38.9	Very low	55.5	Low	130 Å²	130	73 Å²	73	91%	0.909	48%	0.48	S	S	*	.			trans	-76.7	38.1	173	53	0	0	0	0	112.1	S536	S534-S536 PolarHBondContact O-N 3.45Å
535	S	38.7	Very low	55	Low	75 Å²	75	73.7 Å²	73.7	52%	0.524	49%	0.485	S	S	.	.			trans	-84.7	94	-179.2	48.5	0	0	0	0	109.4	S533 S537	S533-S535 PolarHBondContact O-N 3.49Å; S533-S535 PolarHBondContact OG-OG 2.84Å; S533-S535 VanDerWaalsContact OG-OG 3.1Å; S535-S537 PolarHBondContact O-N 3.26Å
536	S	36.1	Very low	54.8	Low	127 Å²	127	76.5 Å²	76.5	89%	0.888	50%	0.496	S	S	*	.			trans	-73.1	47.6	-177.5	58.9	0	0	0	0	113.9	S534	S534-S536 PolarHBondContact O-N 3.45Å
537	S	35.6	Very low	55.1	Low	92 Å²	92	83.8 Å²	83.8	64%	0.643	52%	0.52	S	S	*	.			trans	-100.5	88.6	-175.9	61.9	0	0	0	0	112.6	S535	S535-S537 PolarHBondContact O-N 3.26Å
538	G	40.6	Very low	55.5	Low	51 Å²	51	86.6 Å²	86.6	53%	0.526	54%	0.535	S	S	.	.	S	Bend	trans	93.9	9.1	147.2	0	0	0	0	0	119.6
539	A	48.9	Very low	56.7	Low	53 Å²	53	83.9 Å²	83.9	44%	0.438	52%	0.516	S	S	.	.			trans	-106	116.8	176.4	0	0	0	0	0	112.2	L541	A539-L541 PolarHBondContact O-N 3.18Å
540	D	56.6	Low	58.5	Low	129 Å²	129	79.8 Å²	79.8	69%	0.69	50%	0.5	S	S	*	.	S	Bend	trans	-64.1	1.7	174.6	-67.7	-36	0	0	0	114.5	I383	I383-D540 HydrophobicContact CG2-CB 3.84Å
541	L	67.6	Low	60.6	Low	15 Å²	15	80.8 Å²	80.8	8%	0.079	49%	0.494	C	S	.	.	S	Bend	trans	-116	123.6	-176.1	-65.4	179.7	0	0	0	110.7	I380 I383 R384 L525 A539	I380-L541 HydrophobicContact CG2-CD1 3.53Å; I380-L541 HydrophobicContact CG2-CD2 3.7Å; I380-L541 HydrophobicContact CG2-CG 4.26Å; I383-L541 HydrophobicContact CB-CD2 4.24Å; I383-L541 HydrophobicContact CD1-CD2 3.81Å; I383-L541 HydrophobicContact CG2-CD2 3.96Å; I383-L541 HydrophobicContact CG2-CG 4.3Å; R384-L541 HydrophobicContact CG-CD1 3.71Å; L525-L541 HydrophobicContact CB-CD1 4.29Å; A539-L541 PolarHBondContact O-N 3.18Å
542	S	68.5	Low	63	Low	63 Å²	63	80.4 Å²	80.4	44%	0.441	48%	0.48	S	S	.	.			trans	-58.2	148.3	169.5	178	0	0	0	0	110.7	D544 S545	S542-D544 PolarHBondContact O-N 2.93Å; S542-D544 PolarHBondContact OG-N 2.69Å; S542-D544 VanDerWaalsContact OG-N 3.15Å; S542-D544 PolarHBondContact OG-OD2 2.95Å; S542-S545 VanDerWaalsContact O-CB 3.26Å; S542-S545 WeakPolarHBondContact O-CB 3.34Å; S542-S545 PolarHBondContact O-N 3.38Å; S542-S545 PolarHBondContact O-OG 3.35Å
543	I	69.4	Low	65.3	Low	87 Å²	87	75.9 Å²	75.9	45%	0.446	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-20.2	169.7	-163	61.1	0	0	0	113	S545 R546	I543-S545 VanDerWaalsContact C-N 3.33Å; I543-R546 WeakPolarHBondContact O-CB 3.34Å; I543-R546 WeakPolarHBondContact O-CG 3.45Å; I543-R546 PolarHBondContact O-N 3.04Å; I543-R546 PolarHBondContact O-NE 3.46Å; I543-R546 VanDerWaalsContact O-NE 3.08Å
544	D	67.9	Low	67.9	Low	94 Å²	94	72 Å²	72	50%	0.503	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-20.9	175	-57.1	-49.3	0	0	0	113.4	S542 R546 Y547	S542-D544 PolarHBondContact O-N 2.93Å; S542-D544 PolarHBondContact OG-N 2.69Å; S542-D544 VanDerWaalsContact OG-N 3.15Å; S542-D544 PolarHBondContact OG-OD2 2.95Å; D544-R546 PolarHBondContact O-N 3.04Å; D544-Y547 HydrophobicContact CB-CD2 4.16Å; D544-Y547 HydrophobicContact CB-CE2 4.46Å; D544-Y547 WeakPolarHBondContact O-CB 3.38Å; D544-Y547 VanDerWaalsContact O-CD2 3.26Å; D544-Y547 WeakPolarHBondContact O-CD2 3.49Å; D544-Y547 PolarHBondContact O-N 3.21Å
545	S	75.3	Confident	70.5	Confident	16 Å²	16	68.2 Å²	68.2	11%	0.112	39%	0.385	C	S	.	.	H	α-helix	trans	-59	-19.2	173.5	-60.5	0	0	0	0	112.6	S542 I543 Y547 L548	S542-S545 VanDerWaalsContact O-CB 3.26Å; S542-S545 WeakPolarHBondContact O-CB 3.34Å; S542-S545 PolarHBondContact O-N 3.38Å; S542-S545 PolarHBondContact O-OG 3.35Å; I543-S545 VanDerWaalsContact C-N 3.33Å; S545-Y547 PolarHBondContact O-N 3.13Å; S545-L548 PolarHBondContact O-N 3.1Å
546	R	77.9	Confident	73.2	Confident	61 Å²	61	64.6 Å²	64.6	23%	0.23	36%	0.361	C	S	.	.	H	α-helix	trans	-63.5	-22.4	171.2	-60.1	-174.7	-59.8	177.9	5.9	113.9	R517 L521 L527 I543 D544	R517-R546 PolarHBondContact NH2-O 3.21Å; L521-R546 HydrophobicContact CD2-CB 4.32Å; L521-R546 HydrophobicContact CD2-CG 4.34Å; L527-R546 HydrophobicContact CB-CG 4.01Å; L527-R546 HydrophobicContact CD1-CG 3.53Å; L527-R546 HydrophobicContact CG-CG 4.32Å; I543-R546 WeakPolarHBondContact O-CB 3.34Å; I543-R546 WeakPolarHBondContact O-CG 3.45Å; I543-R546 PolarHBondContact O-N 3.04Å; I543-R546 PolarHBondContact O-NE 3.46Å; I543-R546 VanDerWaalsContact O-NE 3.08Å; D544-R546 PolarHBondContact O-N 3.04Å
547	Y	80.4	Confident	76	Confident	164 Å²	164	58.6 Å²	58.6	64%	0.643	32%	0.318	S	S	*	.	H	α-helix	trans	-79.6	-29.1	177.4	-60.8	-62.9	0	0	0	112.4	D544 S545	D544-Y547 HydrophobicContact CB-CD2 4.16Å; D544-Y547 HydrophobicContact CB-CE2 4.46Å; D544-Y547 WeakPolarHBondContact O-CB 3.38Å; D544-Y547 VanDerWaalsContact O-CD2 3.26Å; D544-Y547 WeakPolarHBondContact O-CD2 3.49Å; D544-Y547 PolarHBondContact O-N 3.21Å; S545-Y547 PolarHBondContact O-N 3.13Å
548	L	82.8	Confident	78.8	Confident	73 Å²	73	58.3 Å²	58.3	38%	0.382	30%	0.303	S	S	.	.	H	α-helix	trans	-67.8	-44.2	177.1	-62.9	173.2	0	0	0	111.2	L377 I380 S545 G550	L377-L548 HydrophobicContact CD2-CB 4.15Å; L377-L548 WeakPolarHBondContact CD2-O 3.49Å; I380-L548 HydrophobicContact CD1-CB 3.63Å; I380-L548 HydrophobicContact CD1-CD1 3.57Å; I380-L548 HydrophobicContact CD1-CG 4.22Å; I380-L548 HydrophobicContact CG1-CD1 4.04Å; S545-L548 PolarHBondContact O-N 3.1Å; L548-G550 VanDerWaalsContact C-N 3.27Å; L548-G550 PolarHBondContact O-N 3.45Å; L548-G550 VanDerWaalsContact O-N 3.09Å
549	L	87.1	Confident	81.3	Confident	1 Å²	1	56 Å²	56	1%	0.005	28%	0.279	C	S	.	.	S	Bend	trans	-84.3	72.3	167.3	-175.5	54.1	0	0	0	110.1	L377 R517 M520 L521 L525 E553 A554 L557	L377-L549 HydrophobicContact CD1-CD1 4.22Å; L377-L549 HydrophobicContact CD2-CB 4.22Å; R517-L549 PolarHBondContact NE-O 3.01Å; R517-L549 PolarHBondContact NH2-O 2.9Å; M520-L549 HydrophobicContact CB-CD2 4.04Å; L521-L549 HydrophobicContact CD2-CB 3.97Å; L521-L549 HydrophobicContact CD2-CD2 4Å; L521-L549 HydrophobicContact CD2-CG 4.2Å; L521-L549 HydrophobicContact CG-CD2 4.31Å; L525-L549 HydrophobicContact CD1-CB 4.34Å; L525-L549 HydrophobicContact CD1-CD2 4.38Å; L549-E553 HydrophobicContact CD1-CB 4.08Å; L549-A554 HydrophobicContact CD1-CB 4.05Å; L549-L557 HydrophobicContact CD1-CD1 3.66Å
550	G	88.1	Confident	83.6	Confident	10 Å²	10	53.6 Å²	53.6	10%	0.103	26%	0.259	C	S	.	.			trans	-71	-174.9	175.7	0	0	0	0	0	113.6	R517 L548 E553 A554	R517-G550 WeakPolarHBondContact CD-O 3.4Å; R517-G550 VanDerWaalsContact NE-C 3.33Å; R517-G550 PolarHBondContact NE-O 3.14Å; L548-G550 VanDerWaalsContact C-N 3.27Å; L548-G550 PolarHBondContact O-N 3.45Å; L548-G550 VanDerWaalsContact O-N 3.09Å; G550-E553 WeakPolarHBondContact CA-OE2 3.49Å; G550-E553 PolarHBondContact N-OE2 2.93Å; G550-E553 VanDerWaalsContact N-OE2 3.14Å; G550-A554 VanDerWaalsContact O-CB 3.32Å; G550-A554 WeakPolarHBondContact O-CB 3.43Å; G550-A554 PolarHBondContact O-N 3.22Å; G550-A554 VanDerWaalsContact O-N 3.12Å
551	K	89.1	Confident	85.4	Confident	141 Å²	141	47.5 Å²	47.5	61%	0.613	23%	0.226	S	C	*	.	H	α-helix	trans	-65.1	-45.2	177.2	178.2	-179.5	165.2	-177.5	0	110.8	E553 A554 E555	K551-E553 VanDerWaalsContact C-N 3.3Å; K551-E553 PolarHBondContact O-N 2.9Å; K551-A554 PolarHBondContact O-N 3.25Å; K551-E555 WeakPolarHBondContact CE-OE1 3.41Å; K551-E555 IonicContact NZ-OE1 3.25Å; K551-E555 WeakPolarHBondContact O-CG 3.43Å; K551-E555 PolarHBondContact O-N 3.07Å
552	K	91	Very high	86.7	Confident	92 Å²	92	47.1 Å²	47.1	40%	0.4	22%	0.224	S	C	.	.	H	α-helix	trans	-61.2	-37.8	-178.6	-87.8	-172.5	177.3	-169.5	0	112.4	S556 K635 R636	K552-S556 PolarHBondContact O-N 2.93Å; K552-K635 PolarHBondContact NZ-O 2.94Å; K552-R636 PolarHBondContact O-NH1 3.47Å; K552-R636 PolarHBondContact O-NH2 2.83Å
553	E	92.8	Very high	87.9	Confident	32 Å²	32	44.6 Å²	44.6	15%	0.15	21%	0.206	C	C	.	.	H	α-helix	trans	-81.8	-37.7	-175.7	-60	67.7	-146.9	0	0	109.8	L374 L549 G550 K551 S556 L557	L374-E553 HydrophobicContact CD2-CB 4.2Å; L374-E553 HydrophobicContact CD2-CG 4.12Å; L549-E553 HydrophobicContact CD1-CB 4.08Å; G550-E553 WeakPolarHBondContact CA-OE2 3.49Å; G550-E553 PolarHBondContact N-OE2 2.93Å; G550-E553 VanDerWaalsContact N-OE2 3.14Å; K551-E553 VanDerWaalsContact C-N 3.3Å; K551-E553 PolarHBondContact O-N 2.9Å; E553-S556 PolarHBondContact O-N 3.44Å; E553-L557 PolarHBondContact O-N 2.8Å
554	A	92.8	Very high	89.1	Confident	5 Å²	5	40.7 Å²	40.7	4%	0.041	19%	0.185	C	C	.	.	H	α-helix	trans	-66	-36	172	0	0	0	0	0	112.8	R517 M520 L549 G550 K551 R558	R517-A554 HydrophobicContact CB-CB 3.67Å; R517-A554 HydrophobicContact CG-CB 3.78Å; M520-A554 HydrophobicContact SD-CB 3.95Å; L549-A554 HydrophobicContact CD1-CB 4.05Å; G550-A554 VanDerWaalsContact O-CB 3.32Å; G550-A554 WeakPolarHBondContact O-CB 3.43Å; G550-A554 PolarHBondContact O-N 3.22Å; G550-A554 VanDerWaalsContact O-N 3.12Å; K551-A554 PolarHBondContact O-N 3.25Å; A554-R558 WeakPolarHBondContact O-CB 3.46Å; A554-R558 PolarHBondContact O-N 2.94Å
555	E	93.1	Very high	90.3	Very high	51 Å²	51	38.7 Å²	38.7	24%	0.238	17%	0.173	C	C	.	.	H	α-helix	trans	-63.4	-44.6	173.5	-75.9	163.4	167.2	0	0	111.7	K551 R558 T559 Y621	K551-E555 WeakPolarHBondContact CE-OE1 3.41Å; K551-E555 IonicContact NZ-OE1 3.25Å; K551-E555 WeakPolarHBondContact O-CG 3.43Å; K551-E555 PolarHBondContact O-N 3.07Å; E555-R558 WeakPolarHBondContact O-CB 3.34Å; E555-R558 PolarHBondContact O-N 3.08Å; E555-T559 PolarHBondContact O-N 3.5Å; E555-T559 PolarHBondContact O-OG1 3.47Å; E555-Y621 HydrophobicContact CB-CE2 4Å
556	S	95	Very high	91	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-62.3	-49.8	174.5	170.2	0	0	0	0	112.5	K552 E553 R558 T559 A560 G616 H618	K552-S556 PolarHBondContact O-N 2.93Å; E553-S556 PolarHBondContact O-N 3.44Å; S556-R558 PolarHBondContact O-N 2.96Å; S556-T559 PolarHBondContact O-N 3.07Å; S556-T559 PolarHBondContact O-OG1 3.18Å; S556-A560 PolarHBondContact O-N 3.13Å; S556-A560 VanDerWaalsContact O-N 3.09Å; S556-G616 WeakPolarHBondContact CB-O 3.39Å; S556-G616 PolarHBondContact OG-O 3.29Å; S556-H618 PolarHBondContact O-CE1 3.01Å; S556-H618 VanDerWaalsContact O-CE1 3.23Å; S556-H618 PolarHBondContact OG-CE1 3.17Å; S556-H618 PolarHBondContact OG-ND1 2.88Å
557	L	95.4	Very high	91.5	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-60.4	-34.6	175.3	-80.1	171.1	0	0	0	112.6	W367 L368 L372 L374 L377 F381 M520 L549 E553 A560 I561	W367-L557 HydrophobicContact CH2-CD2 4.01Å; W367-L557 HydrophobicContact CZ3-CD2 4.06Å; L368-L557 HydrophobicContact CD2-CD2 3.99Å; L372-L557 HydrophobicContact CD1-CD2 3.84Å; L374-L557 HydrophobicContact CD1-CD1 4.47Å; L374-L557 HydrophobicContact CD1-CD2 3.87Å; L374-L557 HydrophobicContact CD1-CG 3.69Å; L377-L557 HydrophobicContact CD1-CD1 3.61Å; L377-L557 HydrophobicContact CD1-CG 4.35Å; F381-L557 HydrophobicContact CZ-CD1 3.93Å; F381-L557 HydrophobicContact CZ-CD2 4.45Å; M520-L557 HydrophobicContact CE-CB 4.33Å; M520-L557 HydrophobicContact SD-CB 4.46Å; L549-L557 HydrophobicContact CD1-CD1 3.66Å; E553-L557 PolarHBondContact O-N 2.8Å; L557-A560 PolarHBondContact O-N 2.97Å; L557-I561 WeakPolarHBondContact O-CD1 3.25Å; L557-I561 VanDerWaalsContact O-CG1 3.27Å; L557-I561 WeakPolarHBondContact O-CG1 3.43Å; L557-I561 PolarHBondContact O-N 3.22Å
558	R	94.1	Very high	92	Very high	87 Å²	87	37.7 Å²	37.7	33%	0.328	18%	0.179	S	C	.	.	H	α-helix	trans	-61.7	-47.8	-179.9	-169.8	177.2	167.8	-95.3	-19	111.2	V514 M520 A554 E555 S556 E562	V514-R558 HydrophobicContact CB-CG 3.71Å; V514-R558 HydrophobicContact CG1-CB 4.46Å; V514-R558 HydrophobicContact CG1-CG 3.79Å; V514-R558 PolarHBondContact O-NE 3.36Å; M520-R558 HydrophobicContact CE-CB 3.81Å; M520-R558 HydrophobicContact CE-CG 4.33Å; A554-R558 WeakPolarHBondContact O-CB 3.46Å; A554-R558 PolarHBondContact O-N 2.94Å; E555-R558 WeakPolarHBondContact O-CB 3.34Å; E555-R558 PolarHBondContact O-N 3.08Å; S556-R558 PolarHBondContact O-N 2.96Å; R558-E562 WeakPolarHBondContact O-CB 3.42Å; R558-E562 PolarHBondContact O-N 2.99Å; R558-E562 VanDerWaalsContact O-N 3.1Å
559	T	94.7	Very high	92.4	Very high	3 Å²	3	34.5 Å²	34.5	2%	0.018	16%	0.162	C	C	.	.	H	α-helix	trans	-69.3	-33.4	177.2	50.7	0	0	0	0	112.6	E555 S556 E562 L563 Y621 L624 D625	E555-T559 PolarHBondContact O-N 3.5Å; E555-T559 PolarHBondContact O-OG1 3.47Å; S556-T559 PolarHBondContact O-N 3.07Å; S556-T559 PolarHBondContact O-OG1 3.18Å; T559-E562 PolarHBondContact O-N 2.93Å; T559-L563 PolarHBondContact O-N 3.27Å; T559-Y621 HydrophobicContact CG2-CD2 4.28Å; T559-Y621 WeakPolarHBondContact OG1-CA 3.5Å; T559-Y621 WeakPolarHBondContact OG1-CB 3.48Å; T559-Y621 PolarHBondContact OG1-N 2.94Å; T559-L624 HydrophobicContact CG2-CB 4.02Å; T559-D625 HydrophobicContact CG2-CB 4.12Å
560	A	96	Very high	92.6	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.008	17%	0.17	C	C	.	.	H	α-helix	trans	-65.1	-42.4	175.6	0	0	0	0	0	112.9	W367 L372 S556 L557 E562 L563 L564	W367-A560 HydrophobicContact CH2-CB 4.35Å; W367-A560 HydrophobicContact CZ2-CB 3.62Å; L372-A560 HydrophobicContact CD1-CB 3.53Å; L372-A560 HydrophobicContact CD2-CB 3.48Å; L372-A560 VanDerWaalsContact CD2-CB 3.48Å; L372-A560 HydrophobicContact CG-CB 4.16Å; S556-A560 PolarHBondContact O-N 3.13Å; S556-A560 VanDerWaalsContact O-N 3.09Å; L557-A560 PolarHBondContact O-N 2.97Å; A560-E562 VanDerWaalsContact C-N 3.33Å; A560-L563 PolarHBondContact O-N 3.42Å; A560-L564 PolarHBondContact O-N 2.95Å; A560-L564 VanDerWaalsContact O-N 3.11Å
561	I	95.2	Very high	92.8	Very high	1 Å²	1	37.1 Å²	37.1	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-67.2	-36.6	174.3	-66.1	160.7	0	0	0	110.6	W367 L391 L394 I395 V514 M520 L557 L564 H565	W367-I561 HydrophobicContact CH2-CG1 4.07Å; W367-I561 HydrophobicContact CZ2-CG1 4.48Å; L391-I561 HydrophobicContact CD2-CD1 4.15Å; L391-I561 HydrophobicContact CD2-CG1 4.23Å; L394-I561 HydrophobicContact CD1-CD1 3.6Å; I395-I561 HydrophobicContact CD1-CG2 3.77Å; I395-I561 HydrophobicContact CG1-CG2 3.84Å; V514-I561 HydrophobicContact CG1-CB 4.03Å; V514-I561 HydrophobicContact CG1-CD1 4.21Å; V514-I561 HydrophobicContact CG1-CG2 3.87Å; V514-I561 HydrophobicContact CG2-CB 4.44Å; V514-I561 HydrophobicContact CG2-CG2 4.04Å; M520-I561 HydrophobicContact CE-CD1 4.19Å; L557-I561 WeakPolarHBondContact O-CD1 3.25Å; L557-I561 VanDerWaalsContact O-CG1 3.27Å; L557-I561 WeakPolarHBondContact O-CG1 3.43Å; L557-I561 PolarHBondContact O-N 3.22Å; I561-L564 PolarHBondContact O-N 2.7Å; I561-H565 WeakPolarHBondContact O-CB 3.48Å; I561-H565 PolarHBondContact O-N 3.4Å
562	E	93.7	Very high	92.9	Very high	8 Å²	8	36.4 Å²	36.4	4%	0.037	17%	0.172	C	C	.	.	H	α-helix	trans	-64.8	-36	174.4	143.7	155	-152.4	0	0	112.1	R510 W512 V514 R558 T559 A560 H565 H566 L624	R510-E562 IonicContact CZ-OE1 3.75Å; R510-E562 IonicContact NH1-OE1 3.85Å; R510-E562 PolarHBondContact NH1-OE1 3.27Å; W512-E562 HydrophobicContact CH2-CB 3.88Å; W512-E562 HydrophobicContact CH2-CG 3.58Å; W512-E562 WeakPolarHBondContact CH2-OE1 3.47Å; W512-E562 HydrophobicContact CZ3-CB 3.79Å; W512-E562 HydrophobicContact CZ3-CG 3.92Å; V514-E562 HydrophobicContact CG2-CB 3.89Å; R558-E562 WeakPolarHBondContact O-CB 3.42Å; R558-E562 PolarHBondContact O-N 2.99Å; R558-E562 VanDerWaalsContact O-N 3.1Å; T559-E562 PolarHBondContact O-N 2.93Å; A560-E562 VanDerWaalsContact C-N 3.33Å; E562-H565 PolarHBondContact O-N 3.17Å; E562-H566 PolarHBondContact O-N 3.34Å; E562-H566 VanDerWaalsContact O-N 3.12Å; E562-H566 PolarHBondContact O-ND1 3.2Å; E562-L624 HydrophobicContact CG-CD1 3.59Å
563	L	93.9	Very high	92.8	Very high	10 Å²	10	35 Å²	35	5%	0.052	17%	0.169	C	C	.	.	H	α-helix	trans	-65	-45	169.1	177.8	65.7	0	0	0	113.1	T559 A560 H565 H566 H567 L589 Y590 A620	T559-L563 PolarHBondContact O-N 3.27Å; A560-L563 PolarHBondContact O-N 3.42Å; L563-H565 VanDerWaalsContact C-N 3.27Å; L563-H565 PolarHBondContact O-N 3.25Å; L563-H566 PolarHBondContact O-N 3.39Å; L563-H567 PolarHBondContact O-ND1 2.68Å; L563-L589 HydrophobicContact CD1-CD1 4.14Å; L563-L589 HydrophobicContact CD1-CD2 4.23Å; L563-L589 HydrophobicContact CD1-CG 3.89Å; L563-Y590 HydrophobicContact CD1-CD1 4.42Å; L563-Y590 HydrophobicContact CD1-CE1 4.22Å; L563-A620 HydrophobicContact CB-CB 3.91Å; L563-A620 HydrophobicContact CD2-CB 4.06Å; L563-A620 HydrophobicContact CG-CB 4.47Å
564	L	94.3	Very high	92.8	Very high	4 Å²	4	33.7 Å²	33.7	2%	0.021	16%	0.163	C	C	.	.	H	α-helix	trans	-60.4	-40.4	176.8	-70.5	176.1	0	0	0	110.9	W362 W367 L391 A560 I561 H567 N568 F569 I571 I574	W362-L564 HydrophobicContact CH2-CD2 4.43Å; W367-L564 HydrophobicContact CH2-CD1 4.26Å; W367-L564 HydrophobicContact CZ2-CD1 3.54Å; W367-L564 HydrophobicContact CZ2-CG 4.34Å; L391-L564 HydrophobicContact CD1-CD1 4.09Å; A560-L564 PolarHBondContact O-N 2.95Å; A560-L564 VanDerWaalsContact O-N 3.11Å; I561-L564 PolarHBondContact O-N 2.7Å; L564-H567 CarbonylContact O-C 2.87Å; L564-H567 PolarHBondContact O-N 2.92Å; L564-N568 PolarHBondContact O-N 2.9Å; L564-F569 HydrophobicContact CB-CD1 3.75Å; L564-F569 HydrophobicContact CB-CE1 3.74Å; L564-F569 HydrophobicContact CB-CG 4.35Å; L564-F569 HydrophobicContact CB-CZ 4.33Å; L564-F569 HydrophobicContact CD1-CD1 4.12Å; L564-F569 HydrophobicContact CD1-CE1 4.02Å; L564-F569 HydrophobicContact CG-CD1 4.46Å; L564-F569 WeakPolarHBondContact O-CA 3.12Å; L564-F569 PolarHBondContact O-N 3.34Å; L564-I571 HydrophobicContact CD2-CG2 4.49Å; L564-I574 HydrophobicContact CD2-CD1 3.86Å
565	H	92.9	Very high	92.6	Very high	52 Å²	52	36.4 Å²	36.4	24%	0.241	17%	0.174	C	C	.	.	H	α-helix	trans	-65.6	-41.1	179	-174.7	-107.6	0	0	0	113.5	I395 W512 I561 E562 L563 H567 N568 F569	I395-H565 HydrophobicContact CD1-CB 3.49Å; I395-H565 VanDerWaalsContact CD1-CB 3.49Å; I395-H565 WeakPolarHBondContact CD1-CD2 3.41Å; W512-H565 AromaticContact CD1-CE1 3.49Å; W512-H565 VanDerWaalsContact CD1-CE1 3.49Å; W512-H565 AromaticContact CD2-CE1 3.74Å; W512-H565 AromaticContact CD2-ND1 3.61Å; W512-H565 AromaticContact CE2-CE1 3.7Å; W512-H565 AromaticContact CE2-ND1 3.4Å; W512-H565 AromaticContact CG-CE1 3.64Å; W512-H565 AromaticContact CZ2-ND1 3.76Å; W512-H565 AromaticContact NE1-CE1 3.5Å; W512-H565 AromaticContact NE1-ND1 3.63Å; I561-H565 WeakPolarHBondContact O-CB 3.48Å; I561-H565 PolarHBondContact O-N 3.4Å; E562-H565 PolarHBondContact O-N 3.17Å; L563-H565 VanDerWaalsContact C-N 3.27Å; L563-H565 PolarHBondContact O-N 3.25Å; H565-H567 PolarHBondContact O-N 2.91Å; H565-H567 VanDerWaalsContact O-N 3.08Å; H565-N568 PolarHBondContact O-N 3Å; H565-F569 HydrophobicContact CB-CE2 4.38Å
566	H	89.9	Confident	92.4	Very high	70 Å²	70	39.3 Å²	39.3	32%	0.324	19%	0.188	S	C	.	.	H	α-helix	trans	-56.4	-24.3	175	-76	130.4	0	0	0	113.3	W512 E562 L563	W512-H566 AromaticContact CH2-CE1 3.95Å; W512-H566 AromaticContact CH2-NE2 3.89Å; W512-H566 AromaticContact CZ2-CD2 3.95Å; W512-H566 AromaticContact CZ2-CE1 3.98Å; W512-H566 AromaticContact CZ2-NE2 3.45Å; W512-H566 WeakPolarHBondContact CZ2-NE2 3.34Å; E562-H566 PolarHBondContact O-N 3.34Å; E562-H566 VanDerWaalsContact O-N 3.12Å; E562-H566 PolarHBondContact O-ND1 3.2Å; L563-H566 PolarHBondContact O-N 3.39Å
567	H	90.2	Very high	92.1	Very high	29 Å²	29	41.5 Å²	41.5	13%	0.134	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.5	21.3	179.7	-58.8	92.7	0	0	0	112.7	L563 L564 H565 F569 N570 L573 I574 Y590	L563-H567 PolarHBondContact O-ND1 2.68Å; L564-H567 CarbonylContact O-C 2.87Å; L564-H567 PolarHBondContact O-N 2.92Å; H565-H567 PolarHBondContact O-N 2.91Å; H565-H567 VanDerWaalsContact O-N 3.08Å; H567-F569 PolarHBondContact O-N 3.15Å; H567-F569 VanDerWaalsContact O-N 3.07Å; H567-N570 VanDerWaalsContact O-CB 3.26Å; H567-N570 WeakPolarHBondContact O-CB 3.25Å; H567-N570 PolarHBondContact O-N 3.46Å; H567-L573 HydrophobicContact CB-CD2 4.34Å; H567-L573 WeakPolarHBondContact CD2-CD2 2.98Å; H567-I574 HydrophobicContact CB-CD1 3.97Å; H567-I574 HydrophobicContact CB-CG1 3.91Å; H567-Y590 AromaticContact CE1-CE1 3.52Å; H567-Y590 AromaticContact CE1-CZ 3.88Å; H567-Y590 PolarHBondContact CE1-OH 3.18Å; H567-Y590 AromaticContact NE2-CE1 3.7Å; H567-Y590 AromaticContact NE2-CZ 3.87Å; H567-Y590 PolarHBondContact NE2-OH 2.9Å; H567-Y590 VanDerWaalsContact NE2-OH 3.13Å
568	N	90.1	Very high	91.8	Very high	122 Å²	122	42.9 Å²	42.9	65%	0.652	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.5	29.6	-179.6	-64.5	20.5	0	0	0	114.2	L564 H565 N570	L564-N568 PolarHBondContact O-N 2.9Å; H565-N568 PolarHBondContact O-N 3Å; N568-N570 PolarHBondContact O-N 3.27Å
569	F	92	Very high	91.3	Very high	6 Å²	6	43 Å²	43	3%	0.026	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.5	21.4	-172.8	-63.6	-98.6	0	0	0	114.7	P355 I358 L391 I395 L564 H565 H567 I571	P355-F569 HydrophobicContact CB-CG 4.4Å; P355-F569 HydrophobicContact CG-CB 4.03Å; P355-F569 HydrophobicContact CG-CD2 3.73Å; P355-F569 HydrophobicContact CG-CE2 4.32Å; P355-F569 HydrophobicContact CG-CG 3.87Å; I358-F569 HydrophobicContact CD1-CB 3.94Å; I358-F569 HydrophobicContact CD1-CD1 3.81Å; I358-F569 HydrophobicContact CD1-CG 4.39Å; L391-F569 HydrophobicContact CB-CE1 4.11Å; I395-F569 HydrophobicContact CD1-CE2 3.91Å; I395-F569 HydrophobicContact CD1-CZ 3.73Å; L564-F569 HydrophobicContact CB-CD1 3.75Å; L564-F569 HydrophobicContact CB-CE1 3.74Å; L564-F569 HydrophobicContact CB-CG 4.35Å; L564-F569 HydrophobicContact CB-CZ 4.33Å; L564-F569 HydrophobicContact CD1-CD1 4.12Å; L564-F569 HydrophobicContact CD1-CE1 4.02Å; L564-F569 HydrophobicContact CG-CD1 4.46Å; L564-F569 WeakPolarHBondContact O-CA 3.12Å; L564-F569 PolarHBondContact O-N 3.34Å; H565-F569 HydrophobicContact CB-CE2 4.38Å; H567-F569 PolarHBondContact O-N 3.15Å; H567-F569 VanDerWaalsContact O-N 3.07Å; F569-I571 PolarHBondContact O-N 3.45Å; F569-I571 VanDerWaalsContact O-N 3.14Å
570	N	90.7	Very high	90.4	Very high	34 Å²	34	49.2 Å²	49.2	18%	0.182	25%	0.25	C	S	.	.			trans	-76.5	94.6	168.9	-173.7	-14.2	0	0	0	110.3	P353 H567 N568 E572 L573 I574	P353-N570 HydrophobicContact CB-CB 3.96Å; H567-N570 VanDerWaalsContact O-CB 3.26Å; H567-N570 WeakPolarHBondContact O-CB 3.25Å; H567-N570 PolarHBondContact O-N 3.46Å; N568-N570 PolarHBondContact O-N 3.27Å; N570-E572 PolarHBondContact OD1-N 3.34Å; N570-L573 HydrophobicContact CB-CB 4.15Å; N570-L573 PolarHBondContact OD1-N 3.46Å; N570-L573 VanDerWaalsContact OD1-N 3.08Å; N570-I574 PolarHBondContact O-N 3.1Å
571	I	91.9	Very high	88.5	Confident	32 Å²	32	51.9 Å²	51.9	16%	0.164	27%	0.269	C	S	.	.	H	α-helix	trans	-66.9	-34.9	178.8	60.1	174.8	0	0	0	112.6	I358 W362 L564 F569 L573 I574 E575	I358-I571 HydrophobicContact CD1-CG2 3.59Å; I358-I571 HydrophobicContact CG1-CG2 3.73Å; W362-I571 HydrophobicContact CD2-CD1 4.37Å; W362-I571 HydrophobicContact CH2-CB 4.31Å; W362-I571 HydrophobicContact CH2-CG2 3.55Å; W362-I571 HydrophobicContact CZ2-CB 3.95Å; W362-I571 HydrophobicContact CZ2-CD1 4.43Å; W362-I571 HydrophobicContact CZ2-CG2 3.69Å; W362-I571 HydrophobicContact CZ3-CG2 4.05Å; L564-I571 HydrophobicContact CD2-CG2 4.49Å; F569-I571 PolarHBondContact O-N 3.45Å; F569-I571 VanDerWaalsContact O-N 3.14Å; I571-L573 VanDerWaalsContact C-N 3.32Å; I571-L573 PolarHBondContact O-N 3.17Å; I571-I574 PolarHBondContact O-N 3.31Å; I571-E575 WeakPolarHBondContact O-CG 3.42Å; I571-E575 PolarHBondContact O-N 2.91Å
572	E	90.4	Very high	86.8	Confident	126 Å²	126	57.8 Å²	57.8	59%	0.589	30%	0.301	S	S	*	.	H	α-helix	trans	-63.4	-40.6	-179.3	-63.1	176	-178.7	0	0	111.1	N570 E575 Q576	N570-E572 PolarHBondContact OD1-N 3.34Å; E572-E575 PolarHBondContact O-N 3.45Å; E572-Q576 WeakPolarHBondContact O-CB 3.29Å; E572-Q576 WeakPolarHBondContact O-CG 3.4Å; E572-Q576 PolarHBondContact O-N 2.87Å
573	L	90	Very high	85.1	Confident	63 Å²	63	59.1 Å²	59.1	33%	0.33	31%	0.308	S	S	.	.	H	α-helix	trans	-64.3	-40.9	175.4	-176.9	156.7	0	0	0	111.6	H567 N570 I571 Q576 I577	H567-L573 HydrophobicContact CB-CD2 4.34Å; H567-L573 WeakPolarHBondContact CD2-CD2 2.98Å; N570-L573 HydrophobicContact CB-CB 4.15Å; N570-L573 PolarHBondContact OD1-N 3.46Å; N570-L573 VanDerWaalsContact OD1-N 3.08Å; I571-L573 VanDerWaalsContact C-N 3.32Å; I571-L573 PolarHBondContact O-N 3.17Å; L573-Q576 PolarHBondContact O-N 3.12Å; L573-I577 HydrophobicContact CD2-CD1 3.6Å; L573-I577 HydrophobicContact CD2-CG1 4.4Å; L573-I577 WeakPolarHBondContact O-CG1 3.4Å; L573-I577 PolarHBondContact O-N 3.31Å
574	I	91.6	Very high	83.4	Confident	4 Å²	4	64.4 Å²	64.4	2%	0.021	35%	0.346	C	S	.	.	H	α-helix	trans	-65.1	-43.7	176.5	-66	171.9	0	0	0	110.8	L564 H567 N570 I571 I577 R578	L564-I574 HydrophobicContact CD2-CD1 3.86Å; H567-I574 HydrophobicContact CB-CD1 3.97Å; H567-I574 HydrophobicContact CB-CG1 3.91Å; N570-I574 PolarHBondContact O-N 3.1Å; I571-I574 PolarHBondContact O-N 3.31Å; I574-I577 PolarHBondContact O-N 3.46Å; I574-R578 WeakPolarHBondContact O-CG 3.24Å; I574-R578 PolarHBondContact O-N 3.19Å
575	E	90.3	Very high	81.5	Confident	61 Å²	61	71.3 Å²	71.3	29%	0.285	38%	0.378	S	S	.	.	H	α-helix	trans	-69.7	-33.9	176.6	-58.8	-42.5	144.7	0	0	112.3	H371 I571 E572 I577 R578 A579	H371-E575 IonicContact CE1-OE1 3.92Å; H371-E575 PolarHBondContact CE1-OE1 3Å; H371-E575 IonicContact CE1-OE2 3.6Å; H371-E575 IonicContact ND1-OE1 3.34Å; H371-E575 IonicContact NE2-OE1 2.69Å; H371-E575 IonicContact NE2-OE2 3.59Å; I571-E575 WeakPolarHBondContact O-CG 3.42Å; I571-E575 PolarHBondContact O-N 2.91Å; E572-E575 PolarHBondContact O-N 3.45Å; E575-I577 VanDerWaalsContact C-N 3.32Å; E575-I577 PolarHBondContact O-N 3.35Å; E575-R578 PolarHBondContact O-N 2.66Å; E575-R578 IonicContact OE1-CZ 2.81Å; E575-R578 IonicContact OE1-NH1 3.77Å; E575-R578 PolarHBondContact OE1-NH1 3.46Å; E575-R578 WeakPolarHBondContact OE2-CD 3.42Å; E575-R578 IonicContact OE2-NH1 3.84Å; E575-R578 PolarHBondContact OE2-NH1 2.99Å; E575-A579 VanDerWaalsContact O-CB 3.25Å; E575-A579 WeakPolarHBondContact O-CB 3.32Å; E575-A579 PolarHBondContact O-N 2.99Å
576	Q	88.2	Confident	80.3	Confident	113 Å²	113	69.4 Å²	69.4	53%	0.528	37%	0.37	S	S	.	.	H	α-helix	trans	-64.1	-34.1	170.9	-77.5	174.2	16.5	0	0	112.6	E572 L573 K580	E572-Q576 WeakPolarHBondContact O-CB 3.29Å; E572-Q576 WeakPolarHBondContact O-CG 3.4Å; E572-Q576 PolarHBondContact O-N 2.87Å; L573-Q576 PolarHBondContact O-N 3.12Å; Q576-K580 WeakPolarHBondContact O-CD 3.49Å; Q576-K580 VanDerWaalsContact O-CG 3.24Å; Q576-K580 WeakPolarHBondContact O-CG 3.31Å; Q576-K580 PolarHBondContact O-N 3.25Å
577	I	87.7	Confident	80	Confident	45 Å²	45	67.4 Å²	67.4	23%	0.231	36%	0.361	C	S	.	.	H	α-helix	trans	-67.7	-43.9	171.8	-70	170	0	0	0	109.9	L573 I574 E575 K580 L586 Y590	L573-I577 HydrophobicContact CD2-CD1 3.6Å; L573-I577 HydrophobicContact CD2-CG1 4.4Å; L573-I577 WeakPolarHBondContact O-CG1 3.4Å; L573-I577 PolarHBondContact O-N 3.31Å; I574-I577 PolarHBondContact O-N 3.46Å; E575-I577 VanDerWaalsContact C-N 3.32Å; E575-I577 PolarHBondContact O-N 3.35Å; I577-K580 PolarHBondContact O-N 3.23Å; I577-L586 HydrophobicContact CG2-CD1 3.86Å; I577-L586 VanDerWaalsContact O-CD1 3.29Å; I577-L586 WeakPolarHBondContact O-CD1 2.98Å; I577-Y590 HydrophobicContact CB-CD1 4.24Å; I577-Y590 HydrophobicContact CB-CE1 4.36Å; I577-Y590 HydrophobicContact CD1-CD1 4.36Å; I577-Y590 HydrophobicContact CD1-CE1 3.64Å; I577-Y590 HydrophobicContact CG2-CD1 3.64Å; I577-Y590 HydrophobicContact CG2-CD2 3.78Å; I577-Y590 HydrophobicContact CG2-CE1 3.87Å; I577-Y590 HydrophobicContact CG2-CE2 4.02Å; I577-Y590 HydrophobicContact CG2-CG 3.6Å
578	R	90	Very high	80	Confident	29 Å²	29	66.3 Å²	66.3	11%	0.109	36%	0.356	C	S	.	.	H	α-helix	trans	-69.8	-30.7	179.7	-72.2	165.4	168.1	174.4	-5.6	114.8	H371 I574 E575 K580 Y590	H371-R578 PolarHBondContact CE1-NH1 3.32Å; H371-R578 PolarHBondContact ND1-NH1 2.75Å; H371-R578 VanDerWaalsContact ND1-NH1 3.11Å; H371-R578 PolarHBondContact NE2-NH1 3.4Å; I574-R578 WeakPolarHBondContact O-CG 3.24Å; I574-R578 PolarHBondContact O-N 3.19Å; E575-R578 PolarHBondContact O-N 2.66Å; E575-R578 IonicContact OE1-CZ 2.81Å; E575-R578 IonicContact OE1-NH1 3.77Å; E575-R578 PolarHBondContact OE1-NH1 3.46Å; E575-R578 WeakPolarHBondContact OE2-CD 3.42Å; E575-R578 IonicContact OE2-NH1 3.84Å; E575-R578 PolarHBondContact OE2-NH1 2.99Å; R578-K580 VanDerWaalsContact C-N 3.28Å; R578-Y590 PolarHBondContact NE-O 3.26Å
579	A	84.5	Confident	80.2	Confident	89 Å²	89	60.7 Å²	60.7	74%	0.736	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-15	176.3	0	0	0	0	0	112.6	E575	E575-A579 VanDerWaalsContact O-CB 3.25Å; E575-A579 WeakPolarHBondContact O-CB 3.32Å; E575-A579 PolarHBondContact O-N 2.99Å
580	K	75	Confident	80.2	Confident	134 Å²	134	61.7 Å²	61.7	58%	0.583	33%	0.33	S	S	*	.	S	Bend	trans	-83.7	134.1	173.9	-77.6	169.1	-175.2	179.1	0	110.3	Q576 I577 R578	Q576-K580 WeakPolarHBondContact O-CD 3.49Å; Q576-K580 VanDerWaalsContact O-CG 3.24Å; Q576-K580 WeakPolarHBondContact O-CG 3.31Å; Q576-K580 PolarHBondContact O-N 3.25Å; I577-K580 PolarHBondContact O-N 3.23Å; R578-K580 VanDerWaalsContact C-N 3.28Å
581	S	56.2	Low	80.4	Confident	58 Å²	58	60.8 Å²	60.8	41%	0.406	32%	0.324	S	S	.	.	S	Bend	trans	67.3	151.6	163.1	71.4	0	0	0	0	116.9	E585	S581-E585 VanDerWaalsContact CB-CB 3.44Å; S581-E585 WeakPolarHBondContact CB-OE2 3.19Å; S581-E585 VanDerWaalsContact OG-CB 3.23Å; S581-E585 WeakPolarHBondContact OG-CB 3.34Å
582	D	59.6	Low	80.5	Confident	125 Å²	125	59.7 Å²	59.7	67%	0.668	32%	0.319	S	S	*	.			trans	-56	157.7	174.8	-71.9	-59.6	0	0	0	111.6	S584 E585 L586	D582-S584 PolarHBondContact O-N 3.09Å; D582-E585 PolarHBondContact O-N 2.81Å; D582-L586 PolarHBondContact O-N 3.45Å
583	L	56.8	Low	80.7	Confident	36 Å²	36	53.7 Å²	53.7	19%	0.188	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.1	-24.8	-179.5	-71.8	178.9	0	0	0	114.5	H595 K598	L583-H595 HydrophobicContact CD2-CB 4.24Å; L583-K598 HydrophobicContact CD1-CB 4.24Å; L583-K598 HydrophobicContact CD1-CD 3.59Å; L583-K598 VanDerWaalsContact CD1-CE 3.47Å; L583-K598 HydrophobicContact CD1-CG 3.73Å
584	S	58.7	Low	80.8	Confident	121 Å²	121	53.7 Å²	53.7	85%	0.846	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-29.4	177.5	-54.7	0	0	0	0	114.2	D582	D582-S584 PolarHBondContact O-N 3.09Å
585	E	55.1	Low	80.9	Confident	149 Å²	149	55.5 Å²	55.5	70%	0.696	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.1	-27.5	-177.5	-76.5	-175	-161.4	0	0	112.5	S581 D582 D587	S581-E585 VanDerWaalsContact CB-CB 3.44Å; S581-E585 WeakPolarHBondContact CB-OE2 3.19Å; S581-E585 VanDerWaalsContact OG-CB 3.23Å; S581-E585 WeakPolarHBondContact OG-CB 3.34Å; D582-E585 PolarHBondContact O-N 2.81Å; E585-D587 PolarHBondContact O-N 3.39Å
586	L	66.8	Low	81	Confident	12 Å²	12	52.6 Å²	52.6	6%	0.063	29%	0.286	C	S	.	.	S	Bend	trans	-68.8	116.5	178.8	-174.1	66.4	0	0	0	111.8	I577 D582 L588 W591	I577-L586 HydrophobicContact CG2-CD1 3.86Å; I577-L586 VanDerWaalsContact O-CD1 3.29Å; I577-L586 WeakPolarHBondContact O-CD1 2.98Å; D582-L586 PolarHBondContact O-N 3.45Å; L586-L588 PolarHBondContact O-N 2.89Å; L586-W591 PolarHBondContact O-NE1 3.49Å
587	D	83.9	Confident	81.2	Confident	27 Å²	27	48.8 Å²	48.8	14%	0.144	27%	0.27	C	S	.	.			trans	-53.8	131.9	174.6	173.6	37.7	0	0	0	112.4	E585 L589 Y590 R663	E585-D587 PolarHBondContact O-N 3.39Å; D587-L589 PolarHBondContact O-N 2.91Å; D587-L589 VanDerWaalsContact OD2-CB 3.32Å; D587-L589 WeakPolarHBondContact OD2-CB 3.1Å; D587-Y590 HydrophobicContact CB-CD2 4.02Å; D587-Y590 HydrophobicContact CB-CE2 4.22Å; D587-Y590 PolarHBondContact O-N 3.48Å; D587-R663 IonicContact OD1-NH1 2.66Å; D587-R663 PolarHBondContact OD1-NH1 3.48Å; D587-R663 IonicContact OD2-CZ 3.37Å; D587-R663 IonicContact OD2-NH1 2.84Å; D587-R663 PolarHBondContact OD2-NH1 3.29Å; D587-R663 IonicContact OD2-NH2 2.68Å
588	L	91.5	Very high	81.3	Confident	7 Å²	7	52 Å²	52	4%	0.037	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-53.8	-26.9	-174.1	-179.4	61.3	0	0	0	112.9	L586 Y590 W591 G619 M622 V623 I656 L657 A660	L586-L588 PolarHBondContact O-N 2.89Å; L588-Y590 PolarHBondContact O-N 3.22Å; L588-W591 HydrophobicContact CD1-CB 4.34Å; L588-W591 HydrophobicContact CD1-CD2 3.5Å; L588-W591 VanDerWaalsContact CD1-CD2 3.5Å; L588-W591 HydrophobicContact CD1-CE3 3.43Å; L588-W591 VanDerWaalsContact CD1-CE3 3.43Å; L588-W591 HydrophobicContact CD1-CG 3.92Å; L588-W591 HydrophobicContact CD1-CH2 4.39Å; L588-W591 HydrophobicContact CD1-CZ2 4.44Å; L588-W591 HydrophobicContact CD1-CZ3 3.89Å; L588-W591 PolarHBondContact O-N 3.43Å; L588-G619 CarbonylContact O-C 3.59Å; L588-G619 WeakPolarHBondContact O-CA 3.27Å; L588-M622 HydrophobicContact CD1-CE 4.37Å; L588-M622 HydrophobicContact CD1-SD 4.28Å; L588-M622 HydrophobicContact CD2-CE 4.44Å; L588-V623 HydrophobicContact CB-CG2 4.01Å; L588-V623 HydrophobicContact CD2-CG2 3.9Å; L588-V623 HydrophobicContact CG-CG2 3.75Å; L588-I656 HydrophobicContact CD1-CD1 4.06Å; L588-I656 HydrophobicContact CD2-CB 4.28Å; L588-I656 HydrophobicContact CD2-CD1 4.25Å; L588-I656 HydrophobicContact CD2-CG1 3.98Å; L588-L657 HydrophobicContact CD2-CB 4.35Å; L588-L657 HydrophobicContact CD2-CD1 3.98Å; L588-A660 HydrophobicContact CB-CB 3.76Å; L588-A660 HydrophobicContact CD2-CB 4.24Å
589	L	92.9	Very high	81.4	Confident	3 Å²	3	51.6 Å²	51.6	2%	0.016	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-51.4	-38.2	174.8	-179.1	62.9	0	0	0	113.3	L563 D587 A620 V623 L624 E664	L563-L589 HydrophobicContact CD1-CD1 4.14Å; L563-L589 HydrophobicContact CD1-CD2 4.23Å; L563-L589 HydrophobicContact CD1-CG 3.89Å; D587-L589 PolarHBondContact O-N 2.91Å; D587-L589 VanDerWaalsContact OD2-CB 3.32Å; D587-L589 WeakPolarHBondContact OD2-CB 3.1Å; L589-A620 HydrophobicContact CD1-CB 4.33Å; L589-A620 PolarHBondContact O-N 3.33Å; L589-A620 VanDerWaalsContact O-N 3.12Å; L589-V623 HydrophobicContact CD1-CB 4.4Å; L589-V623 HydrophobicContact CD1-CG1 4.46Å; L589-L624 HydrophobicContact CD1-CD1 3.76Å; L589-L624 HydrophobicContact CD1-CD2 3.73Å; L589-L624 HydrophobicContact CD1-CG 3.72Å; L589-E664 HydrophobicContact CD2-CG 4.44Å
590	Y	93.5	Very high	81.8	Confident	28 Å²	28	47.4 Å²	47.4	11%	0.11	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-92	-8.5	-172.3	-60.1	-85.8	0	0	0	114	L563 H567 I577 R578 D587 L588 T592	L563-Y590 HydrophobicContact CD1-CD1 4.42Å; L563-Y590 HydrophobicContact CD1-CE1 4.22Å; H567-Y590 AromaticContact CE1-CE1 3.52Å; H567-Y590 AromaticContact CE1-CZ 3.88Å; H567-Y590 PolarHBondContact CE1-OH 3.18Å; H567-Y590 AromaticContact NE2-CE1 3.7Å; H567-Y590 AromaticContact NE2-CZ 3.87Å; H567-Y590 PolarHBondContact NE2-OH 2.9Å; H567-Y590 VanDerWaalsContact NE2-OH 3.13Å; I577-Y590 HydrophobicContact CB-CD1 4.24Å; I577-Y590 HydrophobicContact CB-CE1 4.36Å; I577-Y590 HydrophobicContact CD1-CD1 4.36Å; I577-Y590 HydrophobicContact CD1-CE1 3.64Å; I577-Y590 HydrophobicContact CG2-CD1 3.64Å; I577-Y590 HydrophobicContact CG2-CD2 3.78Å; I577-Y590 HydrophobicContact CG2-CE1 3.87Å; I577-Y590 HydrophobicContact CG2-CE2 4.02Å; I577-Y590 HydrophobicContact CG2-CG 3.6Å; R578-Y590 PolarHBondContact NE-O 3.26Å; D587-Y590 HydrophobicContact CB-CD2 4.02Å; D587-Y590 HydrophobicContact CB-CE2 4.22Å; D587-Y590 PolarHBondContact O-N 3.48Å; L588-Y590 PolarHBondContact O-N 3.22Å; Y590-T592 PolarHBondContact O-N 3.04Å
591	W	93.5	Very high	82.5	Confident	15 Å²	15	43.5 Å²	43.5	6%	0.057	24%	0.235	C	C	.	.			trans	-58	129.7	-176	-75.3	25.7	0	0	0	111.9	L586 L588 H595 I596 W599 G619 I656	L586-W591 PolarHBondContact O-NE1 3.49Å; L588-W591 HydrophobicContact CD1-CB 4.34Å; L588-W591 HydrophobicContact CD1-CD2 3.5Å; L588-W591 VanDerWaalsContact CD1-CD2 3.5Å; L588-W591 HydrophobicContact CD1-CE3 3.43Å; L588-W591 VanDerWaalsContact CD1-CE3 3.43Å; L588-W591 HydrophobicContact CD1-CG 3.92Å; L588-W591 HydrophobicContact CD1-CH2 4.39Å; L588-W591 HydrophobicContact CD1-CZ2 4.44Å; L588-W591 HydrophobicContact CD1-CZ3 3.89Å; L588-W591 PolarHBondContact O-N 3.43Å; W591-H595 HydrophobicContact CB-CB 4.03Å; W591-H595 HydrophobicContact CD2-CB 4.33Å; W591-H595 HydrophobicContact CG-CB 4.12Å; W591-I596 HydrophobicContact CE3-CG1 3.99Å; W591-W599 HydrophobicContact CH2-CB 4.01Å; W591-W599 AromaticContact CH2-CD1 3.81Å; W591-W599 AromaticContact CH2-CG 3.84Å; W591-W599 HydrophobicContact CH2-CG 3.84Å; W591-W599 HydrophobicContact CZ3-CB 3.6Å; W591-W599 AromaticContact CZ3-CD1 4Å; W591-W599 AromaticContact CZ3-CD2 3.96Å; W591-W599 HydrophobicContact CZ3-CD2 3.96Å; W591-W599 HydrophobicContact CZ3-CE3 4.49Å; W591-W599 AromaticContact CZ3-CG 3.56Å; W591-W599 HydrophobicContact CZ3-CG 3.56Å; W591-G619 WeakPolarHBondContact O-CA 3.34Å; W591-G619 PolarHBondContact O-N 2.97Å; W591-I656 HydrophobicContact CH2-CD1 4.1Å; W591-I656 HydrophobicContact CZ3-CD1 4.03Å
592	T	94.6	Very high	84.1	Confident	8 Å²	8	45.8 Å²	45.8	5%	0.049	24%	0.243	C	C	.	.			trans	-80	172.6	172.8	57.3	0	0	0	0	110.7	H371 Y590 D594 H595 I596	H371-T592 HydrophobicContact CB-CG2 4.31Å; H371-T592 CarbonylContact O-C 3.26Å; H371-T592 WeakPolarHBondContact O-CA 3.28Å; Y590-T592 PolarHBondContact O-N 3.04Å; T592-D594 VanDerWaalsContact C-N 3.25Å; T592-D594 PolarHBondContact O-N 3.49Å; T592-H595 PolarHBondContact O-N 2.87Å; T592-H595 PolarHBondContact OG1-CD2 3.08Å; T592-H595 PolarHBondContact OG1-N 2.84Å; T592-I596 PolarHBondContact O-N 3.36Å
593	N	95.2	Very high	85.6	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-58.5	-42.7	169.1	-169.2	-117.5	0	0	0	110.5	H370 H371 G373 H595 I596 V597 I612 L617	H370-N593 WeakPolarHBondContact O-CB 3.48Å; H370-N593 PolarHBondContact O-N 2.94Å; H371-N593 PolarHBondContact O-N 2.83Å; G373-N593 VanDerWaalsContact CA-CG 3.5Å; N593-H595 VanDerWaalsContact C-N 3.34Å; N593-H595 PolarHBondContact O-N 3.13Å; N593-I596 PolarHBondContact O-N 2.88Å; N593-I596 VanDerWaalsContact O-N 3.09Å; N593-V597 WeakPolarHBondContact O-CG2 3.49Å; N593-V597 PolarHBondContact O-N 2.77Å; N593-I612 PolarHBondContact ND2-O 3.28Å; N593-L617 PolarHBondContact ND2-O 3.26Å
594	D	92.1	Very high	87	Confident	63 Å²	63	41.4 Å²	41.4	34%	0.337	23%	0.233	S	C	.	.	H	α-helix	trans	-62.4	-33.9	176.2	-66.1	-30.3	0	0	0	113.1	H370 T592 V597 K598	H370-D594 WeakPolarHBondContact CB-OD2 3.11Å; H370-D594 IonicContact CE1-OD2 2.95Å; H370-D594 IonicContact CG-OD2 3.96Å; H370-D594 IonicContact ND1-OD1 3.16Å; H370-D594 IonicContact ND1-OD2 2.73Å; H370-D594 PolarHBondContact ND1-OD2 3.28Å; T592-D594 VanDerWaalsContact C-N 3.25Å; T592-D594 PolarHBondContact O-N 3.49Å; D594-V597 WeakPolarHBondContact O-CB 3.5Å; D594-V597 PolarHBondContact O-N 2.86Å; D594-K598 PolarHBondContact O-N 3.24Å
595	H	92.2	Very high	88.4	Confident	43 Å²	43	36 Å²	36	20%	0.199	19%	0.194	C	C	.	.	H	α-helix	trans	-67.8	-36.1	172.8	-66.2	177.8	0	0	0	112	L583 W591 T592 N593 K598 W599	L583-H595 HydrophobicContact CD2-CB 4.24Å; W591-H595 HydrophobicContact CB-CB 4.03Å; W591-H595 HydrophobicContact CD2-CB 4.33Å; W591-H595 HydrophobicContact CG-CB 4.12Å; T592-H595 PolarHBondContact O-N 2.87Å; T592-H595 PolarHBondContact OG1-CD2 3.08Å; T592-H595 PolarHBondContact OG1-N 2.84Å; N593-H595 VanDerWaalsContact C-N 3.34Å; N593-H595 PolarHBondContact O-N 3.13Å; H595-K598 PolarHBondContact O-N 3.3Å; H595-W599 WeakPolarHBondContact O-CB 3.46Å; H595-W599 PolarHBondContact O-N 3.17Å
596	I	93	Very high	89.9	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-71.2	-36.3	176	-63.4	175.7	0	0	0	111	W591 T592 N593 K598 W599 L600 I612 L617 H618 M622	W591-I596 HydrophobicContact CE3-CG1 3.99Å; T592-I596 PolarHBondContact O-N 3.36Å; N593-I596 PolarHBondContact O-N 2.88Å; N593-I596 VanDerWaalsContact O-N 3.09Å; I596-K598 VanDerWaalsContact C-N 3.34Å; I596-W599 HydrophobicContact CG2-CE3 4.15Å; I596-W599 PolarHBondContact O-N 3Å; I596-L600 HydrophobicContact CG2-CD1 4.1Å; I596-L600 HydrophobicContact CG2-CG 4.38Å; I596-L600 WeakPolarHBondContact O-CB 3.32Å; I596-L600 VanDerWaalsContact O-CG 3.31Å; I596-L600 WeakPolarHBondContact O-CG 3.3Å; I596-L600 PolarHBondContact O-N 2.92Å; I596-I612 HydrophobicContact CG2-CD1 3.91Å; I596-L617 HydrophobicContact CD1-CD2 4.45Å; I596-L617 HydrophobicContact CD1-CG 3.84Å; I596-L617 HydrophobicContact CG2-CD2 3.81Å; I596-L617 HydrophobicContact CG2-CG 4.3Å; I596-H618 VanDerWaalsContact CD1-CA 3.48Å; I596-M622 HydrophobicContact CD1-SD 3.53Å; I596-M622 VanDerWaalsContact CD1-SD 3.53Å; I596-M622 HydrophobicContact CG1-SD 4.34Å
597	V	92.4	Very high	90.8	Very high	32 Å²	32	36.4 Å²	36.4	19%	0.194	21%	0.206	C	C	.	.	H	α-helix	trans	-55.2	-50.6	169.8	169.3	0	0	0	0	110.4	N593 D594 L600 S601 V609 I612	N593-V597 WeakPolarHBondContact O-CG2 3.49Å; N593-V597 PolarHBondContact O-N 2.77Å; D594-V597 WeakPolarHBondContact O-CB 3.5Å; D594-V597 PolarHBondContact O-N 2.86Å; V597-L600 PolarHBondContact O-N 3.45Å; V597-S601 WeakPolarHBondContact O-CB 3.45Å; V597-S601 PolarHBondContact O-N 2.84Å; V597-S601 PolarHBondContact O-OG 3.26Å; V597-V609 HydrophobicContact CB-CG1 4.21Å; V597-V609 HydrophobicContact CG1-CG1 3.62Å; V597-V609 HydrophobicContact CG1-CG2 4.5Å; V597-V609 HydrophobicContact CG2-CG1 3.93Å; V597-I612 HydrophobicContact CG2-CD1 4.27Å; V597-I612 HydrophobicContact CG2-CG2 3.56Å
598	K	91	Very high	90.8	Very high	114 Å²	114	37.6 Å²	37.6	50%	0.496	21%	0.21	S	C	.	.	H	α-helix	trans	-63.8	-47.7	179.9	-172.4	167.8	161.8	-161.7	0	111.2	L583 D594 H595 I596 L600 S601 D602	L583-K598 HydrophobicContact CD1-CB 4.24Å; L583-K598 HydrophobicContact CD1-CD 3.59Å; L583-K598 VanDerWaalsContact CD1-CE 3.47Å; L583-K598 HydrophobicContact CD1-CG 3.73Å; D594-K598 PolarHBondContact O-N 3.24Å; H595-K598 PolarHBondContact O-N 3.3Å; I596-K598 VanDerWaalsContact C-N 3.34Å; K598-L600 PolarHBondContact O-N 3.22Å; K598-S601 CarbonylContact O-C 3.57Å; K598-S601 WeakPolarHBondContact O-CA 3.32Å; K598-S601 VanDerWaalsContact O-CB 3.32Å; K598-S601 WeakPolarHBondContact O-CB 3.45Å; K598-S601 PolarHBondContact O-N 2.92Å; K598-D602 PolarHBondContact O-N 2.77Å
599	W	91.7	Very high	90.5	Very high	20 Å²	20	38.3 Å²	38.3	8%	0.076	22%	0.215	C	C	.	.	H	α-helix	trans	-56.1	-43.9	174.8	171.5	68.6	0	0	0	113.8	W591 H595 I596 S601 D602 L603 L633 L649 N652 L653 I656	W591-W599 HydrophobicContact CH2-CB 4.01Å; W591-W599 AromaticContact CH2-CD1 3.81Å; W591-W599 AromaticContact CH2-CG 3.84Å; W591-W599 HydrophobicContact CH2-CG 3.84Å; W591-W599 HydrophobicContact CZ3-CB 3.6Å; W591-W599 AromaticContact CZ3-CD1 4Å; W591-W599 AromaticContact CZ3-CD2 3.96Å; W591-W599 HydrophobicContact CZ3-CD2 3.96Å; W591-W599 HydrophobicContact CZ3-CE3 4.49Å; W591-W599 AromaticContact CZ3-CG 3.56Å; W591-W599 HydrophobicContact CZ3-CG 3.56Å; H595-W599 WeakPolarHBondContact O-CB 3.46Å; H595-W599 PolarHBondContact O-N 3.17Å; I596-W599 HydrophobicContact CG2-CE3 4.15Å; I596-W599 PolarHBondContact O-N 3Å; W599-S601 VanDerWaalsContact C-N 3.31Å; W599-S601 PolarHBondContact O-N 3.27Å; W599-D602 PolarHBondContact O-N 3.02Å; W599-L603 HydrophobicContact CD2-CD1 4.2Å; W599-L603 HydrophobicContact CH2-CD1 4.21Å; W599-L603 HydrophobicContact CZ2-CD1 3.63Å; W599-L603 WeakPolarHBondContact O-CG 3.48Å; W599-L603 PolarHBondContact O-N 3.05Å; W599-L633 HydrophobicContact CH2-CD2 4.18Å; W599-L633 HydrophobicContact CZ3-CD2 4.33Å; W599-L649 HydrophobicContact CH2-CD1 3.63Å; W599-L649 HydrophobicContact CZ2-CD1 4.31Å; W599-L649 HydrophobicContact CZ3-CD1 4.14Å; W599-N652 HydrophobicContact CZ2-CB 4.18Å; W599-L653 HydrophobicContact CH2-CB 4.48Å; W599-L653 HydrophobicContact CH2-CD1 4.49Å; W599-I656 HydrophobicContact CD2-CD1 4.31Å; W599-I656 HydrophobicContact CH2-CD1 4.18Å; W599-I656 HydrophobicContact CZ2-CD1 3.6Å
600	L	91.4	Very high	90.1	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-64.6	-37.1	175	-72.1	169.8	0	0	0	111.7	I596 V597 K598 L603 G604 L605 V609 I612 L637 L649	I596-L600 HydrophobicContact CG2-CD1 4.1Å; I596-L600 HydrophobicContact CG2-CG 4.38Å; I596-L600 WeakPolarHBondContact O-CB 3.32Å; I596-L600 VanDerWaalsContact O-CG 3.31Å; I596-L600 WeakPolarHBondContact O-CG 3.3Å; I596-L600 PolarHBondContact O-N 2.92Å; V597-L600 PolarHBondContact O-N 3.45Å; K598-L600 PolarHBondContact O-N 3.22Å; L600-L603 PolarHBondContact O-N 3.38Å; L600-G604 PolarHBondContact O-N 3.17Å; L600-L605 HydrophobicContact CB-CB 4.43Å; L600-L605 HydrophobicContact CD2-CB 4.41Å; L600-L605 HydrophobicContact CD2-CD1 4.27Å; L600-L605 WeakPolarHBondContact O-CA 3.26Å; L600-L605 WeakPolarHBondContact O-CB 3.48Å; L600-L605 PolarHBondContact O-N 2.87Å; L600-V609 HydrophobicContact CB-CG2 4.06Å; L600-V609 HydrophobicContact CD1-CG2 4.39Å; L600-I612 HydrophobicContact CD1-CD1 3.76Å; L600-L637 HydrophobicContact CD1-CD1 3.68Å; L600-L637 HydrophobicContact CD1-CD2 3.87Å; L600-L637 HydrophobicContact CD1-CG 4.45Å; L600-L637 HydrophobicContact CD2-CD1 3.9Å; L600-L637 HydrophobicContact CG-CD1 4.45Å; L600-L649 HydrophobicContact CD2-CD1 4.03Å
601	S	91.2	Very high	89.6	Confident	52 Å²	52	47.2 Å²	47.2	36%	0.364	27%	0.272	S	S	.	.	H	α-helix	trans	-65.7	-43	175.8	-53.5	0	0	0	0	111.3	V597 K598 W599 L603 G604	V597-S601 WeakPolarHBondContact O-CB 3.45Å; V597-S601 PolarHBondContact O-N 2.84Å; V597-S601 PolarHBondContact O-OG 3.26Å; K598-S601 CarbonylContact O-C 3.57Å; K598-S601 WeakPolarHBondContact O-CA 3.32Å; K598-S601 VanDerWaalsContact O-CB 3.32Å; K598-S601 WeakPolarHBondContact O-CB 3.45Å; K598-S601 PolarHBondContact O-N 2.92Å; W599-S601 VanDerWaalsContact C-N 3.31Å; W599-S601 PolarHBondContact O-N 3.27Å; S601-L603 PolarHBondContact O-N 3.22Å; S601-G604 WeakPolarHBondContact O-CA 3.38Å; S601-G604 PolarHBondContact O-N 3.47Å
602	D	89.8	Confident	89.5	Confident	107 Å²	107	46.6 Å²	46.6	57%	0.572	27%	0.27	S	S	*	.	H	α-helix	trans	-63.1	-28.3	175.3	-59.2	-28	0	0	0	111.9	K598 W599 G604	K598-D602 PolarHBondContact O-N 2.77Å; W599-D602 PolarHBondContact O-N 3.02Å; D602-G604 VanDerWaalsContact C-N 3.27Å; D602-G604 PolarHBondContact O-N 3.33Å
603	L	89.3	Confident	89.2	Confident	15 Å²	15	49.7 Å²	49.7	8%	0.079	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-3.7	170.8	-67.1	-177.9	0	0	0	114.2	W599 L600 S601 L605 K648 L649 N652	W599-L603 HydrophobicContact CD2-CD1 4.2Å; W599-L603 HydrophobicContact CH2-CD1 4.21Å; W599-L603 HydrophobicContact CZ2-CD1 3.63Å; W599-L603 WeakPolarHBondContact O-CG 3.48Å; W599-L603 PolarHBondContact O-N 3.05Å; L600-L603 PolarHBondContact O-N 3.38Å; S601-L603 PolarHBondContact O-N 3.22Å; L603-L605 HydrophobicContact CB-CD1 4.18Å; L603-L605 HydrophobicContact CB-CG 4.13Å; L603-L605 HydrophobicContact CD1-CD1 4.47Å; L603-K648 WeakPolarHBondContact O-CE 3.1Å; L603-K648 PolarHBondContact O-NZ 3.14Å; L603-L649 HydrophobicContact CD1-CD1 4.05Å; L603-N652 HydrophobicContact CD1-CB 3.85Å; L603-N652 HydrophobicContact CD2-CB 3.95Å; L603-N652 WeakPolarHBondContact CD2-OD1 3.39Å
604	G	88.1	Confident	89	Confident	54 Å²	54	51.7 Å²	51.7	56%	0.557	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.4	30.9	-173.5	0	0	0	0	0	113.2	L600 S601 D602	L600-G604 PolarHBondContact O-N 3.17Å; S601-G604 WeakPolarHBondContact O-CA 3.38Å; S601-G604 PolarHBondContact O-N 3.47Å; D602-G604 VanDerWaalsContact C-N 3.27Å; D602-G604 PolarHBondContact O-N 3.33Å
605	L	87.2	Confident	89	Confident	7 Å²	7	49.2 Å²	49.2	4%	0.037	29%	0.291	C	S	.	.			trans	-115.5	28.9	-179.2	-58.7	-179.5	0	0	0	111.9	L600 L603 D607 F608 V645 L649	L600-L605 HydrophobicContact CB-CB 4.43Å; L600-L605 HydrophobicContact CD2-CB 4.41Å; L600-L605 HydrophobicContact CD2-CD1 4.27Å; L600-L605 WeakPolarHBondContact O-CA 3.26Å; L600-L605 WeakPolarHBondContact O-CB 3.48Å; L600-L605 PolarHBondContact O-N 2.87Å; L603-L605 HydrophobicContact CB-CD1 4.18Å; L603-L605 HydrophobicContact CB-CG 4.13Å; L603-L605 HydrophobicContact CD1-CD1 4.47Å; L605-D607 PolarHBondContact O-N 2.97Å; L605-F608 HydrophobicContact CB-CD2 4.07Å; L605-F608 HydrophobicContact CD2-CD2 4.05Å; L605-F608 HydrophobicContact CD2-CE2 4.05Å; L605-F608 PolarHBondContact O-N 3.11Å; L605-F608 VanDerWaalsContact O-N 3.13Å; L605-V645 HydrophobicContact CD1-CG1 4.42Å; L605-V645 HydrophobicContact CD2-CB 4.43Å; L605-V645 HydrophobicContact CD2-CG1 3.65Å; L605-V645 HydrophobicContact CD2-CG2 4.15Å; L605-L649 HydrophobicContact CD1-CB 4.25Å; L605-L649 HydrophobicContact CD1-CD1 3.93Å; L605-L649 HydrophobicContact CD1-CG 4.47Å
606	S	87	Confident	89	Confident	57 Å²	57	47.2 Å²	47.2	40%	0.399	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-51.1	-37.3	177.2	45.9	0	0	0	0	113.2	F608 V609	S606-F608 PolarHBondContact O-N 3.21Å; S606-F608 VanDerWaalsContact O-N 3.16Å; S606-V609 WeakPolarHBondContact O-CB 3.49Å; S606-V609 WeakPolarHBondContact O-CG2 3.43Å; S606-V609 PolarHBondContact O-N 3.1Å
607	D	85.5	Confident	89.1	Confident	113 Å²	113	47.2 Å²	47.2	60%	0.604	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-68.8	-17.7	-174.1	-50.4	-10.1	0	0	0	112.1	L605 H610	L605-D607 PolarHBondContact O-N 2.97Å; D607-H610 PolarHBondContact O-CD2 3.44Å
608	F	83.6	Confident	89.3	Confident	51 Å²	51	45.9 Å²	45.9	22%	0.224	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-99.9	5.6	177.6	-52.6	-67.1	0	0	0	113.4	L605 S606 H610 I639 P640 V645	L605-F608 HydrophobicContact CB-CD2 4.07Å; L605-F608 HydrophobicContact CD2-CD2 4.05Å; L605-F608 HydrophobicContact CD2-CE2 4.05Å; L605-F608 PolarHBondContact O-N 3.11Å; L605-F608 VanDerWaalsContact O-N 3.13Å; S606-F608 PolarHBondContact O-N 3.21Å; S606-F608 VanDerWaalsContact O-N 3.16Å; F608-H610 VanDerWaalsContact C-N 3.31Å; F608-I639 HydrophobicContact CB-CD1 4.29Å; F608-I639 HydrophobicContact CB-CG1 3.79Å; F608-I639 HydrophobicContact CD1-CB 4.42Å; F608-I639 HydrophobicContact CD1-CG1 3.96Å; F608-I639 HydrophobicContact CD1-CG2 4.48Å; F608-I639 HydrophobicContact CD2-CG1 4.34Å; F608-I639 HydrophobicContact CE1-CG2 4.45Å; F608-I639 HydrophobicContact CG-CD1 4.44Å; F608-I639 HydrophobicContact CG-CG1 3.75Å; F608-P640 HydrophobicContact CE1-CG 4.29Å; F608-V645 HydrophobicContact CE2-CG1 4.28Å
609	V	85.6	Confident	89.4	Confident	23 Å²	23	40.4 Å²	40.4	14%	0.139	25%	0.249	C	C	.	.			trans	-76.8	-21	174.6	174	0	0	0	0	111.3	V597 L600 S606 G611 I612	V597-V609 HydrophobicContact CB-CG1 4.21Å; V597-V609 HydrophobicContact CG1-CG1 3.62Å; V597-V609 HydrophobicContact CG1-CG2 4.5Å; V597-V609 HydrophobicContact CG2-CG1 3.93Å; L600-V609 HydrophobicContact CB-CG2 4.06Å; L600-V609 HydrophobicContact CD1-CG2 4.39Å; S606-V609 WeakPolarHBondContact O-CB 3.49Å; S606-V609 WeakPolarHBondContact O-CG2 3.43Å; S606-V609 PolarHBondContact O-N 3.1Å; V609-G611 PolarHBondContact O-N 2.95Å; V609-I612 HydrophobicContact CG1-CG2 3.92Å; V609-I612 VanDerWaalsContact O-CB 3.27Å; V609-I612 WeakPolarHBondContact O-CB 3.35Å; V609-I612 WeakPolarHBondContact O-CG2 3.33Å; V609-I612 PolarHBondContact O-N 3.47Å
610	H	83.5	Confident	89.6	Confident	160 Å²	160	39.5 Å²	39.5	74%	0.741	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.2	121.5	-178.8	-58.1	-43.8	0	0	0	112.1	D607 F608	D607-H610 PolarHBondContact O-CD2 3.44Å; F608-H610 VanDerWaalsContact C-N 3.31Å
611	G	84.4	Confident	89.8	Confident	58 Å²	58	39.8 Å²	39.8	60%	0.598	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	85	-1.5	-178.4	0	0	0	0	0	115.6	V609 N613 A614 S615	V609-G611 PolarHBondContact O-N 2.95Å; G611-N613 PolarHBondContact O-N 2.86Å; G611-N613 VanDerWaalsContact O-N 3.13Å; G611-A614 PolarHBondContact O-N 3.13Å; G611-S615 PolarHBondContact O-N 3.35Å
612	I	90.2	Very high	90	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.005	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-58.3	-28.5	178.4	-160	177.4	0	0	0	113	N593 I596 V597 L600 V609 A614 S615 L617 L637	N593-I612 PolarHBondContact ND2-O 3.28Å; I596-I612 HydrophobicContact CG2-CD1 3.91Å; V597-I612 HydrophobicContact CG2-CD1 4.27Å; V597-I612 HydrophobicContact CG2-CG2 3.56Å; L600-I612 HydrophobicContact CD1-CD1 3.76Å; V609-I612 HydrophobicContact CG1-CG2 3.92Å; V609-I612 VanDerWaalsContact O-CB 3.27Å; V609-I612 WeakPolarHBondContact O-CB 3.35Å; V609-I612 WeakPolarHBondContact O-CG2 3.33Å; V609-I612 PolarHBondContact O-N 3.47Å; I612-A614 PolarHBondContact O-N 3.3Å; I612-A614 VanDerWaalsContact O-N 3.13Å; I612-S615 VanDerWaalsContact O-CB 3.29Å; I612-S615 WeakPolarHBondContact O-CB 3.38Å; I612-S615 PolarHBondContact O-N 3.29Å; I612-S615 PolarHBondContact O-OG 2.94Å; I612-L617 HydrophobicContact CD1-CD2 4.32Å; I612-L637 HydrophobicContact CB-CD2 4.37Å; I612-L637 HydrophobicContact CD1-CD2 3.68Å; I612-L637 HydrophobicContact CG1-CD2 3.74Å
613	N	89.4	Confident	90.1	Very high	73 Å²	73	32.2 Å²	32.2	39%	0.39	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-65.2	-11.3	175.8	-56.5	22.1	0	0	0	113.7	G373 L374 V375 G611	G373-N613 VanDerWaalsContact C-C 3.49Å; G373-N613 CarbonylContact C-O 3.31Å; G373-N613 WeakPolarHBondContact CA-O 3.41Å; G373-N613 CarbonylContact O-C 3.45Å; G373-N613 VanDerWaalsContact O-C 3.24Å; L374-N613 PolarHBondContact N-O 2.98Å; V375-N613 HydrophobicContact CG1-CB 4.18Å; V375-N613 WeakPolarHBondContact CG1-O 3.5Å; V375-N613 WeakPolarHBondContact CG2-O 3.08Å; V375-N613 PolarHBondContact N-O 3.03Å; V375-N613 VanDerWaalsContact N-O 3.11Å; G611-N613 PolarHBondContact O-N 2.86Å; G611-N613 VanDerWaalsContact O-N 3.13Å
614	A	90.3	Very high	90.3	Very high	43 Å²	43	31.9 Å²	31.9	36%	0.355	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-113.8	0.4	171.2	0	0	0	0	0	112.9	G373 V375 Q376 G611 I612	G373-A614 CarbonylContact O-C 3.46Å; G373-A614 VanDerWaalsContact O-C 3.26Å; G373-A614 WeakPolarHBondContact O-CA 3.49Å; G373-A614 PolarHBondContact O-N 3.45Å; V375-A614 HydrophobicContact CG2-CB 4.29Å; Q376-A614 PolarHBondContact NE2-O 3.2Å; Q376-A614 VanDerWaalsContact OE1-CA 3.31Å; G611-A614 PolarHBondContact O-N 3.13Å; I612-A614 PolarHBondContact O-N 3.3Å; I612-A614 VanDerWaalsContact O-N 3.13Å
615	S	91.6	Very high	90.5	Very high	11 Å²	11	30.2 Å²	30.2	8%	0.077	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-18.8	-174.5	73.8	0	0	0	0	114	G373 G611 I612 L617 R636	G373-S615 PolarHBondContact O-N 2.93Å; G611-S615 PolarHBondContact O-N 3.35Å; I612-S615 VanDerWaalsContact O-CB 3.29Å; I612-S615 WeakPolarHBondContact O-CB 3.38Å; I612-S615 PolarHBondContact O-N 3.29Å; I612-S615 PolarHBondContact O-OG 2.94Å; S615-L617 PolarHBondContact O-N 3.06Å; S615-L617 VanDerWaalsContact OG-CB 3.24Å; S615-L617 WeakPolarHBondContact OG-CB 3.33Å; S615-L617 PolarHBondContact OG-N 2.9Å; S615-R636 VanDerWaalsContact O-CD 3.3Å; S615-R636 WeakPolarHBondContact O-CD 3.39Å; S615-R636 PolarHBondContact O-NH1 3.06Å
616	G	93.3	Very high	90.6	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.2	12.7	-172.3	0	0	0	0	0	115	L372 G373 S556 H618	L372-G616 CarbonylContact O-C 3.51Å; L372-G616 VanDerWaalsContact O-CA 3.24Å; L372-G616 WeakPolarHBondContact O-CA 3.43Å; G373-G616 WeakPolarHBondContact O-CA 3.41Å; G373-G616 PolarHBondContact O-N 3.29Å; S556-G616 WeakPolarHBondContact CB-O 3.39Å; S556-G616 PolarHBondContact OG-O 3.29Å; G616-H618 PolarHBondContact O-ND1 3.05Å; G616-H618 VanDerWaalsContact O-ND1 3.14Å
617	L	95.2	Very high	90.7	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.213	C	C	.	.			trans	-83	120.4	-175.1	-173.1	64.7	0	0	0	111.2	L372 N593 I596 I612 S615 Y621 M622 F628 L633 L637	L372-L617 PolarHBondContact O-N 3Å; N593-L617 PolarHBondContact ND2-O 3.26Å; I596-L617 HydrophobicContact CD1-CD2 4.45Å; I596-L617 HydrophobicContact CD1-CG 3.84Å; I596-L617 HydrophobicContact CG2-CD2 3.81Å; I596-L617 HydrophobicContact CG2-CG 4.3Å; I612-L617 HydrophobicContact CD1-CD2 4.32Å; S615-L617 PolarHBondContact O-N 3.06Å; S615-L617 VanDerWaalsContact OG-CB 3.24Å; S615-L617 WeakPolarHBondContact OG-CB 3.33Å; S615-L617 PolarHBondContact OG-N 2.9Å; L617-Y621 HydrophobicContact CD1-CD1 4.42Å; L617-M622 HydrophobicContact CD1-CG 3.91Å; L617-M622 HydrophobicContact CD1-SD 4.22Å; L617-F628 HydrophobicContact CD1-CE2 3.67Å; L617-F628 HydrophobicContact CD1-CZ 3.69Å; L617-L633 HydrophobicContact CD1-CD1 4.09Å; L617-L633 HydrophobicContact CD2-CD1 3.42Å; L617-L633 VanDerWaalsContact CD2-CD1 3.42Å; L617-L633 HydrophobicContact CG-CD1 4.4Å; L617-L637 HydrophobicContact CD2-CD2 4.01Å; L617-L637 HydrophobicContact CD2-CG 4.28Å
618	H	95.3	Very high	91.1	Very high	4 Å²	4	30.8 Å²	30.8	2%	0.019	19%	0.185	C	C	.	.			trans	-154.4	165	177	63.7	-82.6	0	0	0	109.8	H371 L372 S556 I596 G616 A620 Y621 M622	H371-H618 VanDerWaalsContact O-CB 3.28Å; H371-H618 WeakPolarHBondContact O-CB 3.46Å; L372-H618 HydrophobicContact CD2-CB 4.41Å; S556-H618 PolarHBondContact O-CE1 3.01Å; S556-H618 VanDerWaalsContact O-CE1 3.23Å; S556-H618 PolarHBondContact OG-CE1 3.17Å; S556-H618 PolarHBondContact OG-ND1 2.88Å; I596-H618 VanDerWaalsContact CD1-CA 3.48Å; G616-H618 PolarHBondContact O-ND1 3.05Å; G616-H618 VanDerWaalsContact O-ND1 3.14Å; H618-A620 PolarHBondContact O-N 3.03Å; H618-Y621 PolarHBondContact CD2-N 3.46Å; H618-Y621 VanDerWaalsContact CE1-CB 3.48Å; H618-Y621 WeakPolarHBondContact CE1-CB 3.48Å; H618-Y621 PolarHBondContact NE2-N 3.01Å; H618-Y621 WeakPolarHBondContact O-CB 3.44Å; H618-Y621 PolarHBondContact O-N 3.41Å; H618-Y621 VanDerWaalsContact O-N 3.1Å; H618-M622 PolarHBondContact O-N 3Å
619	G	94.4	Very high	91.4	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-52.9	-53	-172.8	0	0	0	0	0	114.8	L588 W591 Y621 M622 V623	L588-G619 CarbonylContact O-C 3.59Å; L588-G619 WeakPolarHBondContact O-CA 3.27Å; W591-G619 WeakPolarHBondContact O-CA 3.34Å; W591-G619 PolarHBondContact O-N 2.97Å; G619-Y621 VanDerWaalsContact C-N 3.27Å; G619-Y621 PolarHBondContact O-N 3.46Å; G619-M622 WeakPolarHBondContact O-CB 3.44Å; G619-M622 PolarHBondContact O-N 3.27Å; G619-V623 WeakPolarHBondContact O-CG2 3.44Å; G619-V623 PolarHBondContact O-N 2.96Å
620	A	95.1	Very high	91.6	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-59	-34.1	178	0	0	0	0	0	113.6	L563 L589 H618 L624	L563-A620 HydrophobicContact CB-CB 3.91Å; L563-A620 HydrophobicContact CD2-CB 4.06Å; L563-A620 HydrophobicContact CG-CB 4.47Å; L589-A620 HydrophobicContact CD1-CB 4.33Å; L589-A620 PolarHBondContact O-N 3.33Å; L589-A620 VanDerWaalsContact O-N 3.12Å; H618-A620 PolarHBondContact O-N 3.03Å; A620-L624 HydrophobicContact CB-CD1 3.91Å; A620-L624 HydrophobicContact CB-CG 4.47Å; A620-L624 WeakPolarHBondContact O-CB 3.48Å; A620-L624 WeakPolarHBondContact O-CG 3.46Å; A620-L624 PolarHBondContact O-N 3.36Å
621	Y	95.7	Very high	92	Very high	6 Å²	6	26.9 Å²	26.9	2%	0.024	17%	0.17	C	C	.	.	H	α-helix	trans	-67.2	-41	173.5	179.7	-130.7	0	0	0	112.1	E555 T559 L617 H618 G619 D625 F628 R636	E555-Y621 HydrophobicContact CB-CE2 4Å; T559-Y621 HydrophobicContact CG2-CD2 4.28Å; T559-Y621 WeakPolarHBondContact OG1-CA 3.5Å; T559-Y621 WeakPolarHBondContact OG1-CB 3.48Å; T559-Y621 PolarHBondContact OG1-N 2.94Å; L617-Y621 HydrophobicContact CD1-CD1 4.42Å; H618-Y621 PolarHBondContact CD2-N 3.46Å; H618-Y621 VanDerWaalsContact CE1-CB 3.48Å; H618-Y621 WeakPolarHBondContact CE1-CB 3.48Å; H618-Y621 PolarHBondContact NE2-N 3.01Å; H618-Y621 WeakPolarHBondContact O-CB 3.44Å; H618-Y621 PolarHBondContact O-N 3.41Å; H618-Y621 VanDerWaalsContact O-N 3.1Å; G619-Y621 VanDerWaalsContact C-N 3.27Å; G619-Y621 PolarHBondContact O-N 3.46Å; Y621-D625 HydrophobicContact CD2-CB 4.02Å; Y621-D625 HydrophobicContact CE2-CB 4.02Å; Y621-D625 WeakPolarHBondContact CE2-OD2 3.42Å; Y621-D625 WeakPolarHBondContact O-CB 3.35Å; Y621-D625 PolarHBondContact O-N 3.49Å; Y621-F628 AromaticContact CD1-CD2 3.83Å; Y621-F628 HydrophobicContact CD1-CD2 3.83Å; Y621-F628 AromaticContact CD1-CE2 3.9Å; Y621-F628 HydrophobicContact CD1-CE2 3.9Å; Y621-F628 AromaticContact CE1-CD2 3.54Å; Y621-F628 HydrophobicContact CE1-CD2 3.54Å; Y621-F628 AromaticContact CE1-CE2 3.7Å; Y621-F628 HydrophobicContact CE1-CE2 3.7Å; Y621-F628 HydrophobicContact CE2-CD2 4.43Å; Y621-F628 HydrophobicContact CG-CD2 4.4Å; Y621-F628 AromaticContact CZ-CD2 3.85Å; Y621-R636 VanDerWaalsContact CZ-NH2 3.3Å; Y621-R636 PolarHBondContact OH-NH2 2.85Å
622	M	94.7	Very high	92.3	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-63.9	-47.4	176.6	-60.9	173.3	67.9	0	0	111.3	L588 I596 L617 H618 G619 F628 L653 I656 L657 R661	L588-M622 HydrophobicContact CD1-CE 4.37Å; L588-M622 HydrophobicContact CD1-SD 4.28Å; L588-M622 HydrophobicContact CD2-CE 4.44Å; I596-M622 HydrophobicContact CD1-SD 3.53Å; I596-M622 VanDerWaalsContact CD1-SD 3.53Å; I596-M622 HydrophobicContact CG1-SD 4.34Å; L617-M622 HydrophobicContact CD1-CG 3.91Å; L617-M622 HydrophobicContact CD1-SD 4.22Å; H618-M622 PolarHBondContact O-N 3Å; G619-M622 WeakPolarHBondContact O-CB 3.44Å; G619-M622 PolarHBondContact O-N 3.27Å; M622-F628 HydrophobicContact CB-CD1 4.17Å; M622-F628 HydrophobicContact CB-CE1 4.06Å; M622-F628 HydrophobicContact CB-CZ 4.43Å; M622-F628 HydrophobicContact CE-CE1 4.34Å; M622-F628 HydrophobicContact CG-CD1 4.32Å; M622-F628 HydrophobicContact CG-CE1 3.77Å; M622-F628 HydrophobicContact CG-CE2 4.19Å; M622-F628 HydrophobicContact CG-CZ 3.71Å; M622-L653 HydrophobicContact CE-CD1 3.34Å; M622-I656 HydrophobicContact CE-CD1 4.49Å; M622-L657 HydrophobicContact CB-CD1 4.3Å; M622-L657 WeakPolarHBondContact O-CD1 3.44Å; M622-R661 PolarHBondContact O-NE 2.99Å; M622-R661 PolarHBondContact O-NH2 3.17Å
623	V	93.7	Very high	92.4	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-77.1	-54.8	-174.5	-177.8	0	0	0	0	111.9	L588 L589 G619 A660 R661 E664 I666	L588-V623 HydrophobicContact CB-CG2 4.01Å; L588-V623 HydrophobicContact CD2-CG2 3.9Å; L588-V623 HydrophobicContact CG-CG2 3.75Å; L589-V623 HydrophobicContact CD1-CB 4.4Å; L589-V623 HydrophobicContact CD1-CG1 4.46Å; G619-V623 WeakPolarHBondContact O-CG2 3.44Å; G619-V623 PolarHBondContact O-N 2.96Å; V623-A660 HydrophobicContact CG1-CB 4.21Å; V623-A660 HydrophobicContact CG2-CB 3.73Å; V623-R661 HydrophobicContact CG1-CG 4.2Å; V623-R661 PolarHBondContact O-NE 3.39Å; V623-E664 HydrophobicContact CG1-CB 4.2Å; V623-E664 HydrophobicContact CG1-CG 3.67Å; V623-I666 HydrophobicContact CG1-CD1 4.38Å; V623-I666 WeakPolarHBondContact O-CD1 3.41Å
624	L	92.5	Very high	92.4	Very high	9 Å²	9	22.9 Å²	22.9	5%	0.047	14%	0.136	C	C	.	.	H	α-helix	trans	-80.7	-26.5	-165.3	-54.1	175.6	0	0	0	113.7	T559 E562 L589 A620 T626 E664 I666	T559-L624 HydrophobicContact CG2-CB 4.02Å; E562-L624 HydrophobicContact CG-CD1 3.59Å; L589-L624 HydrophobicContact CD1-CD1 3.76Å; L589-L624 HydrophobicContact CD1-CD2 3.73Å; L589-L624 HydrophobicContact CD1-CG 3.72Å; A620-L624 HydrophobicContact CB-CD1 3.91Å; A620-L624 HydrophobicContact CB-CG 4.47Å; A620-L624 WeakPolarHBondContact O-CB 3.48Å; A620-L624 WeakPolarHBondContact O-CG 3.46Å; A620-L624 PolarHBondContact O-N 3.36Å; L624-T626 PolarHBondContact O-N 3Å; L624-E664 HydrophobicContact CD2-CG 4.14Å; L624-I666 HydrophobicContact CD2-CD1 4.05Å
625	D	91.6	Very high	92.4	Very high	18 Å²	18	27 Å²	27	10%	0.096	15%	0.146	C	C	.	.			trans	-79.3	105.6	171.8	-171.2	-9.9	0	0	0	110.8	T559 Y621 T627 F628 R661	T559-D625 HydrophobicContact CG2-CB 4.12Å; Y621-D625 HydrophobicContact CD2-CB 4.02Å; Y621-D625 HydrophobicContact CE2-CB 4.02Å; Y621-D625 WeakPolarHBondContact CE2-OD2 3.42Å; Y621-D625 WeakPolarHBondContact O-CB 3.35Å; Y621-D625 PolarHBondContact O-N 3.49Å; D625-T627 VanDerWaalsContact CG-OG1 3.26Å; D625-T627 PolarHBondContact O-N 3.14Å; D625-T627 WeakPolarHBondContact OD1-CA 3.25Å; D625-T627 WeakPolarHBondContact OD1-CB 3.5Å; D625-T627 PolarHBondContact OD1-N 2.98Å; D625-T627 PolarHBondContact OD1-OG1 3.1Å; D625-T627 PolarHBondContact OD2-OG1 3.03Å; D625-F628 HydrophobicContact CB-CB 4.18Å; D625-F628 WeakPolarHBondContact O-CB 3.36Å; D625-F628 PolarHBondContact O-N 3.36Å; D625-R661 PolarHBondContact O-NH2 3.07Å
626	T	89.2	Confident	92.2	Very high	96 Å²	96	27.1 Å²	27.1	59%	0.589	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-22.7	172.8	52.2	0	0	0	0	115.1	L624 I666	L624-T626 PolarHBondContact O-N 3Å; T626-I666 HydrophobicContact CG2-CG2 3.73Å
627	T	90.4	Very high	91.9	Very high	93 Å²	93	27.6 Å²	27.6	57%	0.571	15%	0.147	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.8	-10.4	-179.2	72.1	0	0	0	0	113.4	D625 D629	D625-T627 VanDerWaalsContact CG-OG1 3.26Å; D625-T627 PolarHBondContact O-N 3.14Å; D625-T627 WeakPolarHBondContact OD1-CA 3.25Å; D625-T627 WeakPolarHBondContact OD1-CB 3.5Å; D625-T627 PolarHBondContact OD1-N 2.98Å; D625-T627 PolarHBondContact OD1-OG1 3.1Å; D625-T627 PolarHBondContact OD2-OG1 3.03Å; T627-D629 PolarHBondContact O-N 3.25Å
628	F	92.9	Very high	91.5	Very high	1 Å²	1	35.1 Å²	35.1	0%	0.004	18%	0.182	C	C	.	.			trans	-68.1	124.5	177	-173.2	-80.7	0	0	0	110.3	L617 Y621 M622 D625 T632 L633 L657 R661	L617-F628 HydrophobicContact CD1-CE2 3.67Å; L617-F628 HydrophobicContact CD1-CZ 3.69Å; Y621-F628 AromaticContact CD1-CD2 3.83Å; Y621-F628 HydrophobicContact CD1-CD2 3.83Å; Y621-F628 AromaticContact CD1-CE2 3.9Å; Y621-F628 HydrophobicContact CD1-CE2 3.9Å; Y621-F628 AromaticContact CE1-CD2 3.54Å; Y621-F628 HydrophobicContact CE1-CD2 3.54Å; Y621-F628 AromaticContact CE1-CE2 3.7Å; Y621-F628 HydrophobicContact CE1-CE2 3.7Å; Y621-F628 HydrophobicContact CE2-CD2 4.43Å; Y621-F628 HydrophobicContact CG-CD2 4.4Å; Y621-F628 AromaticContact CZ-CD2 3.85Å; M622-F628 HydrophobicContact CB-CD1 4.17Å; M622-F628 HydrophobicContact CB-CE1 4.06Å; M622-F628 HydrophobicContact CB-CZ 4.43Å; M622-F628 HydrophobicContact CE-CE1 4.34Å; M622-F628 HydrophobicContact CG-CD1 4.32Å; M622-F628 HydrophobicContact CG-CE1 3.77Å; M622-F628 HydrophobicContact CG-CE2 4.19Å; M622-F628 HydrophobicContact CG-CZ 3.71Å; D625-F628 HydrophobicContact CB-CB 4.18Å; D625-F628 WeakPolarHBondContact O-CB 3.36Å; D625-F628 PolarHBondContact O-N 3.36Å; F628-T632 HydrophobicContact CD2-CG2 3.71Å; F628-T632 HydrophobicContact CE2-CG2 3.84Å; F628-T632 HydrophobicContact CG-CG2 4.48Å; F628-L633 HydrophobicContact CE1-CB 4.43Å; F628-L633 HydrophobicContact CZ-CB 4.02Å; F628-L633 HydrophobicContact CZ-CD1 4.25Å; F628-L657 HydrophobicContact CD1-CD2 4.5Å; F628-R661 PolarHBondContact O-NH1 2.94Å; F628-R661 VanDerWaalsContact O-NH1 3.17Å; F628-R661 PolarHBondContact O-NH2 3.44Å
629	D	90	Very high	91	Very high	57 Å²	57	35.3 Å²	35.3	31%	0.305	18%	0.183	S	C	.	.			trans	-137.5	175.6	-178.1	76.9	-28.5	0	0	0	111.4	T627 N631 T632 L633	T627-D629 PolarHBondContact O-N 3.25Å; D629-N631 VanDerWaalsContact C-N 3.27Å; D629-N631 PolarHBondContact O-N 3.43Å; D629-N631 PolarHBondContact OD1-N 3.49Å; D629-N631 WeakPolarHBondContact OD2-CB 3.48Å; D629-N631 PolarHBondContact OD2-ND2 3.27Å; D629-T632 WeakPolarHBondContact O-CA 3.48Å; D629-T632 WeakPolarHBondContact O-CB 3.41Å; D629-T632 PolarHBondContact O-N 3.21Å; D629-T632 VanDerWaalsContact OD1-CB 3.24Å; D629-T632 WeakPolarHBondContact OD1-CB 3.43Å; D629-T632 PolarHBondContact OD1-N 3.08Å; D629-T632 PolarHBondContact OD1-OG1 3.45Å; D629-L633 PolarHBondContact O-N 2.85Å; D629-L633 VanDerWaalsContact O-N 3.1Å
630	F	90.6	Very high	90.3	Very high	11 Å²	11	39.2 Å²	39.2	5%	0.048	21%	0.208	C	C	.	.	H	α-helix	trans	-57.2	-39	176.9	175.3	-120.1	0	0	0	112.9	T632 L633 I634 V646 L649 E650 L653	F630-T632 VanDerWaalsContact C-N 3.27Å; F630-T632 PolarHBondContact O-N 2.88Å; F630-L633 WeakPolarHBondContact O-CB 3.48Å; F630-L633 PolarHBondContact O-N 3.41Å; F630-I634 HydrophobicContact CD1-CD1 4.06Å; F630-I634 HydrophobicContact CD2-CD1 4.45Å; F630-I634 HydrophobicContact CE1-CD1 3.47Å; F630-I634 VanDerWaalsContact CE1-CD1 3.47Å; F630-I634 HydrophobicContact CE2-CD1 3.9Å; F630-I634 HydrophobicContact CE2-CG1 4.11Å; F630-I634 HydrophobicContact CZ-CD1 3.38Å; F630-I634 HydrophobicContact CZ-CG1 4.07Å; F630-I634 PolarHBondContact O-N 2.94Å; F630-I634 VanDerWaalsContact O-N 3.08Å; F630-V646 HydrophobicContact CE1-CG1 3.72Å; F630-V646 HydrophobicContact CZ-CB 4.28Å; F630-V646 HydrophobicContact CZ-CG1 3.7Å; F630-V646 WeakPolarHBondContact CZ-O 3.4Å; F630-L649 HydrophobicContact CE2-CB 3.95Å; F630-L649 HydrophobicContact CE2-CD2 4.03Å; F630-L649 HydrophobicContact CE2-CG 3.87Å; F630-E650 HydrophobicContact CB-CG 4.46Å; F630-E650 HydrophobicContact CD1-CB 4Å; F630-E650 HydrophobicContact CD1-CG 3.94Å; F630-E650 HydrophobicContact CD2-CB 3.92Å; F630-E650 HydrophobicContact CD2-CG 4.27Å; F630-E650 HydrophobicContact CE1-CB 3.8Å; F630-E650 HydrophobicContact CE1-CG 4.21Å; F630-E650 HydrophobicContact CE2-CB 3.74Å; F630-E650 HydrophobicContact CG-CB 4.05Å; F630-E650 HydrophobicContact CG-CG 3.97Å; F630-E650 HydrophobicContact CZ-CB 3.67Å; F630-L653 HydrophobicContact CB-CD2 3.97Å; F630-L653 HydrophobicContact CD2-CD2 4.05Å
631	N	90.6	Very high	89.5	Confident	83 Å²	83	46.2 Å²	46.2	44%	0.444	25%	0.245	S	C	.	.	H	α-helix	trans	-63.5	-34.2	175.4	-58.8	-76.8	0	0	0	112.3	D629 K635	D629-N631 VanDerWaalsContact C-N 3.27Å; D629-N631 PolarHBondContact O-N 3.43Å; D629-N631 PolarHBondContact OD1-N 3.49Å; D629-N631 WeakPolarHBondContact OD2-CB 3.48Å; D629-N631 PolarHBondContact OD2-ND2 3.27Å; N631-K635 WeakPolarHBondContact O-CB 3.22Å; N631-K635 VanDerWaalsContact O-CD 3.24Å; N631-K635 WeakPolarHBondContact O-CD 3.39Å; N631-K635 WeakPolarHBondContact O-CG 3.46Å; N631-K635 PolarHBondContact O-N 2.9Å; N631-K635 VanDerWaalsContact O-N 3.08Å
632	T	91.7	Very high	88.8	Confident	29 Å²	29	50.4 Å²	50.4	18%	0.178	27%	0.268	C	S	.	.	H	α-helix	trans	-68.1	-39.7	175.7	-61.2	0	0	0	0	111	F628 D629 F630 K635 R636	F628-T632 HydrophobicContact CD2-CG2 3.71Å; F628-T632 HydrophobicContact CE2-CG2 3.84Å; F628-T632 HydrophobicContact CG-CG2 4.48Å; D629-T632 WeakPolarHBondContact O-CA 3.48Å; D629-T632 WeakPolarHBondContact O-CB 3.41Å; D629-T632 PolarHBondContact O-N 3.21Å; D629-T632 VanDerWaalsContact OD1-CB 3.24Å; D629-T632 WeakPolarHBondContact OD1-CB 3.43Å; D629-T632 PolarHBondContact OD1-N 3.08Å; D629-T632 PolarHBondContact OD1-OG1 3.45Å; F630-T632 VanDerWaalsContact C-N 3.27Å; F630-T632 PolarHBondContact O-N 2.88Å; T632-K635 PolarHBondContact O-N 2.95Å; T632-R636 HydrophobicContact CG2-CG 4.45Å; T632-R636 WeakPolarHBondContact O-CG 3.34Å; T632-R636 PolarHBondContact O-N 3.23Å; T632-R636 VanDerWaalsContact O-N 3.15Å
633	L	91.8	Very high	88.1	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-60.5	-52.1	174.1	-176.4	61.4	0	0	0	111.7	W599 L617 F628 D629 F630 K635 R636 L637 L649 L653	W599-L633 HydrophobicContact CH2-CD2 4.18Å; W599-L633 HydrophobicContact CZ3-CD2 4.33Å; L617-L633 HydrophobicContact CD1-CD1 4.09Å; L617-L633 HydrophobicContact CD2-CD1 3.42Å; L617-L633 VanDerWaalsContact CD2-CD1 3.42Å; L617-L633 HydrophobicContact CG-CD1 4.4Å; F628-L633 HydrophobicContact CE1-CB 4.43Å; F628-L633 HydrophobicContact CZ-CB 4.02Å; F628-L633 HydrophobicContact CZ-CD1 4.25Å; D629-L633 PolarHBondContact O-N 2.85Å; D629-L633 VanDerWaalsContact O-N 3.1Å; F630-L633 WeakPolarHBondContact O-CB 3.48Å; F630-L633 PolarHBondContact O-N 3.41Å; L633-K635 VanDerWaalsContact C-N 3.31Å; L633-K635 PolarHBondContact O-N 3.26Å; L633-R636 PolarHBondContact O-N 2.89Å; L633-L637 HydrophobicContact CD1-CD1 3.61Å; L633-L637 HydrophobicContact CD1-CG 4.1Å; L633-L637 HydrophobicContact CG-CD1 3.94Å; L633-L637 PolarHBondContact O-N 3.26Å; L633-L649 HydrophobicContact CD2-CD1 3.98Å; L633-L649 HydrophobicContact CD2-CD2 3.96Å; L633-L649 HydrophobicContact CD2-CG 4Å; L633-L649 HydrophobicContact CG-CD2 4.36Å; L633-L653 HydrophobicContact CB-CD2 4.42Å; L633-L653 HydrophobicContact CD2-CD1 4.18Å; L633-L653 HydrophobicContact CD2-CD2 3.87Å; L633-L653 HydrophobicContact CD2-CG 4.41Å
634	I	90.1	Very high	87.6	Confident	19 Å²	19	58.9 Å²	58.9	10%	0.097	33%	0.326	C	S	.	.	H	α-helix	trans	-54.9	-46.6	175.8	-69	166	0	0	0	111.1	F630 R636 L637 H638 I639 V646	F630-I634 HydrophobicContact CD1-CD1 4.06Å; F630-I634 HydrophobicContact CD2-CD1 4.45Å; F630-I634 HydrophobicContact CE1-CD1 3.47Å; F630-I634 VanDerWaalsContact CE1-CD1 3.47Å; F630-I634 HydrophobicContact CE2-CD1 3.9Å; F630-I634 HydrophobicContact CE2-CG1 4.11Å; F630-I634 HydrophobicContact CZ-CD1 3.38Å; F630-I634 HydrophobicContact CZ-CG1 4.07Å; F630-I634 PolarHBondContact O-N 2.94Å; F630-I634 VanDerWaalsContact O-N 3.08Å; I634-R636 PolarHBondContact O-N 3.31Å; I634-R636 VanDerWaalsContact O-N 3.16Å; I634-L637 PolarHBondContact O-N 2.87Å; I634-H638 PolarHBondContact O-N 3.46Å; I634-I639 HydrophobicContact CG2-CB 4.41Å; I634-I639 WeakPolarHBondContact CG2-O 3.44Å; I634-V646 HydrophobicContact CD1-CG2 4.43Å
635	K	89.1	Confident	87.1	Confident	130 Å²	130	59.7 Å²	59.7	57%	0.565	33%	0.332	S	S	*	.	H	α-helix	trans	-69.1	-7	179.8	-71.4	166.4	-167.8	163.2	0	114.9	K552 N631 T632 L633	K552-K635 PolarHBondContact NZ-O 2.94Å; N631-K635 WeakPolarHBondContact O-CB 3.22Å; N631-K635 VanDerWaalsContact O-CD 3.24Å; N631-K635 WeakPolarHBondContact O-CD 3.39Å; N631-K635 WeakPolarHBondContact O-CG 3.46Å; N631-K635 PolarHBondContact O-N 2.9Å; N631-K635 VanDerWaalsContact O-N 3.08Å; T632-K635 PolarHBondContact O-N 2.95Å; L633-K635 VanDerWaalsContact C-N 3.31Å; L633-K635 PolarHBondContact O-N 3.26Å
636	R	88.1	Confident	86.8	Confident	14 Å²	14	60 Å²	60	5%	0.053	34%	0.335	C	S	.	.	H	α-helix	trans	-103.1	-36.1	175.9	-70.6	-82	-171.8	158.3	7.2	111.6	K552 S615 Y621 T632 L633 I634	K552-R636 PolarHBondContact O-NH1 3.47Å; K552-R636 PolarHBondContact O-NH2 2.83Å; S615-R636 VanDerWaalsContact O-CD 3.3Å; S615-R636 WeakPolarHBondContact O-CD 3.39Å; S615-R636 PolarHBondContact O-NH1 3.06Å; Y621-R636 VanDerWaalsContact CZ-NH2 3.3Å; Y621-R636 PolarHBondContact OH-NH2 2.85Å; T632-R636 HydrophobicContact CG2-CG 4.45Å; T632-R636 WeakPolarHBondContact O-CG 3.34Å; T632-R636 PolarHBondContact O-N 3.23Å; T632-R636 VanDerWaalsContact O-N 3.15Å; L633-R636 PolarHBondContact O-N 2.89Å; I634-R636 PolarHBondContact O-N 3.31Å; I634-R636 VanDerWaalsContact O-N 3.16Å
637	L	88.1	Confident	86.6	Confident	9 Å²	9	58.3 Å²	58.3	5%	0.047	33%	0.326	C	S	.	.	H	α-helix	trans	-90.5	-3.3	178.8	-63.1	177.1	0	0	0	113.8	L600 I612 L617 L633 I634 I639	L600-L637 HydrophobicContact CD1-CD1 3.68Å; L600-L637 HydrophobicContact CD1-CD2 3.87Å; L600-L637 HydrophobicContact CD1-CG 4.45Å; L600-L637 HydrophobicContact CD2-CD1 3.9Å; L600-L637 HydrophobicContact CG-CD1 4.45Å; I612-L637 HydrophobicContact CB-CD2 4.37Å; I612-L637 HydrophobicContact CD1-CD2 3.68Å; I612-L637 HydrophobicContact CG1-CD2 3.74Å; L617-L637 HydrophobicContact CD2-CD2 4.01Å; L617-L637 HydrophobicContact CD2-CG 4.28Å; L633-L637 HydrophobicContact CD1-CD1 3.61Å; L633-L637 HydrophobicContact CD1-CG 4.1Å; L633-L637 HydrophobicContact CG-CD1 3.94Å; L633-L637 PolarHBondContact O-N 3.26Å; I634-L637 PolarHBondContact O-N 2.87Å; L637-I639 HydrophobicContact CB-CD1 3.74Å; L637-I639 HydrophobicContact CB-CG1 3.69Å; L637-I639 HydrophobicContact CD1-CD1 3.78Å; L637-I639 HydrophobicContact CG-CD1 4.43Å; L637-I639 PolarHBondContact O-N 2.83Å; L637-I639 VanDerWaalsContact O-N 3.16Å
638	H	86.3	Confident	86.4	Confident	158 Å²	158	58.5 Å²	58.5	73%	0.731	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.4	28.9	-179.5	-69.3	-100	0	0	0	114.3	I634 P640	I634-H638 PolarHBondContact O-N 3.46Å; H638-P640 WeakPolarHBondContact O-CD 3.28Å
639	I	83.2	Confident	86.2	Confident	8 Å²	8	58.5 Å²	58.5	4%	0.041	32%	0.318	C	S	.	.			trans	-68.4	124.3	-177	-62.1	171.5	0	0	0	110.1	F608 I634 L637 V645 L649	F608-I639 HydrophobicContact CB-CD1 4.29Å; F608-I639 HydrophobicContact CB-CG1 3.79Å; F608-I639 HydrophobicContact CD1-CB 4.42Å; F608-I639 HydrophobicContact CD1-CG1 3.96Å; F608-I639 HydrophobicContact CD1-CG2 4.48Å; F608-I639 HydrophobicContact CD2-CG1 4.34Å; F608-I639 HydrophobicContact CE1-CG2 4.45Å; F608-I639 HydrophobicContact CG-CD1 4.44Å; F608-I639 HydrophobicContact CG-CG1 3.75Å; I634-I639 HydrophobicContact CG2-CB 4.41Å; I634-I639 WeakPolarHBondContact CG2-O 3.44Å; L637-I639 HydrophobicContact CB-CD1 3.74Å; L637-I639 HydrophobicContact CB-CG1 3.69Å; L637-I639 HydrophobicContact CD1-CD1 3.78Å; L637-I639 HydrophobicContact CG-CD1 4.43Å; L637-I639 PolarHBondContact O-N 2.83Å; L637-I639 VanDerWaalsContact O-N 3.16Å; I639-V645 HydrophobicContact CG2-CG1 3.75Å; I639-L649 HydrophobicContact CD1-CD2 3.49Å; I639-L649 VanDerWaalsContact CD1-CD2 3.49Å
640	P	79.9	Confident	86.3	Confident	82 Å²	82	59.7 Å²	59.7	53%	0.532	32%	0.322	S	S	.	.			trans	-61	149.4	171.4	-21.7	34	0	0	0	111.6	F608 H638 N642	F608-P640 HydrophobicContact CE1-CG 4.29Å; H638-P640 WeakPolarHBondContact O-CD 3.28Å; P640-N642 PolarHBondContact O-N 3.44Å
641	L	78.6	Confident	86.2	Confident	148 Å²	148	65 Å²	65	78%	0.775	35%	0.347	S	S	*	.			trans	-75.3	57.7	-176.2	-65.3	173	0	0	0	113.3	V646	L641-V646 HydrophobicContact CD2-CG2 4.47Å
642	N	81.1	Confident	86.2	Confident	93 Å²	93	62.3 Å²	62.3	50%	0.497	33%	0.333	S	S	.	.			trans	-81.4	116.4	168.2	179.1	-16.5	0	0	0	109.4	P640 A644 V645 V646	P640-N642 PolarHBondContact O-N 3.44Å; N642-A644 VanDerWaalsContact C-N 3.26Å; N642-A644 PolarHBondContact O-N 2.91Å; N642-A644 VanDerWaalsContact O-N 3.16Å; N642-A644 PolarHBondContact OD1-N 3.44Å; N642-A644 VanDerWaalsContact OD1-N 3.11Å; N642-V645 HydrophobicContact CB-CB 4.38Å; N642-V645 HydrophobicContact CB-CG2 4.43Å; N642-V645 PolarHBondContact O-N 2.98Å; N642-V645 VanDerWaalsContact O-N 3.16Å; N642-V646 WeakPolarHBondContact O-CB 3.44Å; N642-V646 VanDerWaalsContact O-CG2 3.23Å; N642-V646 WeakPolarHBondContact O-CG2 3.46Å; N642-V646 PolarHBondContact O-N 3.42Å
643	V	80.7	Confident	86.2	Confident	108 Å²	108	60.9 Å²	60.9	66%	0.655	32%	0.324	S	S	*	.	H	α-helix	trans	-50.9	-41.6	-176.2	-177.5	0	0	0	0	112.7	V646 C647	V643-V646 PolarHBondContact O-N 3.07Å; V643-C647 WeakPolarHBondContact O-CB 3.49Å; V643-C647 PolarHBondContact O-N 3.28Å; V643-C647 PolarHBondContact O-SG 2.84Å
644	A	82.5	Confident	86.2	Confident	70 Å²	70	63.9 Å²	63.9	58%	0.579	34%	0.338	S	S	*	.	H	α-helix	trans	-66.8	-44.4	-177.7	0	0	0	0	0	112.7	N642 K648	N642-A644 VanDerWaalsContact C-N 3.26Å; N642-A644 PolarHBondContact O-N 2.91Å; N642-A644 VanDerWaalsContact O-N 3.16Å; N642-A644 PolarHBondContact OD1-N 3.44Å; N642-A644 VanDerWaalsContact OD1-N 3.11Å; A644-K648 WeakPolarHBondContact O-CB 3.35Å; A644-K648 PolarHBondContact O-N 3.26Å; A644-K648 VanDerWaalsContact O-N 3.16Å
645	V	82.7	Confident	86.2	Confident	26 Å²	26	69.6 Å²	69.6	16%	0.158	36%	0.358	C	S	.	.	H	α-helix	trans	-65.8	-43.4	175.7	169.2	0	0	0	0	110.6	L605 F608 I639 N642 L649	L605-V645 HydrophobicContact CD1-CG1 4.42Å; L605-V645 HydrophobicContact CD2-CB 4.43Å; L605-V645 HydrophobicContact CD2-CG1 3.65Å; L605-V645 HydrophobicContact CD2-CG2 4.15Å; F608-V645 HydrophobicContact CE2-CG1 4.28Å; I639-V645 HydrophobicContact CG2-CG1 3.75Å; N642-V645 HydrophobicContact CB-CB 4.38Å; N642-V645 HydrophobicContact CB-CG2 4.43Å; N642-V645 PolarHBondContact O-N 2.98Å; N642-V645 VanDerWaalsContact O-N 3.16Å; V645-L649 VanDerWaalsContact O-CB 3.27Å; V645-L649 WeakPolarHBondContact O-CB 3.42Å; V645-L649 PolarHBondContact O-N 3.49Å
646	V	84.6	Confident	86.3	Confident	26 Å²	26	65.3 Å²	65.3	16%	0.158	34%	0.342	C	S	.	.	H	α-helix	trans	-60.5	-53.3	179.8	165.7	0	0	0	0	110.8	F630 I634 L641 N642 V643 K648 L649 E650	F630-V646 HydrophobicContact CE1-CG1 3.72Å; F630-V646 HydrophobicContact CZ-CB 4.28Å; F630-V646 HydrophobicContact CZ-CG1 3.7Å; F630-V646 WeakPolarHBondContact CZ-O 3.4Å; I634-V646 HydrophobicContact CD1-CG2 4.43Å; L641-V646 HydrophobicContact CD2-CG2 4.47Å; N642-V646 WeakPolarHBondContact O-CB 3.44Å; N642-V646 VanDerWaalsContact O-CG2 3.23Å; N642-V646 WeakPolarHBondContact O-CG2 3.46Å; N642-V646 PolarHBondContact O-N 3.42Å; V643-V646 PolarHBondContact O-N 3.07Å; V646-K648 PolarHBondContact O-N 3.43Å; V646-L649 PolarHBondContact O-N 3.32Å; V646-E650 WeakPolarHBondContact O-CB 3.12Å; V646-E650 PolarHBondContact O-N 3.38Å
647	C	84.8	Confident	86.5	Confident	59 Å²	59	64.9 Å²	64.9	40%	0.399	34%	0.34	S	S	.	.	H	α-helix	trans	-60.6	-47.2	178.8	-66.5	0	0	0	0	111.9	V643 L649 E650 E651	V643-C647 WeakPolarHBondContact O-CB 3.49Å; V643-C647 PolarHBondContact O-N 3.28Å; V643-C647 PolarHBondContact O-SG 2.84Å; C647-L649 VanDerWaalsContact C-N 3.34Å; C647-L649 PolarHBondContact O-N 3.38Å; C647-E650 PolarHBondContact O-N 3.45Å; C647-E651 WeakPolarHBondContact O-CG 3.31Å; C647-E651 PolarHBondContact O-N 3.48Å
648	K	86.2	Confident	86.5	Confident	98 Å²	98	70.3 Å²	70.3	43%	0.426	36%	0.363	S	S	.	.	H	α-helix	trans	-58.6	-45.5	177.9	-170.9	-179.3	-174.8	-174.8	0	111.2	L603 A644 V646 N652	L603-K648 WeakPolarHBondContact O-CE 3.1Å; L603-K648 PolarHBondContact O-NZ 3.14Å; A644-K648 WeakPolarHBondContact O-CB 3.35Å; A644-K648 PolarHBondContact O-N 3.26Å; A644-K648 VanDerWaalsContact O-N 3.16Å; V646-K648 PolarHBondContact O-N 3.43Å; K648-N652 WeakPolarHBondContact O-CB 3.46Å; K648-N652 PolarHBondContact O-N 2.94Å; K648-N652 VanDerWaalsContact O-N 3.16Å; K648-N652 PolarHBondContact O-ND2 3.27Å
649	L	90.2	Very high	86.6	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-69.4	-38.1	-179.6	-175.2	63.4	0	0	0	112.3	W599 L600 L603 L605 F630 L633 I639 V645 V646 C647 L653	W599-L649 HydrophobicContact CH2-CD1 3.63Å; W599-L649 HydrophobicContact CZ2-CD1 4.31Å; W599-L649 HydrophobicContact CZ3-CD1 4.14Å; L600-L649 HydrophobicContact CD2-CD1 4.03Å; L603-L649 HydrophobicContact CD1-CD1 4.05Å; L605-L649 HydrophobicContact CD1-CB 4.25Å; L605-L649 HydrophobicContact CD1-CD1 3.93Å; L605-L649 HydrophobicContact CD1-CG 4.47Å; F630-L649 HydrophobicContact CE2-CB 3.95Å; F630-L649 HydrophobicContact CE2-CD2 4.03Å; F630-L649 HydrophobicContact CE2-CG 3.87Å; L633-L649 HydrophobicContact CD2-CD1 3.98Å; L633-L649 HydrophobicContact CD2-CD2 3.96Å; L633-L649 HydrophobicContact CD2-CG 4Å; L633-L649 HydrophobicContact CG-CD2 4.36Å; I639-L649 HydrophobicContact CD1-CD2 3.49Å; I639-L649 VanDerWaalsContact CD1-CD2 3.49Å; V645-L649 VanDerWaalsContact O-CB 3.27Å; V645-L649 WeakPolarHBondContact O-CB 3.42Å; V645-L649 PolarHBondContact O-N 3.49Å; V646-L649 PolarHBondContact O-N 3.32Å; C647-L649 VanDerWaalsContact C-N 3.34Å; C647-L649 PolarHBondContact O-N 3.38Å; L649-L653 WeakPolarHBondContact O-CB 3.48Å; L649-L653 PolarHBondContact O-N 3.28Å
650	E	90.5	Very high	86.9	Confident	83 Å²	83	66 Å²	66	39%	0.388	35%	0.35	S	S	.	.	H	α-helix	trans	-63.9	-49.5	178.1	-173.5	162.6	-158.3	0	0	111.5	F630 V646 C647 N652 L653 Q654	F630-E650 HydrophobicContact CB-CG 4.46Å; F630-E650 HydrophobicContact CD1-CB 4Å; F630-E650 HydrophobicContact CD1-CG 3.94Å; F630-E650 HydrophobicContact CD2-CB 3.92Å; F630-E650 HydrophobicContact CD2-CG 4.27Å; F630-E650 HydrophobicContact CE1-CB 3.8Å; F630-E650 HydrophobicContact CE1-CG 4.21Å; F630-E650 HydrophobicContact CE2-CB 3.74Å; F630-E650 HydrophobicContact CG-CB 4.05Å; F630-E650 HydrophobicContact CG-CG 3.97Å; F630-E650 HydrophobicContact CZ-CB 3.67Å; V646-E650 WeakPolarHBondContact O-CB 3.12Å; V646-E650 PolarHBondContact O-N 3.38Å; C647-E650 PolarHBondContact O-N 3.45Å; E650-N652 PolarHBondContact O-N 3.41Å; E650-L653 PolarHBondContact O-N 3.26Å; E650-Q654 HydrophobicContact CG-CG 4.28Å; E650-Q654 WeakPolarHBondContact O-CB 3.22Å; E650-Q654 VanDerWaalsContact O-CG 3.22Å; E650-Q654 WeakPolarHBondContact O-CG 3.35Å; E650-Q654 PolarHBondContact O-N 3.09Å
651	E	89	Confident	87.5	Confident	121 Å²	121	63.1 Å²	63.1	57%	0.565	33%	0.329	S	S	*	.	H	α-helix	trans	-59.3	-45.7	177.9	-71.7	177.9	-172	0	0	112.1	C647 Q654 R655	C647-E651 WeakPolarHBondContact O-CG 3.31Å; C647-E651 PolarHBondContact O-N 3.48Å; E651-Q654 PolarHBondContact O-N 3.31Å; E651-R655 WeakPolarHBondContact O-CB 3.33Å; E651-R655 PolarHBondContact O-N 2.95Å
652	N	91.2	Very high	87.9	Confident	27 Å²	27	62 Å²	62	14%	0.144	32%	0.322	C	S	.	.	H	α-helix	trans	-66.4	-42.5	179.4	-79	-78.9	0	0	0	111.9	W599 L603 K648 E650 R655 I656	W599-N652 HydrophobicContact CZ2-CB 4.18Å; L603-N652 HydrophobicContact CD1-CB 3.85Å; L603-N652 HydrophobicContact CD2-CB 3.95Å; L603-N652 WeakPolarHBondContact CD2-OD1 3.39Å; K648-N652 WeakPolarHBondContact O-CB 3.46Å; K648-N652 PolarHBondContact O-N 2.94Å; K648-N652 VanDerWaalsContact O-N 3.16Å; K648-N652 PolarHBondContact O-ND2 3.27Å; E650-N652 PolarHBondContact O-N 3.41Å; N652-R655 PolarHBondContact O-N 2.87Å; N652-R655 PolarHBondContact OD1-NH1 3.34Å; N652-I656 PolarHBondContact O-N 3.19Å
653	L	91.9	Very high	88.1	Confident	0 Å²	0	65 Å²	65	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-61	-47.2	174.5	178.3	64.3	0	0	0	111.5	W599 M622 F630 L633 L649 E650 R655 I656 L657	W599-L653 HydrophobicContact CH2-CB 4.48Å; W599-L653 HydrophobicContact CH2-CD1 4.49Å; M622-L653 HydrophobicContact CE-CD1 3.34Å; F630-L653 HydrophobicContact CB-CD2 3.97Å; F630-L653 HydrophobicContact CD2-CD2 4.05Å; L633-L653 HydrophobicContact CB-CD2 4.42Å; L633-L653 HydrophobicContact CD2-CD1 4.18Å; L633-L653 HydrophobicContact CD2-CD2 3.87Å; L633-L653 HydrophobicContact CD2-CG 4.41Å; L649-L653 WeakPolarHBondContact O-CB 3.48Å; L649-L653 PolarHBondContact O-N 3.28Å; E650-L653 PolarHBondContact O-N 3.26Å; L653-R655 PolarHBondContact O-N 3.39Å; L653-I656 WeakPolarHBondContact O-CG1 3.28Å; L653-I656 PolarHBondContact O-N 3.09Å; L653-L657 HydrophobicContact CD1-CB 4.27Å; L653-L657 HydrophobicContact CD1-CD2 4.17Å; L653-L657 HydrophobicContact CG-CD2 4.23Å; L653-L657 WeakPolarHBondContact O-CB 3.46Å; L653-L657 PolarHBondContact O-N 3.05Å
654	Q	90.5	Very high	88.3	Confident	62 Å²	62	62 Å²	62	29%	0.29	31%	0.306	S	S	.	.	H	α-helix	trans	-65	-30.2	-179.3	-67.5	-66.9	-15.1	0	0	112.2	E650 E651 K658	E650-Q654 HydrophobicContact CG-CG 4.28Å; E650-Q654 WeakPolarHBondContact O-CB 3.22Å; E650-Q654 VanDerWaalsContact O-CG 3.22Å; E650-Q654 WeakPolarHBondContact O-CG 3.35Å; E650-Q654 PolarHBondContact O-N 3.09Å; E651-Q654 PolarHBondContact O-N 3.31Å; Q654-K658 WeakPolarHBondContact O-CB 3.22Å; Q654-K658 VanDerWaalsContact O-CG 3.32Å; Q654-K658 WeakPolarHBondContact O-CG 3.43Å; Q654-K658 PolarHBondContact O-N 3.18Å
655	R	90.4	Very high	88.2	Confident	139 Å²	139	60.1 Å²	60.1	53%	0.525	29%	0.292	S	S	.	.	H	α-helix	trans	-66.6	-43.5	176.3	-163.2	179.9	-53.1	104.4	4.6	112.4	E651 N652 L653 P659	E651-R655 WeakPolarHBondContact O-CB 3.33Å; E651-R655 PolarHBondContact O-N 2.95Å; N652-R655 PolarHBondContact O-N 2.87Å; N652-R655 PolarHBondContact OD1-NH1 3.34Å; L653-R655 PolarHBondContact O-N 3.39Å; R655-P659 WeakPolarHBondContact O-CD 3.47Å; R655-P659 VanDerWaalsContact O-CG 3.32Å; R655-P659 WeakPolarHBondContact O-CG 3.46Å
656	I	91.1	Very high	88.1	Confident	41 Å²	41	59.6 Å²	59.6	21%	0.21	29%	0.289	C	S	.	.	H	α-helix	trans	-83.7	-34	179.8	63.9	177.9	0	0	0	113.1	L588 W591 W599 M622 N652 L653	L588-I656 HydrophobicContact CD1-CD1 4.06Å; L588-I656 HydrophobicContact CD2-CB 4.28Å; L588-I656 HydrophobicContact CD2-CD1 4.25Å; L588-I656 HydrophobicContact CD2-CG1 3.98Å; W591-I656 HydrophobicContact CH2-CD1 4.1Å; W591-I656 HydrophobicContact CZ3-CD1 4.03Å; W599-I656 HydrophobicContact CD2-CD1 4.31Å; W599-I656 HydrophobicContact CH2-CD1 4.18Å; W599-I656 HydrophobicContact CZ2-CD1 3.6Å; M622-I656 HydrophobicContact CE-CD1 4.49Å; N652-I656 PolarHBondContact O-N 3.19Å; L653-I656 WeakPolarHBondContact O-CG1 3.28Å; L653-I656 PolarHBondContact O-N 3.09Å
657	L	92.1	Very high	87.1	Confident	4 Å²	4	62.9 Å²	62.9	2%	0.021	31%	0.313	C	S	.	.	H	α-helix	trans	-80.1	-35.3	-170.4	-175.2	59.3	0	0	0	113.5	L588 M622 F628 L653 R661	L588-L657 HydrophobicContact CD2-CB 4.35Å; L588-L657 HydrophobicContact CD2-CD1 3.98Å; M622-L657 HydrophobicContact CB-CD1 4.3Å; M622-L657 WeakPolarHBondContact O-CD1 3.44Å; F628-L657 HydrophobicContact CD1-CD2 4.5Å; L653-L657 HydrophobicContact CD1-CB 4.27Å; L653-L657 HydrophobicContact CD1-CD2 4.17Å; L653-L657 HydrophobicContact CG-CD2 4.23Å; L653-L657 WeakPolarHBondContact O-CB 3.46Å; L653-L657 PolarHBondContact O-N 3.05Å; L657-R661 HydrophobicContact CD1-CG 4.14Å; L657-R661 WeakPolarHBondContact O-CB 3.32Å; L657-R661 WeakPolarHBondContact O-CG 3.49Å; L657-R661 PolarHBondContact O-N 3.23Å; L657-R661 VanDerWaalsContact O-N 3.09Å
658	K	88.7	Confident	85.8	Confident	123 Å²	123	64.3 Å²	64.3	54%	0.535	32%	0.32	S	S	.	.	H	α-helix	trans	-65	-50.1	179.7	-69	174.6	-173.8	172	0	112.1	Q654 A660 R661 I662	Q654-K658 WeakPolarHBondContact O-CB 3.22Å; Q654-K658 VanDerWaalsContact O-CG 3.32Å; Q654-K658 WeakPolarHBondContact O-CG 3.43Å; Q654-K658 PolarHBondContact O-N 3.18Å; K658-A660 PolarHBondContact O-N 3.29Å; K658-R661 PolarHBondContact O-N 2.85Å; K658-I662 WeakPolarHBondContact O-CD1 3.44Å; K658-I662 VanDerWaalsContact O-CG1 3.24Å; K658-I662 WeakPolarHBondContact O-CG1 3.37Å; K658-I662 PolarHBondContact O-N 2.87Å
659	P	89.2	Confident	84	Confident	71 Å²	71	68.7 Å²	68.7	46%	0.461	34%	0.339	S	S	.	.	H	α-helix	trans	-59.7	-45.4	178.4	-24.1	35.5	0	0	0	112.7	R655 R661 I662 R663	R655-P659 WeakPolarHBondContact O-CD 3.47Å; R655-P659 VanDerWaalsContact O-CG 3.32Å; R655-P659 WeakPolarHBondContact O-CG 3.46Å; P659-R661 PolarHBondContact O-N 2.83Å; P659-I662 PolarHBondContact O-N 3.16Å; P659-R663 WeakPolarHBondContact O-CG 3.4Å; P659-R663 PolarHBondContact O-N 2.96Å
660	A	89.4	Confident	81.5	Confident	4 Å²	4	77 Å²	77	3%	0.033	38%	0.378	C	S	.	.	H	α-helix	trans	-60.3	-46.1	179.3	0	0	0	0	0	112.3	L588 V623 K658 I662 R663 E664	L588-A660 HydrophobicContact CB-CB 3.76Å; L588-A660 HydrophobicContact CD2-CB 4.24Å; V623-A660 HydrophobicContact CG1-CB 4.21Å; V623-A660 HydrophobicContact CG2-CB 3.73Å; K658-A660 PolarHBondContact O-N 3.29Å; A660-I662 VanDerWaalsContact C-N 3.33Å; A660-I662 PolarHBondContact O-N 2.84Å; A660-R663 PolarHBondContact O-N 3.06Å; A660-E664 PolarHBondContact O-N 3.29Å; A660-E664 VanDerWaalsContact O-N 3.1Å
661	R	91.5	Very high	78.8	Confident	22 Å²	22	81 Å²	81	8%	0.083	40%	0.396	C	S	.	.	H	α-helix	trans	-65.4	-33.1	176.1	-77.5	-176.1	173.5	166.2	3.4	113.7	M622 V623 D625 F628 L657 K658 P659 E664 G665 I666	M622-R661 PolarHBondContact O-NE 2.99Å; M622-R661 PolarHBondContact O-NH2 3.17Å; V623-R661 HydrophobicContact CG1-CG 4.2Å; V623-R661 PolarHBondContact O-NE 3.39Å; D625-R661 PolarHBondContact O-NH2 3.07Å; F628-R661 PolarHBondContact O-NH1 2.94Å; F628-R661 VanDerWaalsContact O-NH1 3.17Å; F628-R661 PolarHBondContact O-NH2 3.44Å; L657-R661 HydrophobicContact CD1-CG 4.14Å; L657-R661 WeakPolarHBondContact O-CB 3.32Å; L657-R661 WeakPolarHBondContact O-CG 3.49Å; L657-R661 PolarHBondContact O-N 3.23Å; L657-R661 VanDerWaalsContact O-N 3.09Å; K658-R661 PolarHBondContact O-N 2.85Å; P659-R661 PolarHBondContact O-N 2.83Å; R661-E664 PolarHBondContact O-N 2.73Å; R661-G665 PolarHBondContact O-N 3.06Å; R661-I666 HydrophobicContact CB-CB 4.16Å; R661-I666 HydrophobicContact CG-CB 4.31Å; R661-I666 HydrophobicContact CG-CG2 4.48Å; R661-I666 PolarHBondContact O-N 3.48Å
662	I	87.4	Confident	76.2	Confident	125 Å²	125	86.2 Å²	86.2	64%	0.641	41%	0.411	S	S	*	.	H	α-helix	trans	-65.9	-44.5	175.4	-71	163.8	0	0	0	110.3	K658 P659 A660 E664 G665	K658-I662 WeakPolarHBondContact O-CD1 3.44Å; K658-I662 VanDerWaalsContact O-CG1 3.24Å; K658-I662 WeakPolarHBondContact O-CG1 3.37Å; K658-I662 PolarHBondContact O-N 2.87Å; P659-I662 PolarHBondContact O-N 3.16Å; A660-I662 VanDerWaalsContact C-N 3.33Å; A660-I662 PolarHBondContact O-N 2.84Å; I662-E664 VanDerWaalsContact C-N 3.33Å; I662-E664 PolarHBondContact O-N 2.86Å; I662-G665 PolarHBondContact O-N 3.5Å; I662-G665 VanDerWaalsContact O-N 3.14Å
663	R	85.8	Confident	73.5	Confident	155 Å²	155	92.3 Å²	92.3	59%	0.585	44%	0.441	S	S	*	.	H	α-helix	trans	-59.9	-41.6	176	-68.6	174.2	69.2	-91.1	5.3	112.1	D587 P659 A660 G665	D587-R663 IonicContact OD1-NH1 2.66Å; D587-R663 PolarHBondContact OD1-NH1 3.48Å; D587-R663 IonicContact OD2-CZ 3.37Å; D587-R663 IonicContact OD2-NH1 2.84Å; D587-R663 PolarHBondContact OD2-NH1 3.29Å; D587-R663 IonicContact OD2-NH2 2.68Å; P659-R663 WeakPolarHBondContact O-CG 3.4Å; P659-R663 PolarHBondContact O-N 2.96Å; A660-R663 PolarHBondContact O-N 3.06Å; R663-G665 PolarHBondContact O-N 2.88Å
664	E	84.5	Confident	70.7	Confident	47 Å²	47	101 Å²	101	22%	0.22	48%	0.48	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	3.8	177.3	-68.8	-56.5	114.4	0	0	115.3	R510 L589 V623 L624 A660 R661 I662 I666	R510-E664 PolarHBondContact NH2-O 2.94Å; L589-E664 HydrophobicContact CD2-CG 4.44Å; V623-E664 HydrophobicContact CG1-CB 4.2Å; V623-E664 HydrophobicContact CG1-CG 3.67Å; L624-E664 HydrophobicContact CD2-CG 4.14Å; A660-E664 PolarHBondContact O-N 3.29Å; A660-E664 VanDerWaalsContact O-N 3.1Å; R661-E664 PolarHBondContact O-N 2.73Å; I662-E664 VanDerWaalsContact C-N 3.33Å; I662-E664 PolarHBondContact O-N 2.86Å; E664-I666 HydrophobicContact CB-CD1 3.82Å; E664-I666 HydrophobicContact CB-CG1 3.87Å; E664-I666 PolarHBondContact O-N 3.48Å
665	G	81.3	Confident	68	Low	29 Å²	29	109 Å²	109	30%	0.299	51%	0.507	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.5	13.5	-178.4	0	0	0	0	0	114.9	R661 I662 R663 S667	R661-G665 PolarHBondContact O-N 3.06Å; I662-G665 PolarHBondContact O-N 3.5Å; I662-G665 VanDerWaalsContact O-N 3.14Å; R663-G665 PolarHBondContact O-N 2.88Å; G665-S667 PolarHBondContact O-N 3.18Å
666	I	80.2	Confident	65.3	Low	15 Å²	15	113.6 Å²	113.6	8%	0.077	52%	0.524	C	S	.	.			trans	-84.4	82.8	-174.1	-56.4	176.5	0	0	0	109.3	V623 L624 T626 R661 E664 T668	V623-I666 HydrophobicContact CG1-CD1 4.38Å; V623-I666 WeakPolarHBondContact O-CD1 3.41Å; L624-I666 HydrophobicContact CD2-CD1 4.05Å; T626-I666 HydrophobicContact CG2-CG2 3.73Å; R661-I666 HydrophobicContact CB-CB 4.16Å; R661-I666 HydrophobicContact CG-CB 4.31Å; R661-I666 HydrophobicContact CG-CG2 4.48Å; R661-I666 PolarHBondContact O-N 3.48Å; E664-I666 HydrophobicContact CB-CD1 3.82Å; E664-I666 HydrophobicContact CB-CG1 3.87Å; E664-I666 PolarHBondContact O-N 3.48Å; I666-T668 PolarHBondContact O-N 3.29Å; I666-T668 VanDerWaalsContact O-N 3.11Å
667	S	63.4	Low	62.6	Low	95 Å²	95	123 Å²	123	66%	0.664	56%	0.557	S	S	*	*			trans	-65.1	111.5	169.4	-176.1	0	0	0	0	110	G665 K669	G665-S667 PolarHBondContact O-N 3.18Å; S667-K669 VanDerWaalsContact C-N 3.28Å; S667-K669 PolarHBondContact O-N 3.04Å
668	T	57.7	Low	59.9	Low	89 Å²	89	127.7 Å²	127.7	55%	0.546	59%	0.59	S	S	.	*			trans	-65.1	94.1	162.5	47.5	0	0	0	0	107.7	I666 Q670	I666-T668 PolarHBondContact O-N 3.29Å; I666-T668 VanDerWaalsContact O-N 3.11Å; T668-Q670 PolarHBondContact O-N 3.11Å
669	K	48.6	Very low	57.4	Low	190 Å²	190	129 Å²	129	83%	0.826	60%	0.602	S	S	*	*			trans	-62.2	92.6	166.6	-74.2	-178	-179	173.7	0	107.2	S667 H671	S667-K669 VanDerWaalsContact C-N 3.28Å; S667-K669 PolarHBondContact O-N 3.04Å; K669-H671 PolarHBondContact O-N 3.32Å; K669-H671 VanDerWaalsContact O-N 3.1Å
670	Q	37.7	Very low	54.7	Low	175 Å²	175	131 Å²	131	82%	0.818	62%	0.618	S	S	*	*			trans	-44.8	125	159.5	-75.3	-175.9	-13.4	0	0	106	T668 R672	T668-Q670 PolarHBondContact O-N 3.11Å; Q670-R672 PolarHBondContact O-N 3.18Å
671	H	33.3	Very low	52.1	Low	168 Å²	168	141.5 Å²	141.5	78%	0.778	66%	0.656	S	S	*	*			trans	-57.3	100.5	167.8	-92	-78.9	0	0	0	106.1	K669 I673	K669-H671 PolarHBondContact O-N 3.32Å; K669-H671 VanDerWaalsContact O-N 3.1Å; H671-I673 VanDerWaalsContact C-N 3.27Å; H671-I673 PolarHBondContact O-N 2.88Å
672	R	34	Very low	49.3	Very low	230 Å²	230	147.9 Å²	147.9	87%	0.868	69%	0.691	S	S	*	*			trans	-52.9	108.3	158.8	-79.7	-172	174.7	-176.8	-0.9	103.6	Q670 F674	Q670-R672 PolarHBondContact O-N 3.18Å; R672-F674 PolarHBondContact O-N 3.12Å
673	I	34.6	Very low	46.6	Very low	154 Å²	154	150 Å²	150	79%	0.79	70%	0.704	S	S	*	*			trans	-44.3	116.6	175	-64.6	167	0	0	0	104.4	H671 R675	H671-I673 VanDerWaalsContact C-N 3.27Å; H671-I673 PolarHBondContact O-N 2.88Å; I673-R675 PolarHBondContact O-N 3.45Å
674	F	32.4	Very low	44	Very low	183 Å²	183	148.2 Å²	148.2	80%	0.803	71%	0.714	S	S	*	*			trans	-62.1	96.1	172.3	-86.2	-84.9	0	0	0	104.7	R672 R676	R672-F674 PolarHBondContact O-N 3.12Å; F674-R676 VanDerWaalsContact C-N 3.25Å; F674-R676 PolarHBondContact O-N 2.92Å
675	R	35.3	Very low	41.6	Very low	231 Å²	231	151.3 Å²	151.3	87%	0.872	74%	0.736	S	S	*	*			trans	-49	106.8	155.6	-78.7	-171.1	178.5	-173.4	0.2	103	I673 R677	I673-R675 PolarHBondContact O-N 3.45Å; R675-R677 PolarHBondContact O-N 3.46Å
676	R	34.1	Very low	39.3	Very low	234 Å²	234	157.3 Å²	157.3	88%	0.883	76%	0.762	S	S	*	*			trans	-47.4	115.8	169	-82.3	-176.1	168.5	-153	-0.6	104.2	F674 S678	F674-R676 VanDerWaalsContact C-N 3.25Å; F674-R676 PolarHBondContact O-N 2.92Å; R676-S678 VanDerWaalsContact C-N 3.27Å; R676-S678 PolarHBondContact O-N 3.45Å
677	R	34	Very low	37.1	Very low	238 Å²	238	161 Å²	161	90%	0.898	79%	0.789	S	S	*	*			trans	-62.6	105	166.6	-86.3	-172.2	176.3	-177.2	-0.9	104.4	R675 I679	R675-R677 PolarHBondContact O-N 3.46Å; R677-I679 PolarHBondContact O-N 3.26Å
678	S	34	Very low	35.9	Very low	103 Å²	103	163.8 Å²	163.8	72%	0.72	79%	0.794	S	S	*	*			trans	-46.5	126	164.8	-53.4	0	0	0	0	106.8	R676 S680	R676-S678 VanDerWaalsContact C-N 3.27Å; R676-S678 PolarHBondContact O-N 3.45Å; S678-S680 PolarHBondContact O-N 3.43Å
679	I	37	Very low	34.8	Very low	151 Å²	151	166.4 Å²	166.4	77%	0.774	80%	0.802	S	S	*	*			trans	-75.3	80	-178.3	-61.3	172.5	0	0	0	107	R677 R681	R677-I679 PolarHBondContact O-N 3.26Å; I679-R681 PolarHBondContact O-N 3.04Å; I679-R681 VanDerWaalsContact O-N 3.11Å
680	S	33.3	Very low	34.4	Very low	114 Å²	114	164.6 Å²	164.6	80%	0.797	80%	0.797	S	S	*	*			trans	-84.4	55.7	170.5	50.5	0	0	0	0	110.5	S678	S678-S680 PolarHBondContact O-N 3.43Å
681	R	33.6	Very low	34.4	Very low	223 Å²	223	166.2 Å²	166.2	84%	0.842	80%	0.795	S	S	*	*			trans	-145.1	64.1	165.4	-70.5	-161.7	-174	-159.3	1.4	110.6	I679	I679-R681 PolarHBondContact O-N 3.04Å; I679-R681 VanDerWaalsContact O-N 3.11Å
682	L	33.2	Very low	34.6	Very low	156 Å²	156	163.1 Å²	163.1	82%	0.817	79%	0.792	S	S	*	*			trans	-120.8	80.7	154.2	-78.5	170.8	0	0	0	107.5	C684	L682-C684 PolarHBondContact O-N 2.99Å
683	N	30.1	Very low	34.8	Very low	171 Å²	171	159.6 Å²	159.6	91%	0.914	79%	0.788	S	S	*	*			trans	-72.8	102.3	155.6	-76.1	7.4	0	0	0	106.2
684	C	32.1	Very low	34.9	Very low	117 Å²	117	158.3 Å²	158.3	79%	0.791	79%	0.788	S	S	*	*			trans	-140.1	138.7	155.2	-157	0	0	0	0	108.1	L682	L682-C684 PolarHBondContact O-N 2.99Å
685	T	33.9	Very low	35	Very low	111 Å²	111	154 Å²	154	68%	0.681	78%	0.78	S	S	*	*			trans	-89.7	168	-165.9	47.6	0	0	0	0	112.6
686	N	33.2	Very low	35	Very low	156 Å²	156	148.3 Å²	148.3	83%	0.834	77%	0.771	S	S	*	*			trans	75.9	140.7	172.6	-42.5	-28.4	0	0	0	113.8
687	S	34.3	Very low	35	Very low	93 Å²	93	143.8 Å²	143.8	65%	0.65	77%	0.765	S	S	*	*			cis	160.3	141.3	-10.7	-178	0	0	0	0	103.3
688	I	37.1	Very low	35	Very low	152 Å²	152	138 Å²	138	78%	0.779	76%	0.756	S	S	*	*			trans	67.2	138.1	167.4	-65.6	153.6	0	0	0	114.3
689	M	36.2	Very low	35.2	Very low	145 Å²	145	139.9 Å²	139.9	71%	0.714	76%	0.756	S	S	*	*			cis	-152.1	134.3	-5.9	-116.6	167.6	172.9	0	0	105.3
690	Q	39.6	Very low	35.1	Very low	151 Å²	151	140.4 Å²	140.4	71%	0.706	76%	0.76	S	S	*	*				68	135.4	81.6	-145.4	-175.4	29.8	0	0	116.8
691	R	37.6	Very low	35.2	Very low	209 Å²	209	138.8 Å²	138.8	79%	0.789	76%	0.762	S	S	*	*			trans	88.8	142.1	172	-52	171.2	-166.5	-107.8	-0.3	117
692	S	36.9	Very low	35.2	Very low	103 Å²	103	133.7 Å²	133.7	72%	0.72	76%	0.76	S	S	*	*			cis	-167.9	135.8	-19.7	-95.9	0	0	0	0	112.2
693	M	37.4	Very low	35.1	Very low	156 Å²	156	131.8 Å²	131.8	77%	0.768	76%	0.759	S	S	*	*			trans	47.1	143.1	132.3	-63.8	-65.9	99	0	0	125.6
694	T	36.8	Very low	35.1	Very low	128 Å²	128	129.4 Å²	129.4	79%	0.785	76%	0.756	S	S	*	*			trans	72.6	148.1	145.7	45.7	0	0	0	0	120.7
695	S	35.6	Very low	35.1	Very low	93 Å²	93	129.4 Å²	129.4	65%	0.65	76%	0.757	S	S	*	*			cis	-172.1	147.9	-14.5	49.8	0	0	0	0	116.6
696	T	35.2	Very low	34.8	Very low	111 Å²	111	132 Å²	132	68%	0.681	77%	0.766	S	S	*	*			trans	67.2	133.9	134.7	54.8	0	0	0	0	125.9
697	N	34.8	Very low	34.8	Very low	139 Å²	139	131 Å²	131	74%	0.743	76%	0.759	S	S	*	*			trans	73.8	147.5	138.6	-63.8	1.8	0	0	0	119.7
698	T	32.7	Very low	34.4	Very low	117 Å²	117	134.8 Å²	134.8	72%	0.718	77%	0.772	S	S	*	*			cis	-168.2	-178.8	-12	22.9	0	0	0	0	108.6
699	I	38.3	Very low	34	Very low	141 Å²	141	132.8 Å²	132.8	72%	0.723	77%	0.772	S	S	*	*			trans	108.8	109.9	151.9	-55.5	176.4	0	0	0	118.1
700	N	35.4	Very low	33.8	Very low	162 Å²	162	130.9 Å²	130.9	87%	0.866	77%	0.773	S	S	*	*			trans	58.1	134.7	147.4	-57.4	-5.3	0	0	0	123.6
701	G	34.4	Very low	33.4	Very low	80 Å²	80	131.2 Å²	131.2	83%	0.825	77%	0.774	S	S	*	*			trans	155.4	89.5	166	0	0	0	0	0	113
702	S	33.6	Very low	33.1	Very low	116 Å²	116	128.7 Å²	128.7	81%	0.811	77%	0.769	S	S	*	*			trans	-86.4	177.7	-166.3	-54	0	0	0	0	116.2
703	C	31.3	Very low	32.8	Very low	116 Å²	116	131.5 Å²	131.5	78%	0.784	77%	0.771	S	S	*	*			trans	88.3	92.6	174.7	-56.9	0	0	0	0	114.3
704	S	31	Very low	32.4	Very low	122 Å²	122	129 Å²	129	85%	0.853	77%	0.765	S	S	*	*				62.6	123.4	66.2	-49.2	0	0	0	0	111.7
705	S	32.7	Very low	32.2	Very low	117 Å²	117	132.3 Å²	132.3	82%	0.818	77%	0.768	S	S	*	*			cis	-137.7	130.2	33.4	44.4	0	0	0	0	115.5
706	L	26.6	Very low	32.1	Very low	165 Å²	165	132.7 Å²	132.7	86%	0.864	77%	0.771	S	S	*	*			trans	-89.3	174.9	144.4	-69.2	160.8	0	0	0	106.2
707	I	33.5	Very low	31.9	Very low	135 Å²	135	132.5 Å²	132.5	69%	0.692	77%	0.774	S	S	*	*				-174.4	132.6	63.9	-79.6	-177.6	0	0	0	108.5	S709	I707-S709 WeakPolarHBondContact CG2-OG 3.38Å
708	N	26	Very low	32	Very low	172 Å²	172	131.3 Å²	131.3	92%	0.92	77%	0.772	S	S	*	*			trans	-77	131.5	150.6	-89.5	-20.1	0	0	0	108
709	S	28.4	Very low	32.1	Very low	111 Å²	111	132.1 Å²	132.1	78%	0.776	77%	0.772	S	S	*	*			trans	-153.3	113.6	166.1	-79.5	0	0	0	0	112.7	I707	I707-S709 WeakPolarHBondContact CG2-OG 3.38Å
710	S	33	Very low	32	Very low	105 Å²	105	131.8 Å²	131.8	73%	0.734	77%	0.771	S	S	*	*			trans	-100.8	120.9	155.4	53.3	0	0	0	0	108.1
711	E	30.7	Very low	32.1	Very low	158 Å²	158	131 Å²	131	74%	0.738	77%	0.767	S	S	*	*			trans	55.5	147.4	141.9	-64.6	178	147.2	0	0	119.9
712	F	30.6	Very low	32.2	Very low	156 Å²	156	131.3 Å²	131.3	68%	0.684	76%	0.757	S	S	*	*			cis	-163.5	163.8	30	-130	-56.5	0	0	0	110.7
713	Q	30.5	Very low	32.1	Very low	161 Å²	161	136 Å²	136	75%	0.752	76%	0.759	S	S	*	*			trans	75.9	139.7	157.5	-64.1	174.7	40.2	0	0	117
714	T	30	Very low	32.5	Very low	104 Å²	104	140.3 Å²	140.3	64%	0.638	76%	0.764	S	S	*	*			cis	-164.4	151.7	7.5	8.9	0	0	0	0	112.1
715	K	32.1	Very low	32.5	Very low	197 Å²	197	141.8 Å²	141.8	86%	0.857	76%	0.757	S	S	*	*			trans	67.2	147	158	-63.7	165.9	-176.5	179.5	0	116.1
716	S	32.2	Very low	32.5	Very low	101 Å²	101	142.4 Å²	142.4	71%	0.706	75%	0.75	S	S	*	*			cis	-165.4	159.5	1.3	40.8	0	0	0	0	110.9
717	S	32.1	Very low	32.8	Very low	107 Å²	107	142.9 Å²	142.9	75%	0.748	75%	0.745	S	S	*	*			trans	60.3	145.5	166.2	52.9	0	0	0	0	117.1
718	T	37.3	Very low	32.9	Very low	115 Å²	115	142.6 Å²	142.6	71%	0.706	74%	0.743	S	S	*	*			cis	-154.5	136.1	24.1	-27.9	0	0	0	0	112
719	D	34.7	Very low	33.2	Very low	133 Å²	133	141.4 Å²	141.4	71%	0.711	74%	0.736	S	S	*	*			trans	22.8	127.5	146.5	-45.7	-19	0	0	0	123.2
720	N	35.5	Very low	33.5	Very low	134 Å²	134	139.1 Å²	139.1	72%	0.717	73%	0.73	S	S	*	*				144.7	129.7	110.9	-83.6	-44	0	0	0	116.8
721	N	37.9	Very low	33.5	Very low	145 Å²	145	141.6 Å²	141.6	78%	0.775	74%	0.735	S	S	*	*			trans	68.9	145.7	152.2	-58.4	-26.3	0	0	0	121.4
722	S	37.4	Very low	33.4	Very low	87 Å²	87	139.7 Å²	139.7	61%	0.608	73%	0.734	S	S	*	*			cis	-173.8	148.5	-25.7	60.9	0	0	0	0	112
723	Y	31.4	Very low	33.4	Very low	216 Å²	216	143 Å²	143	85%	0.847	74%	0.744	S	S	*	*			trans	63.3	106.3	151.3	-70.5	-61.9	0	0	0	123.3
724	K	38.2	Very low	33.5	Very low	206 Å²	206	142.4 Å²	142.4	90%	0.896	75%	0.746	S	S	*	*				146.4	151.1	118.8	-82	173.6	-178	177	0	112.4
725	H	31.7	Very low	33.3	Very low	153 Å²	153	145.3 Å²	145.3	71%	0.708	75%	0.754	S	S	*	*			cis	-172.5	122.2	-26.9	-176.2	-111	0	0	0	109.7
726	L	33.3	Very low	33.4	Very low	129 Å²	129	142 Å²	142	68%	0.675	75%	0.745	S	S	*	*			trans	58.7	126.3	163.6	-58	-175.4	0	0	0	120.3
727	K	32.7	Very low	33.4	Very low	175 Å²	175	144.5 Å²	144.5	76%	0.761	75%	0.746	S	S	*	*				76.9	131.1	73	-118.5	178.7	167.2	-175	0	111.6
728	M	35.2	Very low	33.4	Very low	130 Å²	130	145.4 Å²	145.4	64%	0.64	74%	0.742	S	S	*	*			cis	-158.9	152.7	46.7	-71.2	-79.3	-89.6	0	0	113.4
729	N	32.6	Very low	33.1	Very low	147 Å²	147	148.4 Å²	148.4	79%	0.786	75%	0.746	S	S	*	*			trans	59.5	138.2	147.2	-53.3	-2	0	0	0	121.1
730	G	34.2	Very low	32.9	Very low	62 Å²	62	149.3 Å²	149.3	64%	0.639	75%	0.75	S	S	*	*			cis	-167.9	171.5	1.1	0	0	0	0	0	115.6
731	D	34	Very low	32.7	Very low	158 Å²	158	148.8 Å²	148.8	85%	0.845	75%	0.752	S	S	*	*			trans	50.9	103.7	153.9	-44.3	-26.8	0	0	0	118.6
732	V	26.7	Very low	32.3	Very low	118 Å²	118	148.3 Å²	148.3	72%	0.715	75%	0.754	S	S	*	*			cis	66	96.3	46.7	-169.3	0	0	0	0	114.7
733	Y	32.5	Very low	31.8	Very low	225 Å²	225	150.9 Å²	150.9	88%	0.882	76%	0.76	S	S	*	*				-162.9	96.7	128.9	-88.3	-66.6	0	0	0	107.7
734	N	31.8	Very low	31.8	Very low	149 Å²	149	146.3 Å²	146.3	80%	0.797	75%	0.754	S	S	*	*				84.5	111.2	90.3	-159.2	16.1	0	0	0	113.6
735	M	26.2	Very low	31.3	Very low	165 Å²	165	141.3 Å²	141.3	81%	0.813	75%	0.745	S	S	*	*			trans	-80.6	148	179.5	-75.4	-86.3	177.8	0	0	111.3
736	N	32.9	Very low	31.2	Very low	126 Å²	126	142.1 Å²	142.1	67%	0.674	75%	0.754	S	S	*	*				-169.5	131.3	125.2	-100.4	-22.1	0	0	0	115
737	H	33	Very low	31.2	Very low	154 Å²	154	142 Å²	142	71%	0.713	76%	0.758	S	S	*	*			trans	51.5	125.7	149.7	-46.2	-37.7	0	0	0	118.6
738	N	32.4	Very low	30.9	Very low	127 Å²	127	142.1 Å²	142.1	68%	0.679	76%	0.759	S	S	*	*			cis	-175	128.1	38.8	-126.7	-30.5	0	0	0	111.6
739	K	31	Very low	30.8	Very low	178 Å²	178	142.3 Å²	142.3	77%	0.774	77%	0.768	S	S	*	*			trans	40	125.1	147.2	-65.9	172.3	-177.3	169.9	0	122
740	N	29.5	Very low	30.6	Very low	152 Å²	152	141.1 Å²	141.1	81%	0.813	76%	0.761	S	S	*	*			trans	81.7	97.5	152.4	-56	-8.2	0	0	0	118.9
741	T	31.1	Very low	30.6	Very low	123 Å²	123	145.2 Å²	145.2	76%	0.755	77%	0.773	S	S	*	*				-179.4	125.9	115.8	-72.6	0	0	0	0	108.7	I743	T741-I743 HydrophobicContact CG2-CG1 4.22Å
742	V	31.1	Very low	30.3	Very low	134 Å²	134	145.1 Å²	145.1	81%	0.812	77%	0.771	S	S	*	*			trans	-96	106	173.6	177.7	0	0	0	0	109
743	I	27.3	Very low	30.5	Very low	142 Å²	142	149.6 Å²	149.6	73%	0.728	78%	0.775	S	S	*	*			trans	-119.6	122.3	154.5	-65.6	173.6	0	0	0	105.3	T741	T741-I743 HydrophobicContact CG2-CG1 4.22Å
744	T	31.4	Very low	30.5	Very low	120 Å²	120	145.6 Å²	145.6	74%	0.736	77%	0.769	S	S	*	*			trans	-130.9	88.3	167.5	48.8	0	0	0	0	108.6
745	S	26.2	Very low	30.4	Very low	100 Å²	100	143.1 Å²	143.1	70%	0.699	77%	0.77	S	S	*	*			trans	-61.1	134.7	147.4	48.4	0	0	0	0	108.6
746	L	30	Very low	30.8	Very low	171 Å²	171	144.2 Å²	144.2	90%	0.895	77%	0.773	S	S	*	*			trans	-126.3	134.7	160.3	-139.4	77.7	0	0	0	109.4
747	T	32.6	Very low	30.6	Very low	125 Å²	125	143.1 Å²	143.1	77%	0.767	78%	0.775	S	S	*	*			trans	-96	144	-170.2	43.7	0	0	0	0	112.1
748	K	27.8	Very low	30.5	Very low	179 Å²	179	144.2 Å²	144.2	78%	0.778	79%	0.785	S	S	*	*			trans	-9.2	128.3	154.4	-172.1	-177.5	-177.1	-173.5	0	117	D750	K748-D750 WeakPolarHBondContact CE-OD1 3.42Å
749	T	33.4	Very low	30.3	Very low	134 Å²	134	144.7 Å²	144.7	82%	0.822	79%	0.787	S	S	*	*			trans	-142.6	144.6	150.9	48.7	0	0	0	0	109.7
750	D	27.4	Very low	30.3	Very low	121 Å²	121	143.6 Å²	143.6	65%	0.647	79%	0.789	S	S	*	*			trans	-84.9	154.6	-166	-45.8	-84	0	0	0	113.9	K748	K748-D750 WeakPolarHBondContact CE-OD1 3.42Å
751	V	34.1	Very low	30.4	Very low	148 Å²	148	141.2 Å²	141.2	90%	0.897	78%	0.78	S	S	*	*			trans	-134.4	110.2	156.1	180	0	0	0	0	108.4
752	I	27.3	Very low	30.4	Very low	156 Å²	156	140.8 Å²	140.8	80%	0.8	78%	0.777	S	S	*	*			trans	-79.7	134.2	172.7	-64.9	160.8	0	0	0	108.1
753	R	32.5	Very low	30.4	Very low	213 Å²	213	143 Å²	143	80%	0.804	78%	0.776	S	S	*	*			trans	-157.2	114.6	146.8	-156.8	159.3	71.7	131.5	4.4	115.1
754	D	32.2	Very low	30.5	Very low	141 Å²	141	143.3 Å²	143.3	75%	0.754	78%	0.779	S	S	*	*			trans	63.8	139.4	149.9	-50.6	-14.9	0	0	0	120.8
755	A	28.9	Very low	30.6	Very low	97 Å²	97	144.6 Å²	144.6	80%	0.802	78%	0.78	S	S	*	*			trans	-138	147.8	-173.4	0	0	0	0	0	110.2
756	E	34.4	Very low	30.7	Very low	188 Å²	188	146.7 Å²	146.7	88%	0.879	78%	0.783	S	S	*	*			trans	-156.7	91.5	160.6	-101	169.5	-161.3	0	0	104.8
757	S	28.6	Very low	30.6	Very low	102 Å²	102	145.7 Å²	145.7	71%	0.713	78%	0.778	S	S	*	*				62.9	94.5	78.7	77.4	0	0	0	0	114.4
758	L	32.3	Very low	30.5	Very low	178 Å²	178	145.2 Å²	145.2	93%	0.932	78%	0.775	S	S	*	*			trans	-156.6	113.8	139.4	-110.2	154	0	0	0	109.6
759	D	27.1	Very low	30.5	Very low	136 Å²	136	144.6 Å²	144.6	73%	0.727	78%	0.78	S	S	*	*			trans	-75	160	176.6	-132.2	-35.7	0	0	0	111
760	L	31.6	Very low	30.4	Very low	156 Å²	156	144.7 Å²	144.7	82%	0.817	78%	0.775	S	S	*	*			trans	171.9	86.1	140.8	-92.4	169.4	0	0	0	111.2
761	T	31.2	Very low	30.5	Very low	102 Å²	102	146.2 Å²	146.2	63%	0.626	78%	0.783	S	S	*	*				27.6	144.4	125.3	64.7	0	0	0	0	120.7
762	V	30.3	Very low	30.4	Very low	114 Å²	114	144 Å²	144	69%	0.691	77%	0.772	S	S	*	*			cis	-174.8	161.7	3	127	0	0	0	0	109
763	K	31.2	Very low	30.5	Very low	179 Å²	179	144.8 Å²	144.8	78%	0.778	78%	0.776	S	S	*	*			trans	80.1	126.7	176.1	-67	145.3	-174.5	-178.8	0	116.6
764	D	30.5	Very low	30.3	Very low	150 Å²	150	137.5 Å²	137.5	80%	0.802	77%	0.768	S	S	*	*			cis	-138.8	128.7	-6.9	-78.9	-44.3	0	0	0	109.6
765	I	32.4	Very low	30.2	Very low	147 Å²	147	139.3 Å²	139.3	75%	0.754	78%	0.776	S	S	*	*			trans	-135.1	116.7	172.2	-64.3	176.8	0	0	0	107.6	L767	I765-L767 HydrophobicContact CG2-CB 3.85Å; I765-L767 HydrophobicContact CG2-CD1 3.85Å; I765-L767 HydrophobicContact CG2-CG 3.79Å
766	D	27.9	Very low	30.1	Very low	143 Å²	143	140.5 Å²	140.5	77%	0.765	77%	0.774	S	S	*	*			trans	-108.6	78.7	167	-154.7	-10.4	0	0	0	109.5
767	L	28.6	Very low	29.9	Very low	150 Å²	150	137.2 Å²	137.2	79%	0.785	77%	0.769	S	S	*	*			trans	-106.1	75.4	171.3	-82	174	0	0	0	109.4	I765 L769	I765-L767 HydrophobicContact CG2-CB 3.85Å; I765-L767 HydrophobicContact CG2-CD1 3.85Å; I765-L767 HydrophobicContact CG2-CG 3.79Å; L767-L769 VanDerWaalsContact C-N 3.32Å; L767-L769 PolarHBondContact O-N 3.1Å; L767-L769 VanDerWaalsContact O-N 3.08Å
768	T	30.8	Very low	30	Very low	116 Å²	116	139.7 Å²	139.7	71%	0.712	76%	0.763	S	S	*	*			trans	-83.9	75.1	173	37.8	0	0	0	0	111.8	N770	T768-N770 PolarHBondContact O-N 3.39Å
769	L	28.1	Very low	29.8	Very low	165 Å²	165	139.4 Å²	139.4	86%	0.864	75%	0.749	S	S	*	*			trans	-68.5	100.5	158.6	-109.2	163.4	0	0	0	108.8	L767	L767-L769 VanDerWaalsContact C-N 3.32Å; L767-L769 PolarHBondContact O-N 3.1Å; L767-L769 VanDerWaalsContact O-N 3.08Å
770	N	30.7	Very low	30	Very low	137 Å²	137	139.8 Å²	139.8	73%	0.733	75%	0.746	S	S	*	*			trans	-158.6	94.9	167.1	-92.8	-36.3	0	0	0	111.9	T768	T768-N770 PolarHBondContact O-N 3.39Å
771	N	29.2	Very low	29.9	Very low	152 Å²	152	141.6 Å²	141.6	81%	0.813	75%	0.748	S	S	*	*				179	150.3	107.3	-89.3	-31.6	0	0	0	112.5
772	P	32.1	Very low	29.8	Very low	103 Å²	103	146.4 Å²	146.4	67%	0.669	75%	0.754	S	S	*	*			trans	-107.3	-156	-168.5	37.5	-23	0	0	0	112.2
773	I	30.1	Very low	29.5	Very low	171 Å²	171	152.1 Å²	152.1	88%	0.877	76%	0.764	S	S	*	*			trans	79.4	134.4	177.2	-44.2	150.4	0	0	0	112.6
774	G	28.3	Very low	29.4	Very low	61 Å²	61	150.6 Å²	150.6	63%	0.629	76%	0.762	S	S	*	*			cis	167.5	148	-6.5	0	0	0	0	0	111.4
775	L	30.5	Very low	29.1	Very low	178 Å²	178	149.8 Å²	149.8	93%	0.932	76%	0.757	S	S	*	*			trans	42.9	129.9	153.8	-56.9	173.5	0	0	0	121.6
776	T	26.7	Very low	28.9	Very low	123 Å²	123	148.8 Å²	148.8	76%	0.755	76%	0.758	S	S	*	*			trans	-63.7	159.3	171.9	65	0	0	0	0	113.8
777	P	29.6	Very low	28.8	Very low	119 Å²	119	147.4 Å²	147.4	77%	0.773	76%	0.755	S	S	*	*				-139.4	137.3	84.5	33.7	-17.7	0	0	0	113
778	R	29.9	Very low	28.9	Very low	154 Å²	154	146.8 Å²	146.8	58%	0.581	76%	0.757	S	S	*	*				55.7	102.2	71.6	-146.9	-178.7	-160.9	-177	9.6	114.3	D504	D504-R778 PolarHBondContact O-NH2 3.29Å
779	R	30	Very low	28.8	Very low	171 Å²	171	144.5 Å²	144.5	65%	0.645	76%	0.757	S	S	*	*			trans	67.5	108.1	162.5	-68.7	177.3	165.9	149.4	1.8	119.3	D504	D504-R779 IonicContact OD2-CZ 3.2Å; D504-R779 IonicContact OD2-NH1 2.85Å; D504-R779 PolarHBondContact OD2-NH1 2.98Å; D504-R779 IonicContact OD2-NH2 2.67Å; D504-R779 PolarHBondContact OD2-NH2 2.9Å
780	E	31.1	Very low	28.8	Very low	144 Å²	144	144.8 Å²	144.8	67%	0.673	76%	0.759	S	S	*	*			trans	-133.7	109.1	136.8	-175	73.2	-146	0	0	108.8	R782	E780-R782 HydrophobicContact CG-CG 4.1Å; E780-R782 PolarHBondContact O-N 3.12Å; E780-R782 WeakPolarHBondContact OE1-CD 3.45Å; E780-R782 WeakPolarHBondContact OE1-CG 3.31Å; E780-R782 IonicContact OE1-CZ 3.61Å; E780-R782 IonicContact OE1-NE 3Å; E780-R782 PolarHBondContact OE1-NE 2.91Å; E780-R782 IonicContact OE1-NH2 3.85Å
781	K	28.1	Very low	28.9	Very low	195 Å²	195	145.6 Å²	145.6	85%	0.848	76%	0.763	S	S	*	*			trans	-86.6	91	171	-80.3	179.1	176.3	171.6	0	109.1
782	R	29.2	Very low	29	Very low	203 Å²	203	147.4 Å²	147.4	77%	0.766	77%	0.768	S	S	*	*			trans	-113.8	109.9	165.4	-78.6	-178.2	-176.2	-164.8	-8.9	112.1	E780 I784	E780-R782 HydrophobicContact CG-CG 4.1Å; E780-R782 PolarHBondContact O-N 3.12Å; E780-R782 WeakPolarHBondContact OE1-CD 3.45Å; E780-R782 WeakPolarHBondContact OE1-CG 3.31Å; E780-R782 IonicContact OE1-CZ 3.61Å; E780-R782 IonicContact OE1-NE 3Å; E780-R782 PolarHBondContact OE1-NE 2.91Å; E780-R782 IonicContact OE1-NH2 3.85Å; R782-I784 PolarHBondContact O-N 2.89Å
783	R	24.6	Very low	29	Very low	234 Å²	234	149.5 Å²	149.5	88%	0.883	77%	0.774	S	S	*	*			trans	-73.5	110	168.3	-60.5	163.7	77.8	164.9	4.9	107
784	I	28.8	Very low	28.9	Very low	147 Å²	147	145.6 Å²	145.6	75%	0.754	76%	0.762	S	S	*	*			trans	-115.7	111.7	158.1	-61.2	-178.4	0	0	0	105.9	R782	R782-I784 PolarHBondContact O-N 2.89Å
785	L	24	Very low	29.2	Very low	132 Å²	132	149.4 Å²	149.4	69%	0.691	77%	0.768	S	S	*	*			trans	-73.8	126.1	168	-88.5	75.5	0	0	0	107.7	V787	L785-V787 HydrophobicContact CB-CG2 4.43Å; L785-V787 HydrophobicContact CD2-CG2 4.03Å; L785-V787 HydrophobicContact CG-CG2 4.44Å
786	T	29.1	Very low	29.3	Very low	126 Å²	126	151.8 Å²	151.8	77%	0.773	77%	0.765	S	S	*	*			trans	-121.5	113.7	148.7	-51.6	0	0	0	0	106.9
787	V	25.4	Very low	29.6	Very low	115 Å²	115	152.8 Å²	152.8	70%	0.697	77%	0.765	S	S	*	*			trans	-108.6	116	-176	171	0	0	0	0	108.8	L785	L785-V787 HydrophobicContact CB-CG2 4.43Å; L785-V787 HydrophobicContact CD2-CG2 4.03Å; L785-V787 HydrophobicContact CG-CG2 4.44Å
788	T	30	Very low	29.7	Very low	137 Å²	137	152.4 Å²	152.4	84%	0.84	76%	0.76	S	S	*	*			trans	-153.1	119	167.3	47.5	0	0	0	0	108.5
789	G	30.1	Very low	29.9	Very low	68 Å²	68	156.1 Å²	156.1	70%	0.701	77%	0.774	S	S	*	*			cis	-177.3	112.8	-10	0	0	0	0	0	111.4
790	D	27.7	Very low	30	Very low	171 Å²	171	153.3 Å²	153.3	91%	0.914	78%	0.776	S	S	*	*			trans	-86.4	102.6	160.2	-86.5	-27.9	0	0	0	107.7
791	L	31.7	Very low	29.9	Very low	154 Å²	154	154.7 Å²	154.7	81%	0.806	78%	0.78	S	S	*	*			trans	-148.9	74.4	172.6	-151.1	79.4	0	0	0	114.3
792	M	31.5	Very low	30.1	Very low	189 Å²	189	151 Å²	151	93%	0.931	77%	0.773	S	S	*	*			trans	-126.7	63.6	153	-82.6	-100.6	100.5	0	0	109.5
793	N	32.2	Very low	30.2	Very low	148 Å²	148	153.1 Å²	153.1	79%	0.791	78%	0.782	S	S	*	*			trans	-158	129.1	133.3	-127.7	-20.3	0	0	0	111
794	S	28.4	Very low	30.4	Very low	88 Å²	88	144.7 Å²	144.7	62%	0.615	77%	0.768	S	S	*	*			trans	-90.1	176.5	-174.4	52	0	0	0	0	112.3
795	N	34.1	Very low	30.5	Very low	142 Å²	142	146.2 Å²	146.2	76%	0.759	77%	0.771	S	S	*	*			trans	77.4	88.4	161.7	-51.1	-29.5	0	0	0	117.9
796	R	33.3	Very low	30.8	Very low	228 Å²	228	147.9 Å²	147.9	86%	0.86	77%	0.773	S	S	*	*				176.1	117.4	93.7	-94.6	172.4	166.4	-166.9	-5.8	114.9
797	L	32	Very low	30.8	Very low	144 Å²	144	148.2 Å²	148.2	75%	0.754	78%	0.775	S	S	*	*			trans	47	103.4	132	-55.4	175.8	0	0	0	118.8
798	T	33	Very low	31	Very low	111 Å²	111	147.1 Å²	147.1	68%	0.681	77%	0.772	S	S	*	*				67.9	102.1	77.3	63.7	0	0	0	0	117.4
799	R	34.1	Very low	30.8	Very low	232 Å²	232	148 Å²	148	88%	0.875	77%	0.772	S	S	*	*				162.8	155.2	121.9	-91.1	-177.8	-114.6	-169.8	-4.1	110.1
800	V	31.5	Very low	30.9	Very low	112 Å²	112	151 Å²	151	68%	0.679	78%	0.777	S	S	*	*			cis	171.3	119.6	-30.3	134	0	0	0	0	104.9
801	F	29.3	Very low	30.9	Very low	173 Å²	173	149.6 Å²	149.6	76%	0.759	77%	0.769	S	S	*	*			trans	56.6	121.8	148.6	-68.4	-103.4	0	0	0	123.6
802	T	33	Very low	30.8	Very low	116 Å²	116	149.9 Å²	149.9	71%	0.712	77%	0.766	S	S	*	*				80	139.6	125.3	56.5	0	0	0	0	124
803	R	30.7	Very low	30.7	Very low	248 Å²	248	149 Å²	149	94%	0.936	76%	0.759	S	S	*	*			trans	60.7	136.2	159.4	-76.8	173.5	161	153.2	-7.3	115.3
804	G	28.2	Very low	30.6	Very low	57 Å²	57	146.9 Å²	146.9	59%	0.588	76%	0.757	S	S	*	*			cis	121.6	126.8	10.4	0	0	0	0	0	109.1
805	H	32	Very low	30.6	Very low	179 Å²	179	149.6 Å²	149.6	83%	0.829	76%	0.764	S	S	*	*			trans	67.5	155.9	-167.2	-53.7	-72.4	0	0	0	114
806	K	29.1	Very low	30.7	Very low	168 Å²	168	151.9 Å²	151.9	73%	0.73	77%	0.767	S	S	*	*			cis	-167.2	154.2	-26.7	-111.8	179.6	174.2	179.4	0	104.2
807	T	30.2	Very low	30.3	Very low	132 Å²	132	146 Å²	146	81%	0.81	76%	0.761	S	S	*	*			trans	60	157	158.3	48.1	0	0	0	0	116.7
808	S	29.7	Very low	30.3	Very low	92 Å²	92	146.5 Å²	146.5	64%	0.643	76%	0.764	S	S	*	*			cis	-170.4	135.3	-20.4	45.8	0	0	0	0	108.8
809	N	25	Very low	30.3	Very low	157 Å²	157	148.2 Å²	148.2	84%	0.84	77%	0.768	S	S	*	*			trans	56.2	174.4	151.8	-68.8	-0.3	0	0	0	120.7
810	V	32.4	Very low	30	Very low	131 Å²	131	143.8 Å²	143.8	79%	0.794	76%	0.762	S	S	*	*			trans	73.7	92.2	178.1	-160.9	0	0	0	0	112.4
811	N	26.8	Very low	30.1	Very low	141 Å²	141	144.7 Å²	144.7	75%	0.754	77%	0.767	S	S	*	*				81	152.1	56	-150.9	46.2	0	0	0	112.8
812	E	30.2	Very low	30.2	Very low	160 Å²	160	145 Å²	145	75%	0.748	77%	0.771	S	S	*	*			trans	70.4	146.5	179.8	-66	170.9	-172.5	0	0	116.3
813	Q	29.4	Very low	30.2	Very low	169 Å²	169	145.2 Å²	145.2	79%	0.79	77%	0.772	S	S	*	*			cis	162.7	159.9	-25	-110.6	-171.5	13.1	0	0	104.1
814	S	30.9	Very low	30.1	Very low	105 Å²	105	138.8 Å²	138.8	73%	0.734	77%	0.765	S	S	*	*			trans	70.3	154.2	171.3	91.8	0	0	0	0	115.8
815	N	28.8	Very low	30.3	Very low	144 Å²	144	145.1 Å²	145.1	77%	0.77	78%	0.777	S	S	*	*			cis	-166.3	174.5	-26	-106.1	-24.2	0	0	0	108.1
816	K	35.3	Very low	30.3	Very low	190 Å²	190	144.5 Å²	144.5	83%	0.826	77%	0.774	S	S	*	*			trans	81.8	109	175	-50.4	169.9	-176.8	177.1	0	113.4
817	S	26	Very low	30.3	Very low	104 Å²	104	143.7 Å²	143.7	73%	0.727	78%	0.777	S	S	*	*			cis	79.9	155.9	36.1	93.7	0	0	0	0	114.8
818	L	31.2	Very low	30.3	Very low	155 Å²	155	141.7 Å²	141.7	81%	0.812	77%	0.768	S	S	*	*			trans	82.5	133.7	-170.8	-49.7	167.5	0	0	0	113.6
819	L	32.2	Very low	30.4	Very low	147 Å²	147	142.8 Å²	142.8	77%	0.77	77%	0.771	S	S	*	*			cis	-149.7	160.2	1.6	-121.9	160.5	0	0	0	112.2
820	N	27.7	Very low	30.6	Very low	139 Å²	139	143.8 Å²	143.8	74%	0.743	77%	0.773	S	S	*	*			trans	-66.6	165.8	-179	-58.5	-48.1	0	0	0	113.5
821	T	33.4	Very low	30.4	Very low	131 Å²	131	140.6 Å²	140.6	80%	0.804	77%	0.767	S	S	*	*				-165	121.2	107	-67	0	0	0	0	110.5	V823	T821-V823 HydrophobicContact CG2-CG2 4.31Å
822	Q	32.5	Very low	30.7	Very low	180 Å²	180	141.6 Å²	141.6	84%	0.841	77%	0.771	S	S	*	*			trans	-87.3	143.8	162.7	-55.6	162.6	-65.7	0	0	108.6
823	V	32.5	Very low	30.7	Very low	121 Å²	121	139.8 Å²	139.8	73%	0.733	77%	0.766	S	S	*	*			trans	-143.4	122.9	145.2	-177.9	0	0	0	0	109.8	T821	T821-V823 HydrophobicContact CG2-CG2 4.31Å
824	S	27.9	Very low	30.8	Very low	113 Å²	113	136.8 Å²	136.8	79%	0.79	76%	0.756	S	S	*	*			trans	-99.6	142.6	159.8	-53.8	0	0	0	0	109.6
825	K	34.4	Very low	30.8	Very low	190 Å²	190	137.5 Å²	137.5	83%	0.826	75%	0.751	S	S	*	*			trans	-168	111.2	160.7	-99.3	155.7	-173.9	-175	0	104.3
826	Q	31.2	Very low	31	Very low	165 Å²	165	136.9 Å²	136.9	77%	0.771	75%	0.748	S	S	*	*				48.2	126.4	55.1	-83.2	-154	22.2	0	0	114.1
827	L	29.5	Very low	31.1	Very low	152 Å²	152	133.6 Å²	133.6	80%	0.796	74%	0.74	S	S	*	*			trans	66.4	146.4	165.2	-61.4	152.8	0	0	0	114.1
828	S	30	Very low	31.5	Very low	89 Å²	89	136.1 Å²	136.1	62%	0.622	75%	0.745	S	S	*	*			cis	-177.6	150.5	-10.2	46.2	0	0	0	0	109
829	V	30.3	Very low	31.5	Very low	116 Å²	116	131.9 Å²	131.9	70%	0.703	74%	0.739	S	S	*	*			trans	65.9	134.7	140	169.7	0	0	0	0	119.5
830	M	31.2	Very low	31.5	Very low	177 Å²	177	132.8 Å²	132.8	87%	0.872	74%	0.743	S	S	*	*			trans	62	129.2	167.9	-69.8	153	-178.4	0	0	115.4
831	G	28	Very low	31.5	Very low	65 Å²	65	132.8 Å²	132.8	67%	0.67	74%	0.743	S	S	*	*			cis	97.1	150.8	25	0	0	0	0	0	109.6
832	L	32.2	Very low	31.5	Very low	162 Å²	162	132.6 Å²	132.6	85%	0.848	74%	0.741	S	S	*	*			trans	75.7	139.5	-173.9	-51	-179.8	0	0	0	113.8
833	N	29.3	Very low	31.2	Very low	121 Å²	121	130.3 Å²	130.3	65%	0.647	74%	0.735	S	S	*	*			cis	-163.9	174	-21.7	-144.9	-0.7	0	0	0	110.9
834	N	31.5	Very low	30.9	Very low	106 Å²	106	129.6 Å²	129.6	57%	0.567	74%	0.735	S	S	*	*			trans	65	106.5	139	-75.6	-3.7	0	0	0	121.7
835	N	30.9	Very low	31	Very low	120 Å²	120	129.4 Å²	129.4	64%	0.642	73%	0.734	S	S	*	*				95.1	154.9	102	-69.9	-5.1	0	0	0	121
836	N	35	Very low	30.7	Very low	131 Å²	131	127.1 Å²	127.1	70%	0.701	73%	0.731	S	S	*	*			trans	85.4	133.2	158.1	-59.3	-24.2	0	0	0	116.5
837	N	35.4	Very low	30.8	Very low	121 Å²	121	126.5 Å²	126.5	65%	0.647	73%	0.733	S	S	*	*			cis	-169.8	157.5	-23.9	-117.8	-7.7	0	0	0	108.1
838	N	35.4	Very low	30.7	Very low	157 Å²	157	126.5 Å²	126.5	84%	0.84	73%	0.733	S	S	*	*			trans	65.7	139.1	164.6	-48.2	-23	0	0	0	115.5
839	G	31	Very low	30.9	Very low	66 Å²	66	130.7 Å²	130.7	68%	0.68	75%	0.748	S	S	*	*			cis	150.9	175	2.7	0	0	0	0	0	110
840	I	33.2	Very low	31	Very low	167 Å²	167	130.6 Å²	130.6	86%	0.856	74%	0.743	S	S	*	*			trans	76.1	77.3	170.9	-45.9	177.1	0	0	0	115
841	N	26.2	Very low	31.1	Very low	138 Å²	138	134.1 Å²	134.1	74%	0.738	75%	0.747	S	S	*	*			trans	-41.8	134.2	135.2	167.9	35.7	0	0	0	112.5
842	V	33.8	Very low	31.2	Very low	127 Å²	127	135.1 Å²	135.1	77%	0.77	74%	0.744	S	S	*	*			trans	-162.9	150	140	156.5	0	0	0	0	109.9
843	N	26.7	Very low	31.3	Very low	132 Å²	132	132.4 Å²	132.4	71%	0.706	74%	0.738	S	S	*	*			trans	-65.3	171.2	-178.6	-57.6	-56	0	0	0	115.9
844	S	26.2	Very low	31.6	Very low	106 Å²	106	133.3 Å²	133.3	74%	0.741	74%	0.743	S	S	*	*			trans	80	157.7	139.2	69.1	0	0	0	0	120.1
845	S	30.5	Very low	31.9	Very low	110 Å²	110	134.9 Å²	134.9	77%	0.769	75%	0.75	S	S	*	*			trans	91.6	130.4	164.9	-51.7	0	0	0	0	117.3
846	N	27.1	Very low	32.2	Very low	142 Å²	142	136.7 Å²	136.7	76%	0.759	76%	0.755	S	S	*	*			trans	-49.8	158.9	157.2	-48	-42.4	0	0	0	110.4
847	D	32.6	Very low	32.3	Very low	152 Å²	152	135.9 Å²	135.9	81%	0.813	75%	0.75	S	S	*	*				-169.8	152.4	102.6	-91	-26.1	0	0	0	112.6
848	N	28.8	Very low	32.5	Very low	151 Å²	151	137.2 Å²	137.2	81%	0.807	75%	0.751	S	S	*	*			trans	-72.2	149.9	171.2	-62.7	-59.1	0	0	0	110
849	L	34.8	Very low	32.6	Very low	177 Å²	177	134.7 Å²	134.7	93%	0.927	75%	0.745	S	S	*	*			trans	-129.8	115.9	150.1	-90.2	171.2	0	0	0	110.1
850	D	31.3	Very low	32.9	Very low	114 Å²	114	136.4 Å²	136.4	61%	0.61	75%	0.747	S	S	*	*			trans	-86.6	156.3	-179.5	178.8	40.9	0	0	0	111.1	S852	D850-S852 PolarHBondContact OD2-OG 2.94Å
851	W	34.3	Very low	33	Very low	251 Å²	251	134.1 Å²	134.1	95%	0.951	74%	0.741	S	S	*	*			trans	-137.6	116.5	161.1	-89.8	76.3	0	0	0	108.3
852	S	29.5	Very low	33.4	Very low	87 Å²	87	135 Å²	135	61%	0.608	75%	0.745	S	S	*	*			trans	-94.1	-161.7	-151.5	-39.1	0	0	0	0	115.1	D850	D850-S852 PolarHBondContact OD2-OG 2.94Å
853	S	34.3	Very low	33.6	Very low	104 Å²	104	135.5 Å²	135.5	73%	0.727	75%	0.748	S	S	*	*			trans	86.6	127.3	-178.1	69.7	0	0	0	0	115.5
854	D	35.4	Very low	33.8	Very low	141 Å²	141	139.7 Å²	139.7	75%	0.754	75%	0.754	S	S	*	*			cis	-159.7	154.4	4.5	-105.2	-17.7	0	0	0	114.1
855	I	36.6	Very low	34.2	Very low	139 Å²	139	143.8 Å²	143.8	71%	0.713	76%	0.758	S	S	*	*			trans	64.9	102.6	149.5	-60.7	163.9	0	0	0	117.7
856	E	37.3	Very low	34.3	Very low	157 Å²	157	144.1 Å²	144.1	73%	0.734	76%	0.755	S	S	*	*				58.2	130.8	100.8	-60	-166.4	159.7	0	0	115.3	K858	E856-K858 IonicContact OE2-NZ 3.89Å
857	D	37.5	Very low	34.6	Very low	114 Å²	114	142 Å²	142	61%	0.61	75%	0.752	S	S	*	*			cis	-160.3	158.3	48.5	-135.8	-2	0	0	0	119.4
858	K	39.2	Very low	34.7	Very low	149 Å²	149	141.3 Å²	141.3	65%	0.648	75%	0.748	S	S	*	*			trans	-9.6	146.4	165.3	-55.4	145.6	-169.2	109.3	0	119.1	E856	E856-K858 IonicContact OE2-NZ 3.89Å
859	S	38.4	Very low	34.8	Very low	105 Å²	105	142.5 Å²	142.5	73%	0.734	75%	0.746	S	S	*	*				-173.9	146.3	54.2	-52.7	0	0	0	0	116.1
860	S	37.6	Very low	34.8	Very low	101 Å²	101	139.5 Å²	139.5	71%	0.706	74%	0.74	S	S	*	*			trans	46.1	130.3	145.9	59.7	0	0	0	0	123.2
861	T	34.4	Very low	35	Very low	120 Å²	120	138.8 Å²	138.8	74%	0.736	74%	0.744	S	S	*	*			cis	104.2	146.4	19.4	64.5	0	0	0	0	117.2
862	L	35	Very low	35.2	Very low	157 Å²	157	132.8 Å²	132.8	82%	0.822	73%	0.73	S	S	*	*			trans	86.8	144.6	164.1	-53.6	140.2	0	0	0	116.5
863	V	38.6	Very low	35.4	Very low	136 Å²	136	135.2 Å²	135.2	82%	0.824	74%	0.737	S	S	*	*			cis	-154.9	172.6	-6.5	112	0	0	0	0	113.8
864	R	30.1	Very low	35.5	Very low	220 Å²	220	135.6 Å²	135.6	83%	0.83	74%	0.739	S	S	*	*			trans	-100.1	141.9	-168.8	176	-160.9	-62.9	143.2	-5.4	114.4
865	K	35.2	Very low	35.5	Very low	193 Å²	193	134.2 Å²	134.2	84%	0.839	74%	0.74	S	S	*	*			trans	174.2	113.7	150.3	-99.3	174.6	175.9	-177.8	0	109.8
866	T	33.5	Very low	35.4	Very low	116 Å²	116	131.9 Å²	131.9	71%	0.712	74%	0.742	S	S	*	*				78.3	136.5	76.4	60.7	0	0	0	0	117.9
867	S	32.9	Very low	35.2	Very low	97 Å²	97	131.5 Å²	131.5	68%	0.678	74%	0.744	S	S	*	*			trans	78	124.3	151.6	55.7	0	0	0	0	122.8
868	D	33.7	Very low	34.9	Very low	138 Å²	138	135.4 Å²	135.4	74%	0.738	76%	0.756	S	S	*	*			trans	66.3	149.9	140	-65.4	-34.4	0	0	0	120.2
869	K	32.1	Very low	34.7	Very low	177 Å²	177	136.3 Å²	136.3	77%	0.77	76%	0.762	S	S	*	*			cis	176.8	171.7	-23.4	-122.4	179.3	-175.9	170.1	0	105.5
870	S	33.9	Very low	34.6	Very low	114 Å²	114	137.6 Å²	137.6	80%	0.797	76%	0.76	S	S	*	*			trans	62.6	143.6	179.8	57.6	0	0	0	0	116.1
871	S	36	Very low	34.3	Very low	99 Å²	99	139.2 Å²	139.2	69%	0.692	76%	0.761	S	S	*	*			cis	145.3	161.2	-18.7	62	0	0	0	0	108.4
872	D	37.3	Very low	34.1	Very low	124 Å²	124	138.8 Å²	138.8	66%	0.663	76%	0.763	S	S	*	*			trans	114.3	101.1	159.9	-64.6	23.4	0	0	0	114.4
873	N	33.8	Very low	34.1	Very low	139 Å²	139	139.5 Å²	139.5	74%	0.743	77%	0.767	S	S	*	*				85.7	119.6	79.7	-69.1	-34.9	0	0	0	110.7
874	S	37	Very low	33.6	Very low	112 Å²	112	139.9 Å²	139.9	78%	0.783	76%	0.764	S	S	*	*				166.8	177.5	80.8	47.7	0	0	0	0	109.6
875	S	34.7	Very low	33.7	Very low	111 Å²	111	135.8 Å²	135.8	78%	0.776	77%	0.768	S	S	*	*				-176.9	137.2	-55.7	57.8	0	0	0	0	110.1
876	A	35.5	Very low	33.4	Very low	90 Å²	90	135.6 Å²	135.6	74%	0.744	77%	0.767	S	S	*	*			trans	-160.8	94.6	158.4	0	0	0	0	0	109.4
877	L	33.3	Very low	33.4	Very low	150 Å²	150	139.7 Å²	139.7	79%	0.785	78%	0.775	S	S	*	*				72.6	98.2	102.2	-72.1	164.6	0	0	0	112.9
878	K	31.9	Very low	33.5	Very low	195 Å²	195	141 Å²	141	85%	0.848	78%	0.779	S	S	*	*				66.5	149.3	62.3	-75.6	-169.6	171.8	179.3	0	115.2
879	Q	35	Very low	33.5	Very low	168 Å²	168	141 Å²	141	79%	0.785	78%	0.784	S	S	*	*			trans	90.3	127.5	172.4	-56.5	-167.7	41.5	0	0	114
880	L	34.8	Very low	34	Very low	133 Å²	133	137.8 Å²	137.8	70%	0.696	78%	0.781	S	S	*	*			cis	-143.2	155.7	7.8	-79.8	114	0	0	0	114.3
881	N	32.5	Very low	33.9	Very low	134 Å²	134	138.2 Å²	138.2	72%	0.717	78%	0.781	S	S	*	*			trans	30.1	122.4	140.7	-50.8	-6.2	0	0	0	119.7
882	S	28.5	Very low	33.6	Very low	111 Å²	111	145.2 Å²	145.2	78%	0.776	79%	0.792	S	S	*	*				59.5	96.2	63.1	-175	0	0	0	0	114.7
883	L	36.6	Very low	33.6	Very low	173 Å²	173	148.1 Å²	148.1	91%	0.906	80%	0.802	S	S	*	*			trans	-152.7	122.5	149.9	-108.3	169	0	0	0	109.9
884	D	28.4	Very low	33.5	Very low	144 Å²	144	147.4 Å²	147.4	77%	0.77	80%	0.803	S	S	*	*			trans	-61.9	146.3	171.1	-83.6	-64.8	0	0	0	112.1
885	C	32.2	Very low	33.4	Very low	134 Å²	134	147.8 Å²	147.8	91%	0.905	80%	0.8	S	S	*	*			trans	-154.2	125.1	136.4	-106.3	0	0	0	0	113.1
886	K	28.5	Very low	33.5	Very low	188 Å²	188	148.4 Å²	148.4	82%	0.817	79%	0.791	S	S	*	*			trans	-69.5	141.3	-179.6	-58.4	162.9	-178.7	172	0	111.1
887	K	32.7	Very low	33.4	Very low	203 Å²	203	150.2 Å²	150.2	88%	0.883	80%	0.795	S	S	*	*			trans	-153.9	80.2	147.9	-117.3	168.1	-173	177.2	0	113.5
888	T	35.1	Very low	34.1	Very low	123 Å²	123	150 Å²	150	76%	0.755	79%	0.789	S	S	*	*			trans	14.4	112.1	137.8	54.1	0	0	0	0	118.1
889	T	33.1	Very low	34.5	Very low	138 Å²	138	147.7 Å²	147.7	85%	0.847	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-68.2	128.1	158.4	-19.2	0	0	0	0	109.8
890	P	42.9	Very low	34.9	Very low	111 Å²	111	144 Å²	144	72%	0.721	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-77.5	153.2	175.4	31.7	-33.9	0	0	0	111.5
891	P	32.5	Very low	35.5	Very low	122 Å²	122	143.7 Å²	143.7	79%	0.792	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-79.8	145.1	-175.5	32.2	-34.9	0	0	0	113.1	Q893	P891-Q893 PolarHBondContact O-N 2.81Å; P891-Q893 VanDerWaalsContact O-N 3.1Å
892	R	28.9	Very low	35.7	Very low	246 Å²	246	145.2 Å²	145.2	93%	0.928	79%	0.793	S	S	*	*			trans	-23	100.8	160	-168.2	-176.4	-161.4	-175.6	3.3	114.5
893	Q	38.1	Very low	36.1	Very low	186 Å²	186	148 Å²	148	87%	0.869	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-94	139	163.4	-116.3	176.1	-6.6	0	0	110.7	P891	P891-Q893 PolarHBondContact O-N 2.81Å; P891-Q893 VanDerWaalsContact O-N 3.1Å
894	V	32.1	Very low	36.2	Very low	124 Å²	124	145 Å²	145	75%	0.752	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-81.4	119.2	-178.3	171.4	0	0	0	0	108.3
895	V	35.1	Very low	36.6	Very low	120 Å²	120	144 Å²	144	73%	0.727	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-89.8	130.7	169.7	179.7	0	0	0	0	108.9
896	Q	36	Very low	37	Very low	124 Å²	124	146.1 Å²	146.1	58%	0.579	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-76.9	155.1	-175.5	-70.9	-77.3	9.3	0	0	111.8	H898	Q896-H898 VanDerWaalsContact C-N 3.28Å; Q896-H898 PolarHBondContact O-N 2.84Å
897	P	33.7	Very low	37.3	Very low	128 Å²	128	140.5 Å²	140.5	83%	0.831	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	62.7	-173.1	34.8	-36.8	0	0	0	113.1
898	H	48.1	Very low	37.7	Very low	144 Å²	144	136.5 Å²	136.5	67%	0.667	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	-144.8	3	173	62.6	-82.8	0	0	0	116.3	Q896	Q896-H898 VanDerWaalsContact C-N 3.28Å; Q896-H898 PolarHBondContact O-N 2.84Å
899	E	39	Very low	37.7	Very low	148 Å²	148	138.4 Å²	138.4	69%	0.692	78%	0.777	S	S	*	*			trans	-123.6	37	-174.5	-60.4	-172.4	136.6	0	0	114
900	A	43.7	Very low	37.9	Very low	89 Å²	89	137.9 Å²	137.9	74%	0.736	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-92.9	129.8	173	0	0	0	0	0	111.1	L902	A900-L902 PolarHBondContact O-N 2.82Å
901	P	48.9	Very low	37.5	Very low	127 Å²	127	136 Å²	136	83%	0.825	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-64.4	132.9	172.2	-18.9	31.4	0	0	0	111.4
902	L	35.2	Very low	37.6	Very low	167 Å²	167	139.9 Å²	139.9	87%	0.874	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-59.8	134.9	163.2	-94.7	77.3	0	0	0	109.5	A900	A900-L902 PolarHBondContact O-N 2.82Å
903	L	37.5	Very low	38	Very low	168 Å²	168	134 Å²	134	88%	0.88	78%	0.777	S	S	*	*			trans	-166.4	116.2	145.8	-105.5	157.8	0	0	0	112.8
904	D	39.6	Very low	37.6	Very low	110 Å²	110	136.4 Å²	136.4	59%	0.588	78%	0.778	S	S	*	*			trans	43.5	114.6	156.6	-152.1	-12.4	0	0	0	122.5	F906	D904-F906 VanDerWaalsContact C-N 3.32Å; D904-F906 PolarHBondContact O-N 2.77Å; D904-F906 WeakPolarHBondContact OD1-CD2 3.42Å; D904-F906 PolarHBondContact OD1-N 3.27Å
905	P	36.8	Very low	37.7	Very low	125 Å²	125	138.2 Å²	138.2	81%	0.812	78%	0.783	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	-1.2	171.2	-15.3	31.2	0	0	0	117.3
906	F	39.7	Very low	37.6	Very low	177 Å²	177	143.2 Å²	143.2	78%	0.776	79%	0.789	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.1	12.2	-170.9	-68.2	-72.4	0	0	0	116.6	D904 S908	D904-F906 VanDerWaalsContact C-N 3.32Å; D904-F906 PolarHBondContact O-N 2.77Å; D904-F906 WeakPolarHBondContact OD1-CD2 3.42Å; D904-F906 PolarHBondContact OD1-N 3.27Å; F906-S908 PolarHBondContact O-N 3.36Å
907	G	35.6	Very low	37.7	Very low	71 Å²	71	144.7 Å²	144.7	73%	0.732	80%	0.799	S	S	*	*			trans	-67.1	94.9	175.5	0	0	0	0	0	114.1	D909	G907-D909 PolarHBondContact O-N 3.3Å
908	S	39.3	Very low	37.5	Very low	119 Å²	119	145.8 Å²	145.8	83%	0.832	80%	0.797	S	S	*	*			trans	-83.3	72.4	-173.6	64.9	0	0	0	0	114.4	F906	F906-S908 PolarHBondContact O-N 3.36Å
909	D	35.7	Very low	36.9	Very low	162 Å²	162	147.7 Å²	147.7	87%	0.866	81%	0.811	S	S	*	*			trans	-147.3	58.4	172.5	-140.7	2.2	0	0	0	115	G907	G907-D909 PolarHBondContact O-N 3.3Å
910	C	37.9	Very low	36.6	Very low	127 Å²	127	144.3 Å²	144.3	86%	0.858	82%	0.816	S	S	*	*	S	Bend	trans	-156	152.3	158.5	59.4	0	0	0	0	112.5
911	G	35	Very low	36.2	Very low	73 Å²	73	148.9 Å²	148.9	75%	0.753	82%	0.822	S	S	*	*			trans	-88.6	139.5	-166.7	0	0	0	0	0	116.1
912	K	34.1	Very low	35.5	Very low	203 Å²	203	149.9 Å²	149.9	88%	0.883	83%	0.826	S	S	*	*			trans	43.8	125.6	154.8	-62.6	174.7	-175.9	164.4	0	118.3
913	P	37.2	Very low	35.3	Very low	121 Å²	121	149 Å²	149	79%	0.786	82%	0.822	S	S	*	*				-129.7	156.7	122.6	33.1	-22.7	0	0	0	114.2
914	R	28.7	Very low	35.1	Very low	238 Å²	238	152.2 Å²	152.2	90%	0.898	82%	0.823	S	S	*	*			trans	-84.9	124.6	167.9	-61.8	162.2	82.8	171.1	6.5	107.6
915	L	34.9	Very low	34.7	Very low	161 Å²	161	154.2 Å²	154.2	84%	0.843	83%	0.833	S	S	*	*			trans	-128.6	147.7	160.6	-84.7	173.1	0	0	0	111
916	R	32.7	Very low	34.4	Very low	225 Å²	225	154.7 Å²	154.7	85%	0.849	83%	0.828	S	S	*	*			trans	-142	110.7	-172	-177.3	-152.3	-59.5	-159.6	5.5	106.4
917	I	38.6	Very low	34	Very low	155 Å²	155	151.1 Å²	151.1	80%	0.795	83%	0.825	S	S	*	*			trans	-132.8	142.9	177.4	-61.3	-176.1	0	0	0	109.2
918	L	29.8	Very low	33.8	Very low	151 Å²	151	155 Å²	155	79%	0.791	83%	0.828	S	S	*	*			trans	-81.7	157.2	-174.7	-73.4	74.1	0	0	0	112.5
919	L	35.7	Very low	33.4	Very low	184 Å²	184	154.4 Å²	154.4	96%	0.963	82%	0.824	S	S	*	*			trans	-165.3	151.5	137.2	-102.8	143.2	0	0	0	109.8
920	G	33.2	Very low	33.2	Very low	77 Å²	77	150.2 Å²	150.2	79%	0.794	82%	0.819	S	S	*	*			trans	116.8	95.6	174	0	0	0	0	0	114.8
921	Q	34.5	Very low	32.9	Very low	185 Å²	185	152 Å²	152	86%	0.864	82%	0.819	S	S	*	*			trans	-83.4	150.8	-177.6	-61.8	156.2	-27.6	0	0	112.5
922	T	34.1	Very low	32.6	Very low	148 Å²	148	153 Å²	153	91%	0.908	81%	0.814	S	S	*	*			trans	-170.9	149.4	131.4	16.7	0	0	0	0	111.4
923	N	30.8	Very low	32.6	Very low	148 Å²	148	148.5 Å²	148.5	79%	0.791	81%	0.808	S	S	*	*			trans	-90.4	142.7	-165.5	-62.8	-37.2	0	0	0	114.3
924	R	32.6	Very low	32.2	Very low	236 Å²	236	149.1 Å²	149.1	89%	0.891	81%	0.805	S	S	*	*			trans	172.5	96.8	136.1	-94	161.6	-164.9	-108	4.3	107.8
925	L	31.1	Very low	32.3	Very low	153 Å²	153	144.9 Å²	144.9	80%	0.801	80%	0.797	S	S	*	*				68	123.9	80.3	-77.9	168	0	0	0	115.5
926	N	32.2	Very low	32.1	Very low	134 Å²	134	146 Å²	146	72%	0.717	80%	0.795	S	S	*	*			trans	97.9	112.6	150.3	-63.2	-0.7	0	0	0	121.2
927	S	30.4	Very low	31.9	Very low	103 Å²	103	144.3 Å²	144.3	72%	0.72	79%	0.794	S	S	*	*			trans	66.3	138	135.7	66.7	0	0	0	0	119
928	L	31.9	Very low	31.6	Very low	152 Å²	152	144 Å²	144	80%	0.796	79%	0.794	S	S	*	*			cis	-129.7	142.5	3.6	-73.7	88.6	0	0	0	107.7
929	S	29.8	Very low	31.6	Very low	106 Å²	106	141 Å²	141	74%	0.741	78%	0.784	S	S	*	*			cis	74.2	110.7	42.5	79.8	0	0	0	0	115.4
930	G	31.3	Very low	31.5	Very low	74 Å²	74	138.8 Å²	138.8	76%	0.763	77%	0.773	S	S	*	*			trans	121.7	127.5	168.6	0	0	0	0	0	113.8
931	I	33.1	Very low	31.5	Very low	166 Å²	166	140.8 Å²	140.8	85%	0.851	77%	0.77	S	S	*	*			cis	-139.7	143.1	-2.6	-69.9	178.7	0	0	0	109.1
932	S	27.4	Very low	31.5	Very low	94 Å²	94	138 Å²	138	66%	0.657	77%	0.766	S	S	*	*			trans	-110.7	136.5	167.8	168.8	0	0	0	0	109.5
933	S	34.5	Very low	31.2	Very low	107 Å²	107	140.6 Å²	140.6	75%	0.748	76%	0.76	S	S	*	*			trans	-157.3	94.9	155.3	55.3	0	0	0	0	107.9
934	N	28.5	Very low	31.3	Very low	134 Å²	134	143 Å²	143	72%	0.717	76%	0.764	S	S	*	*				62.3	143	73.3	-88.2	-19.6	0	0	0	115.8
935	M	31	Very low	31.1	Very low	150 Å²	150	138.2 Å²	138.2	74%	0.739	76%	0.756	S	S	*	*			trans	84.3	137.4	164.9	-51.4	-147.8	171.1	0	0	116.1
936	K	31.6	Very low	31.1	Very low	183 Å²	183	138 Å²	138	80%	0.796	75%	0.754	S	S	*	*			cis	-151.9	157.1	2.9	-126.4	159.4	-176.1	163.1	0	111.9
937	F	28.9	Very low	31	Very low	191 Å²	191	136.5 Å²	136.5	84%	0.838	75%	0.754	S	S	*	*			trans	-59.1	152	173.4	-89.8	-111	0	0	0	113.1	P939	F937-P939 HydrophobicContact CD1-CG 4.24Å
938	N	30.3	Very low	31	Very low	147 Å²	147	138.4 Å²	138.4	79%	0.786	76%	0.756	S	S	*	*			trans	-143.3	110.3	135	-162.1	7	0	0	0	109.7
939	P	31.3	Very low	31	Very low	90 Å²	90	139.8 Å²	139.8	58%	0.584	76%	0.758	S	S	*	*			trans	-98.4	126	175.8	34.4	-24.4	0	0	0	110.1	F937	F937-P939 HydrophobicContact CD1-CG 4.24Å
940	N	33.5	Very low	31.1	Very low	136 Å²	136	144 Å²	144	73%	0.727	76%	0.763	S	S	*	*			trans	-154.6	132.9	163.4	-105.1	-27.5	0	0	0	111.8
941	T	33.3	Very low	31.1	Very low	119 Å²	119	147.5 Å²	147.5	73%	0.73	76%	0.764	S	S	*	*			trans	50.7	121.6	144.8	61.5	0	0	0	0	118.2
942	T	33	Very low	31	Very low	127 Å²	127	147 Å²	147	78%	0.779	76%	0.763	S	S	*	*			cis	-154.3	129.9	32.8	-60.1	0	0	0	0	111.8
943	Y	28.6	Very low	31.3	Very low	203 Å²	203	150 Å²	150	80%	0.796	77%	0.771	S	S	*	*			trans	-71.1	134.8	163.5	-97	-101.4	0	0	0	110.5
944	K	33.1	Very low	31	Very low	197 Å²	197	150 Å²	150	86%	0.857	78%	0.777	S	S	*	*			trans	-140.4	101.3	145.4	-113.5	-179.3	-178.2	-179.6	0	110	I946	K944-I946 PolarHBondContact O-N 3.4Å
945	N	29.1	Very low	30.9	Very low	136 Å²	136	147 Å²	147	73%	0.727	77%	0.767	S	S	*	*			trans	-66.2	123.6	162	-66.2	-36.5	0	0	0	108
946	I	31.1	Very low	30.9	Very low	149 Å²	149	148.8 Å²	148.8	76%	0.764	77%	0.773	S	S	*	*			trans	-130.9	105.3	146.1	-63.3	-176.2	0	0	0	106.4	K944 D948	K944-I946 PolarHBondContact O-N 3.4Å; I946-D948 PolarHBondContact O-N 2.81Å
947	S	29.1	Very low	30.8	Very low	102 Å²	102	149.5 Å²	149.5	71%	0.713	78%	0.779	S	S	*	*			trans	-65.5	117.1	154.5	47.7	0	0	0	0	108.2
948	D	30.3	Very low	30.8	Very low	143 Å²	143	145.3 Å²	145.3	77%	0.765	77%	0.774	S	S	*	*			trans	-175.9	160	140.5	-90.7	-26.5	0	0	0	110.5	I946	I946-D948 PolarHBondContact O-N 2.81Å
949	H	32.9	Very low	30.6	Very low	182 Å²	182	147 Å²	147	84%	0.843	78%	0.782	S	S	*	*			trans	97.4	50.3	-166.5	-59	-59.3	0	0	0	117
950	K	31.8	Very low	30.6	Very low	195 Å²	195	147.4 Å²	147.4	85%	0.848	79%	0.793	S	S	*	*			trans	-88.8	145.3	134.9	-82.1	-178.5	173.8	179	0	109
951	N	30.1	Very low	30.3	Very low	146 Å²	146	151.1 Å²	151.1	78%	0.781	80%	0.803	S	S	*	*	S	Bend	trans	77.6	139.9	-178.1	-50.6	-18.3	0	0	0	115.1
952	N	31.8	Very low	30	Very low	155 Å²	155	151.3 Å²	151.3	83%	0.829	81%	0.809	S	S	*	*			trans	67.6	81	178.4	-60.1	-11.3	0	0	0	117.8
953	L	32.8	Very low	29.7	Very low	159 Å²	159	151.4 Å²	151.4	83%	0.832	81%	0.813	S	S	*	*				-150.1	92.4	100.3	-157.3	69.2	0	0	0	111.3	S955	L953-S955 PolarHBondContact O-N 3.44Å
954	A	29	Very low	29.7	Very low	105 Å²	105	150.3 Å²	150.3	87%	0.868	82%	0.817	S	S	*	*			trans	-87.8	95.8	168.2	0	0	0	0	0	109.4
955	S	27.1	Very low	29.5	Very low	73 Å²	73	147.9 Å²	147.9	51%	0.51	82%	0.819	S	S	.	*			trans	-165.4	154.7	164	46	0	0	0	0	108.5	L953	L953-S955 PolarHBondContact O-N 3.44Å
956	H	30.5	Very low	29.6	Very low	186 Å²	186	146.6 Å²	146.6	86%	0.861	82%	0.821	S	S	*	*	S	Bend	trans	73.7	27.3	-171.7	-57.8	-81.7	0	0	0	118
957	Q	30.1	Very low	29.7	Very low	198 Å²	198	145.1 Å²	145.1	93%	0.925	82%	0.819	S	S	*	*			trans	-122.3	66.3	154.7	-75.4	-166.7	-0.6	0	0	111.9
958	S	27.2	Very low	30	Very low	103 Å²	103	149.7 Å²	149.7	72%	0.72	83%	0.826	S	S	*	*			trans	-156.4	92.4	169.1	60.7	0	0	0	0	111.6
959	L	27	Very low	30	Very low	183 Å²	183	149.3 Å²	149.3	96%	0.958	83%	0.83	S	S	*	*	S	Bend	trans	174.3	62.8	156.4	-98.4	156.3	0	0	0	111.6
960	A	31.1	Very low	30.1	Very low	99 Å²	99	145 Å²	145	82%	0.818	83%	0.826	S	S	*	*	S	Bend	trans	-166.2	22.9	163.9	0	0	0	0	0	114.4
961	K	28.1	Very low	30.3	Very low	214 Å²	214	142.5 Å²	142.5	93%	0.93	83%	0.827	S	S	*	*			trans	-144.9	73.4	175.9	-76	-168.2	177.9	-178.8	0	111.2
962	S	26.9	Very low	30.3	Very low	123 Å²	123	140.6 Å²	140.6	86%	0.86	83%	0.825	S	S	*	*			trans	-163.2	94.1	161.5	-172.6	0	0	0	0	110
963	C	27.1	Very low	30.4	Very low	128 Å²	128	141.5 Å²	141.5	87%	0.865	83%	0.828	S	S	*	*	S	Bend	trans	-168.5	38.3	153.7	-137.7	0	0	0	0	113.3
964	M	27.4	Very low	30.3	Very low	181 Å²	181	139.4 Å²	139.4	89%	0.892	82%	0.822	S	S	*	*			trans	-155.3	106	164.3	-80.5	-154.7	164.9	0	0	110.2
965	T	29.3	Very low	30.6	Very low	145 Å²	145	140.3 Å²	140.3	89%	0.89	82%	0.822	S	S	*	*			trans	165.6	110.3	135.9	40.7	0	0	0	0	111.4
966	S	31.9	Very low	30.8	Very low	110 Å²	110	146.1 Å²	146.1	77%	0.769	84%	0.838	S	S	*	*			trans	172	136.8	146.6	54.6	0	0	0	0	107.9
967	T	33.2	Very low	30.9	Very low	117 Å²	117	141 Å²	141	72%	0.718	84%	0.835	S	S	*	*			cis	-163.6	174.9	0.4	6	0	0	0	0	110.4
968	F	34.2	Very low	31	Very low	198 Å²	198	136.6 Å²	136.6	87%	0.868	83%	0.827	S	S	*	*			trans	91.8	92.6	163.3	-69.8	-71	0	0	0	120.4
969	T	30	Very low	31.2	Very low	136 Å²	136	136.8 Å²	136.8	83%	0.834	82%	0.823	S	S	*	*			trans	-91.4	136.9	154.1	47	0	0	0	0	111.7
970	A	36.1	Very low	31.6	Very low	92 Å²	92	135.1 Å²	135.1	76%	0.76	82%	0.816	S	S	*	*			trans	173.9	142.9	151.4	0	0	0	0	0	108.1
971	T	36.3	Very low	31.5	Very low	142 Å²	142	134.7 Å²	134.7	87%	0.871	81%	0.807	S	S	*	*			cis	-157.2	148.5	-7.9	13.1	0	0	0	0	107.5
972	S	28.6	Very low	31.8	Very low	105 Å²	105	131.6 Å²	131.6	73%	0.734	80%	0.799	S	S	*	*			trans	-76.8	144.6	172.9	174.5	0	0	0	0	111.6
973	L	34	Very low	31.9	Very low	174 Å²	174	132.4 Å²	132.4	91%	0.911	79%	0.793	S	S	*	*			trans	-153.8	153.6	144.4	-107.9	173.4	0	0	0	111.4
974	V	32.3	Very low	32	Very low	116 Å²	116	131.1 Å²	131.1	70%	0.703	79%	0.786	S	S	*	*			trans	-111.7	142.7	-162.5	168.5	0	0	0	0	111.3
975	S	34.5	Very low	32.3	Very low	123 Å²	123	129.8 Å²	129.8	86%	0.86	78%	0.781	S	S	*	*			trans	-164.3	167.8	139.7	-157.5	0	0	0	0	112.9
976	K	31.2	Very low	32.2	Very low	195 Å²	195	127.8 Å²	127.8	85%	0.848	77%	0.773	S	S	*	*			trans	-115.7	161.3	-162.9	-60.4	169.4	175.8	174.4	0	113.8
977	G	33	Very low	32.2	Very low	78 Å²	78	128.3 Å²	128.3	80%	0.804	78%	0.776	S	S	*	*			trans	87.8	157.9	155	0	0	0	0	0	115.7
978	S	32	Very low	32.1	Very low	107 Å²	107	126.6 Å²	126.6	75%	0.748	77%	0.769	S	S	*	*			cis	-158.7	145.4	-14.1	-162	0	0	0	0	110.1
979	T	31.6	Very low	32.1	Very low	106 Å²	106	127 Å²	127	65%	0.65	77%	0.766	S	S	*	*			trans	16.1	149.5	147.7	58.8	0	0	0	0	122.8
980	N	34.3	Very low	32.1	Very low	148 Å²	148	127.1 Å²	127.1	79%	0.791	76%	0.761	S	S	*	*			trans	93.9	136.6	159.6	-56.6	-16.4	0	0	0	115.3
981	S	29.9	Very low	32	Very low	91 Å²	91	130.2 Å²	130.2	64%	0.636	76%	0.763	S	S	*	*			cis	156.2	168.4	-17.3	48.9	0	0	0	0	106.4
982	I	34.1	Very low	32.1	Very low	148 Å²	148	128.5 Å²	128.5	76%	0.759	75%	0.754	S	S	*	*			trans	96.6	88.4	165	-52.5	160.2	0	0	0	116.3
983	N	29	Very low	32.4	Very low	140 Å²	140	131.6 Å²	131.6	75%	0.749	76%	0.761	S	S	*	*				46.6	123.4	116.9	-64.5	3.5	0	0	0	123.2
984	S	28.1	Very low	32.3	Very low	102 Å²	102	128.2 Å²	128.2	71%	0.713	75%	0.751	S	S	*	*				88.5	163	116.7	73.2	0	0	0	0	121.9
985	I	34.2	Very low	32.4	Very low	153 Å²	153	132.4 Å²	132.4	79%	0.785	76%	0.76	S	S	*	*			trans	82.7	122.3	177	-48.8	167.4	0	0	0	113
986	S	28.1	Very low	32.3	Very low	103 Å²	103	131.8 Å²	131.8	72%	0.72	75%	0.751	S	S	*	*			cis	140	127.9	-14.9	-82.2	0	0	0	0	108
987	S	30.8	Very low	32.4	Very low	120 Å²	120	128.9 Å²	128.9	84%	0.839	75%	0.745	S	S	*	*			trans	63.9	155.6	160.2	-101.2	0	0	0	0	117.7
988	S	30.9	Very low	32.3	Very low	81 Å²	81	138.6 Å²	138.6	57%	0.566	77%	0.766	S	S	*	*			cis	-169.1	-179	-4.1	29.9	0	0	0	0	109.4
989	Y	34.7	Very low	32.3	Very low	207 Å²	207	140.2 Å²	140.2	81%	0.812	77%	0.767	S	S	*	*			trans	86.7	115.4	172.2	-63.4	-87.2	0	0	0	116.2
990	I	30.8	Very low	32.3	Very low	139 Å²	139	142 Å²	142	71%	0.713	77%	0.773	S	S	*	*			cis	95.4	119.2	26	-59	179	0	0	0	114.8
991	I	33.2	Very low	32.2	Very low	156 Å²	156	141.7 Å²	141.7	80%	0.8	77%	0.772	S	S	*	*			trans	95.1	135.6	156.3	-84.1	162.3	0	0	0	119.6
992	P	37.7	Very low	32.4	Very low	106 Å²	106	144.6 Å²	144.6	69%	0.688	78%	0.78	S	S	*	*			trans	-116.4	-175.4	-163.1	43	-29	0	0	0	112.9
993	I	35.6	Very low	32.3	Very low	171 Å²	171	144.4 Å²	144.4	88%	0.877	78%	0.781	S	S	*	*			trans	-148.5	138.8	148.9	-94.3	130.1	0	0	0	109.4
994	S	31.5	Very low	32.5	Very low	102 Å²	102	144.7 Å²	144.7	71%	0.713	78%	0.783	S	S	*	*			trans	-79.8	153.2	175.9	49.7	0	0	0	0	112.9
995	K	35.5	Very low	32.8	Very low	204 Å²	204	147.8 Å²	147.8	89%	0.887	79%	0.788	S	S	*	*				-161.1	160	127.3	-112.7	170.7	-175.8	-178.3	0	113.2
996	T	31.1	Very low	32.7	Very low	110 Å²	110	147.4 Å²	147.4	68%	0.675	79%	0.788	S	S	*	*			trans	-100.2	177	-161.4	42.8	0	0	0	0	113.5
997	D	33.2	Very low	33.1	Very low	135 Å²	135	151.1 Å²	151.1	72%	0.722	79%	0.794	S	S	*	*			trans	101	86	148.8	-50.6	-49.1	0	0	0	117.7
998	F	31.8	Very low	33.3	Very low	282 Å²	282	153.9 Å²	153.9	100%	1.237	79%	0.79	S	S	*	*				-165.3	0	98.1	-113.4	-80.3	0	0	0	112.7

Retrieved 998 of 998 residues in 1127.5 ms (Link to these results)

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